Clc1cc2O[B-]3(Oc2cc1Cl)c1ccc(cc1)[B-]1(Oc2c(O1)cc(c(c2)Cl)Cl)[n+]1ccc(-c2ncnc(-c4cc[n+](cc4)[B-]4(c5ccc([B-]6([n+]7ccc(-c8nc(-c9cc[n+]3cc9)ncn8)cc7)Oc3c(O6)cc(c(c3)Cl)Cl)cc5)Oc3c(O4)cc(c(c3)Cl)Cl)n2)cc1 203
C1COCCOc2ccccc2OCCOCCOCCOc2c(OCCO1)cc1Cc3cc4c(cc3Cc1c2)[C@H]1c2c([C@@H]4c3c1cc1c(c3)OCCOCCOCCOc3c(OCCOCCOCCO1)cccc3)cccc2 3277
C1COCCOc2ccccc2OCCOCCOCCOc2c(OCCO1)cc1Cc3cc4c(cc3Cc1c2)[C@H]1c2c([C@@H]4c3c1cc1c(c3)OCCOCCOCCOc3c(OCCOCCOCCO1)cccc3)cccc2 5959
CC1(C)c2ccc([nH]2)[C@]2(C)c3ccc(cc3)OCCOc3c4cccc3Cc3cccc(Cc5c(OCCOc6ccc([C@@](c7[nH]c1cc7)(C)c1ccc([nH]1)C(c1[nH]c2cc1)(C)C)cc6)c(ccc5)Cc1cc(C4)ccc1)c3 8671
CC1(C)c2ccc([nH]2)[C@]2(C)c3ccc(cc3)OCCOc3c4cccc3Cc3cccc(Cc5c(OCCOc6ccc([C@@](c7[nH]c1cc7)(C)c1ccc([nH]1)C(c1[nH]c2cc1)(C)C)cc6)c(ccc5)Cc1cc(C4)ccc1)c3 11319
c1cc2cc3cccc4c3cc2c(c1)/N=C/c1ccc(-c2nc3ccccc3nc2-c2ccc([nH]2)/C=N/c2cccc3c2cc2c(/N=C/c5[nH]c(-c6c(-c7[nH]c(/C=N/4)cc7)nc4ccccc4n6)cc5)cccc2c3)[nH]1 13964
O[C@H]1[C@@H]2OC[C@H]([C@@H]1O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O[C@H]5OC[C@@H](O2)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]1O 16654
O[C@H]1[C@@H]2OC[C@H]([C@@H]1O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O[C@H]5OC[C@@H](O2)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]1O 19216
O[C@H]1[C@@H]2OC[C@H]([C@@H]1O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O[C@H]5OC[C@@H](O2)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]1O 21778
O=C1C=C2Cc3cccc4c3OCCOc3ccc(cc3)OCCNC(=O)c3cccc(C(=O)NCCOc5ccc(OCCOc6c(CC(=C1)C2=O)cccc6CC1=CC(=O)C=C(C4)C1=O)cc5)c3 24199
Cc1cc2cc(c1NC(=O)c1cccc(c1)C(=O)Nc1c(C)cc(cc1C)C1(CCCCC1)c1cc(c(NC(=O)c3cc(C(=O)Nc4c(cc(C52CCCCC5)cc4C)C)ccc3)c(c1)C)C)C 26560
O=C1N2CN3[C@H]4[C@H]5N(C3=O)CN3C(=O)N6[C@@]7([C@]3(N(CN5C(=O)N4CN3[C@H]2[C@@H]2N1CN1C(=O)N4[C@]5([C@]1(C)N(CN2C3=O)C(=O)N5Cc1c(C4)cccc1)C)C(=O)N7Cc1c(C6)cccc1)C)C 28899
Oc1c2cccc1Cc1cccc(c1O)Cc1cccc(c1O)Cc1cccc(c1O)Cc1c(c(Cc3c(c(Cc4c(c(Cc5c(c(C2)ccc5)O)ccc4)O)ccc3)O)ccc1)O 31116
CC1(C)c2[nH]c(c3c2S/C(=C\2/SC=CS2)/S3)C(C)(C)c2[nH]c(c3c2S/C(=C\2/SC=CS2)/S3)C(c2[nH]c(C(c3[nH]c1c1S/C(=C\4/SC=CS4)/Sc31)(C)C)c1S/C(=C\3/SC=CS3)/Sc21)(C)C 33319
CC1(C)c2[nH]c(c3c2S/C(=C\2/SC=CS2)/S3)C(C)(C)c2[nH]c(c3c2S/C(=C\2/SC=CS2)/S3)C(c2[nH]c(C(c3[nH]c1c1S/C(=C\4/SC=CS4)/Sc31)(C)C)c1S/C(=C\3/SC=CS3)/Sc21)(C)C 35538
CC1(C)c2[nH]c(c3c2S/C(=C\2/SC=CS2)/S3)C(C)(C)c2[nH]c(c3c2S/C(=C\2/SC=CS2)/S3)C(c2[nH]c(C(c3[nH]c1c1S/C(=C\4/SC=CS4)/Sc31)(C)C)c1S/C(=C\3/SC=CS3)/Sc21)(C)C 37757
Brc1cc2Cc3cc(Br)cc(c3)Cc3cc(Br)cc(c3)Cc3cc(Br)cc(c3)Cc3cc(cc(Cc4cc(Cc5cc(Cc6cc(Cc(c1)c2)cc(Br)c6)cc(Br)c5)cc(Br)c4)c3)Br 39942
[O-][C@H]1[C@@H]2OC[C@H]([C@@H]1[O-])O[C@H]1OC[C@H]([C@@H]([C@H]1[O-])[O-])O[C@H]1OC[C@H]([C@@H]([C@H]1[O-])[O-])O[C@H]1OC[C@H]([C@@H]([C@H]1[O-])[O-])O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O2)[C@H]([O-])[C@H]4[O-])[C@H]([O-])[C@H]3[O-])[C@H]([O-])[C@H]1[O-] 42266
[O-][C@H]1[C@@H]2OC[C@H]([C@@H]1[O-])O[C@H]1OC[C@H]([C@@H]([C@H]1[O-])[O-])O[C@H]1OC[C@H]([C@@H]([C@H]1[O-])[O-])O[C@H]1OC[C@H]([C@@H]([C@H]1[O-])[O-])O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O2)[C@H]([O-])[C@H]4[O-])[C@H]([O-])[C@H]3[O-])[C@H]([O-])[C@H]1[O-] 44550
O[C@H]1[C@@H]2OC[C@H]([C@@H]1O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O2)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]1O 46792
O[C@H]1[C@@H]2OC[C@H]([C@@H]1O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O2)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]1O 49034
O[C@H]1[C@@H]2OC[C@H]([C@@H]1O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O2)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]1O 51276
O[C@H]1[C@@H]2OC[C@H]([C@@H]1O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O2)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]1O 53518
O[C@@H]1[C@H]2OC[C@@H]([C@H]1O)O[C@@H]1OC[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1OC[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1OC[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1OC[C@H](O[C@@H]3OC[C@H](O[C@@H]4OC[C@H](O2)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]1O 55772
O[C@@H]1[C@H]2OC[C@@H]([C@H]1O)O[C@@H]1OC[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1OC[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1OC[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1OC[C@H](O[C@@H]3OC[C@H](O[C@@H]4OC[C@H](O2)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]1O 58026
[c-]12c3c4c5c1[C@H]1c6c7[C@@H]2c2c8[C@@H]3c3c9[C@@H]4c4c%10[C@@H]5c5c1c1c6c6c%11c7c2c2c7c8c3c3c8c9c4c4c9c%10c5c5c1c1c6c6c%11c2c2c7c3c3c8c4c4c9c5c1c1c6c2c3c41 60200
[C@H]12c3c4c5c6c3c3c7c2c2c8c1c1c4c4c9c1c1c8c8c%10c2c2c7c7c3c3c6c6c%11c5[c-]4c4c%11c5c%11c6c3c3c7c6c2c%10c2c7c8c1c1c9c4c4c1c7c1c2c6c3c%11c1c54 62262
[C@H]12c3c4[c-]5c6c1c1c7c2c2c8c3c3c4c4c9c5c5c6c6c1c1c%10c7c7c2c2c8c8c3c3c4c4c9c9c5c5c6c1c1c6c%10c7c7c2c2c8c3c3c4c4c9c5c1c1c6c7c2c3c41 64316
N\1=C/c2cc3/C=N/CC/N=C/c4cc5/C=N/CC/N=C/c6cc(/C=N/CC1)cc(/C=N/CC/N=C/c1cc(/C=N/CC/N=C/c(c2)c3)cc(c1)/C=N/CC/N=C/c(c4)c5)c6 66359
N\1=C/c2cc3/C=N/CC/N=C/c4cc5/C=N/CC/N=C/c6cc(/C=N/CC1)cc(/C=N/CC/N=C/c1cc(/C=N/CC/N=C/c(c2)c3)cc(c1)/C=N/CC/N=C/c(c4)c5)c6 68402
c1ccc2c(c1)[C@@H]1c3c4[C@H]2c2c1cc(cc2)Oc1ccc2c(n1)nc(cc2)Oc1ccc2c(c1)Cc1cc(Oc5nc6nc(Oc(c3)cc4)ccc6cc5)ccc1C2 70432
O=C1OCCC[C@]2(C)c3ccc([nH]3)C(C)(C)c3ccc([nH]3)[C@](CCCOC(=O)c3[nH]c4c5[nH]c1cc5c1ccccc1c4c3)(c1[nH]c(C(c3[nH]c2cc3)(C)C)cc1)C 72415
C[C@H]1c2ccc3c(c2)[C@@H](C)c2ccc(c(c2)[C@H](c2cc4[C@H](c5cc1c(OCCOCCOCCOCCOc4cc2)cc5)C)C)OCCOCCOCCOCCO3 74375
O=C1NCc2c3ccccc3c(c3c2cccc3)CNC(=O)c2cccc(c2)C(=O)NCc2c3c(c(CNC(=O)c4cc1ccc4)c1ccccc21)cccc3 76324
IC#Cc1c2OCCOc3c4Cc2cc2c1OCCOc1c(C2)cc2Cc5cc6Cc(c4)c(c3C#CI)OCCOc6c(c5OCCOc2c1C#CI)C#CI 78203
c1cc2COc3ccc4c(c3)[C@@H]3c5c([C@H]4c4c3cccc4)ccc(c5)OCc3cccc(COc4cc5Cc6cc(OCc(c1)c2)ccc6Cc5cc4)c3 80097
O[C@H]1[C@@H]2OC[C@H]([C@@H]1O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O2)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]1O 82019
O[C@H]1[C@@H]2OC[C@H]([C@@H]1O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1OC[C@@H](O[C@H]3OC[C@@H](O[C@H]4OC[C@@H](O2)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]1O 83941
O1CCOCCOc2ccc3cc2Cc2ccc(OCCOCC1)c(Cc1ccc4c(c1)Cc1cc(C3)c(OCCOCCOCCOCCO4)cc1)c2 85748
C1COc2ccc3c(c2)Cc2ccc4cc2Cc2c(C3)cc(OCCOc3ccc5Cc6cc(O1)ccc6Cc1cc(OCCO4)ccc1Cc5c3)cc2 87561
C1COc2ccc3c(c2)Cc2ccc4cc2Cc2c(C3)cc(OCCOc3ccc5Cc6cc(O1)ccc6Cc1cc(OCCO4)ccc1Cc5c3)cc2 89374
c1cc2COc3c4cccc3Cc3cccc(c3)Cc3cc(Cc5c(OCc(c1)c2)c(ccc5)Cc1cccc(c1)Cc1cc(C4)ccc1)ccc3 91187
O=C1C=C/C(=C/2\c3ccc([nH]3)/C(=C\3/C=CC(=O)C=C3)/c3ccc([nH]3)/C(=C\3/C=CC(=O)C=C3)/c3[nH]c(/C(=C/4\C=CC(=O)C=C4)/c4[nH]c2cc4)cc3)/C=C1 92986
Fc1c(F)c(C#C[C@]2(O)CC[C@@H]3[C@]2(C)CC[C@H]2[C@H]3CCc3c2cccc3)c(c(c1C#C[C@]1(O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCc2c1cccc2)F)F 94777
Oc1c2/C=N/[C@@H]3CCCC[C@H]3/N=C/c3cccc(c3O)/C=N/[C@H]3[C@H](/N=C/c4c(c(/C=N/[C@H]5[C@H](/N=C/c1ccc2)CCCC5)ccc4)O)CCCC3 96560
[SiH3]C#Cc1cc2c3c(c1)c1nc4c(ccc(c4nc1c1c3c(c3c2nc2c(ccc(c2n3)C#C[SiH3])C#C[SiH3])cc(c1)C#C[SiH3])C#C[SiH3])C#C[SiH3] 98309
O=C1NCCC(=O)NCC(=O)N2CCC[C@H]2C(=O)NCCC(=O)NCC(=O)NCCC(=O)NCC(=O)N2[C@H](C(=O)NCCC(=O)NC1)CCC2 100010
C[C@@H]1/C=C/C=C/C=C(\C)/CC[C@@H]2CC[C@H]([C@](O2)(O)C(=O)C(=O)N2[C@H](C(=O)OCCC(=O)[C@@H](/C=C(/[C@H](CC(=O)[C@@H](C1)C)O)\C)C)CCCC2)C 101746
C[C@@H]1/C=C/C=C/C=C(\C)/CC[C@@H]2CC[C@H]([C@](O2)(O)C(=O)C(=O)N2[C@H](C(=O)OCCC(=O)[C@@H](/C=C(/[C@H](CC(=O)[C@@H](C1)C)O)\C)C)CCCC2)C 103450
C[C@@H]1/C=C/C=C/C=C(\C)/CC[C@@H]2CC[C@H]([C@](O2)(O)C(=O)C(=O)N2[C@H](C(=O)OCCC(=O)[C@@H](/C=C(/[C@H](CC(=O)[C@@H](C1)C)O)\C)C)CCCC2)C 105154
C1C[C@H]2CO[C@@H]1O[C@H]1CC[C@H](OC1)O[C@H]1CC[C@H](OC1)O[C@H]1CC[C@H](OC1)O[C@H]1CC[C@@H](O[C@H]3CC[C@@H](O[C@H]4CC[C@@H](O2)OC4)OC3)OC1 106860
[NH2+]1Cc2cc3C[NH2+]Cc4cccc(n4)C[NH2+]Cc4cc(C[NH2+]Cc5nc(C1)ccc5)cc(C[NH2+]Cc1nc(C[NH2+]Cc(c2)c3)ccc1)c4 108533
Oc1c2cccc1Sc1cccc(c1O)Sc1cccc(c1O)Sc1c(c(Sc3c(c(Sc4c(c(S2)ccc4)O)ccc3)O)ccc1)O 110148
Oc1c2cccc1Cc1cccc(c1O)Cc1cccc(c1O)Cc1c(c(Cc3c(c(Cc4c(c(C2)ccc4)O)ccc3)O)ccc1)O 111769
Oc1c2cccc1Cc1cccc(c1O)Cc1cccc(c1O)Cc1c(c(Cc3c(c(Cc4c(c(C2)ccc4)O)ccc3)O)ccc1)O 113384
Oc1c2Cc3cc(Cc4cc(Cc5cc(Cc(c2)c2c1CNCO2)c(O)c1c5OCNC1)c(c1c4OCNC1)O)c(c1c3OCNC1)O 115001
O=P1Oc2c3Cc4c(O1)c(C)c1c(c4)Cc4cc5Cc6cc7Cc(c3)c(c2C)OP(=O)Oc7c(c6OP(=O)Oc5c(c4OP(=O)O1)C)C 116628
c1sc2c(c1)c1c(s2)sc2c1c1c(c3c2c2sc4c(c2c2c3sc3c2c2c(s3)scc2)c2c(s4)scc2)sc2c1c1ccsc1s2 118255
O=C1c2cc3O[B-]4(Oc3cc2C(=O)c2c1cc1O[B-]3(Oc1c2)Oc1c(O3)cc2c(c1)cccc2)Oc1c(O4)cc2c(c1)cccc2 119830
O=C1c2cc3O[B-]4(Oc3cc2C(=O)c2c1cc1O[B-]3(Oc1c2)Oc1c(O3)cc2c(c1)cccc2)Oc1c(O4)cc2c(c1)cccc2 121393
O1CCOCCOc2cccc3c2cccc3OCCOCCOCCOCCOc2c3c(c(OCCOCC1)ccc3)ccc2 122926
C1=CC2=CC=C3C4=C(C=CC(=C1)[C+]24)N[Si-2]12(O3)(NC3=C4C(=CC=C5[C+]4C(=CC=C5)C=C3)O2)NC2=C3C(=CC=C4[C+]3C(=CC=C4)C=C2)O1 124517
CN1c2cccc(n2)Nc2ncnc(c2)N(C)c2cccc(n2)Nc2cc(N(c3nc(Nc4cc1ncn4)ccc3)C)ncn2 126064
c1cc2c(s1)c1c3c4c2c2ccccc2c2c4c4c5c3c(c3c1scc3)c1ccccc1c5c1c(c4c3c2ccs3)scc1 127581
O=C1Nc2cccc(c2)CN2CCOCCOCCN(Cc3cc(NC(=O)c4cc1ccc4)ccc3)CCOCCOCC2 129058
O=C1NC(=O)c2cccc(c2)C(=O)NC(=O)c2cccc(c2)C(=O)NC(=O)c2cc(C(=O)NC(=O)c3cc1ccc3)ccc2 130549
O=C1CCOC(=O)CN(C)C(=O)[C@@H]2CSSC[C@H](N(C(=O)[C@@H](N1)C)C)C(=O)N(C)CC(=O)OCCC(=O)N[C@H](C(=O)N2C)C 132058
C[C@@H]1C/C=C/O[C@@]2(C)Oc3c(C2=O)c2c(O)cc(c(c2c(c3C)O)O)NC(=O)/C(=C\C=C\[C@@H]([C@@H]([C@H]([C@H]([C@H](C1)C)O)C)O)C)/C 133589
C[C@@H]1C/C=C/O[C@@]2(C)Oc3c(C2=O)c2C(=O)C=C(C(=O)c2c(c3C)O)NC(=O)/C(=C\C=C\[C@@H]([C@@H]([C@H]([C@H]([C@H](C1)C)O)C)O)C)/C 135121
Brc1c2OCOc3c4Cc2cc2c1OCOc1c(C2)cc2c(c1Br)OCOc1c(C2)cc2Cc(c4)c(c3Br)OCOc2c1Br 136606
Oc1ccc2cc1Cc1ccc(c(c1)Cc1ccc3c(Cc4cc(C2)c(OCCOCCOCCOCCO3)cc4)c1)O 138084
O=C1NCCOc2ccc(cc2)OCCOCCOCCOCCOc2ccc(OCCNC(=O)c3cc1ccc3)cc2 139520
Fc1c(F)c(F)c2c(c1F)c1nc3n4[BH-]5n1c2nc1-c2c(-c([n+]51)nc4c1c3c(F)c(F)c(c1F)F)c(F)c(c(c2F)F)F 140989
c1cc2nc(c1)Nc1ncnc(c1)Nc1cccc(n1)Nc1cc(Nc3nc(Nc4cc(N2)ncn4)ccc3)ncn1 142434
c1cc2ccc1Nc1ccc(cc1)Oc1nnc(nn1)Oc1ccc(Nc3ccc(Oc4nnc(O2)nn4)cc3)cc1 143845
c1cc2ccc1Cc1ccc(cc1)Cc1ccc(cc1)Cc1ccc(Cc3ccc(Cc4ccc(C2)cc4)cc3)cc1 145256
c1cc2c3cccc4c3c3c5c2c(c1)c1cccc2c1c5c1c5c3c3c4cccc3c3c5c(c4c1c2ccc4)ccc3 146673
c1cc2c3cccc4c3c3c5c2c(c1)c1cccc2c1c5c1c5c3c3c4cccc3c3c5c(c4c1c2ccc4)ccc3 148090
c1cc2Cc3cccc(c3)Cc3cccc(c3)Cc3cccc(Cc4cc(Cc5cc(Cc(c1)c2)ccc5)ccc4)c3 149503
O=C1CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)[C@H]2N(C(=O)[C@H]3N(C(=O)CN1)CCC3)CCC2 150933
CC1(C)c2ccc([nH]2)Cc2ccc([nH]2)C(C)(C)c2ccc([nH]2)Cc2[nH]c(C(c3[nH]c(Cc4[nH]c1cc4)cc3)(C)C)cc2 152372
C1C[C@H]2CO[C@@H]1O[C@H]1CC[C@H](OC1)O[C@H]1CC[C@H](OC1)O[C@H]1CC[C@@H](O[C@H]3CC[C@@H](O[C@H]4CC[C@@H](O2)OC4)OC3)OC1 153835
c1ccc2c(c1)c1[N-]c3n4[SiH2-2]56n1c2[N-]c1n5c(c2c1cccc2)[N-]c1n6c([N-]c4c2c3cccc2)c2c1cccc2 155270
O=C1NCC(=O)NCC(=O)N[C@@H]2CCCCNC(=O)[C@H](NC(=O)[C@H](CC1)NC(=O)[C@@H]1CCCN1C(=O)CNC2=O)C 156673
C1NCc2ccccc2OCCN2CCOc3c(CNCCN(C1)CCNCc1ccccc1OCC2)cccc3 158041
Oc1c2cccc1Cc1cccc(c1O)Cc1cccc(c1O)Cc1c(c(Cc3c(c(C2)ccc3)O)ccc1)O 159418
Oc1c2Cc3cc(Cc4cc(Cc5cc(Cc(c2)c(c1C)O)c(O)c(c5O)C)c(c(c4O)C)O)c(c(c3O)C)O 160771
Oc1c2Cc3cc(Cc4cc(Cc5cc(Cc(c2)c(c1Br)O)c(O)c(c5O)Br)c(c(c4O)Br)O)c(c(c3O)Br)O 162128
Oc1c(O)c2Cc3cc(Cc4cc(Cc5cc(Cc(c1O)c2)c(O)c(c5O)O)c(c(c4O)O)O)c(c(c3O)O)O 163485
O=C1O[C@]2(c3c1cccc3)c1cc3c(cc1Oc1c2cccc1)Oc1c([C@]23OC(=O)c3c2cccc3)cccc1 164840
O=C1C[NH2+]Cc2ccc(cc2)C[NH2+]CC(=O)NCCNC(=O)C[NH2+]Cc2ccc(C[NH2+]CC(=O)NCCN1)cc2 166201
O=C1CCCCCCCCC(=O)Nc2ccc(cc2)CNC(=O)c2cc(C(=O)NCc3ccc(N1)cc3)ccc2 167546
O1CCOCCSC2=C(SCCOCCOCCSC3=C(SCC1)S/C(=C\1/SC=CS1)/S3)S/C(=C/1\SC=CS1)/S2 168899
Cc1c2Cc3c(C)cc(c(c3C)Cc3c(C)cc(c(Cc4c(c(Cc1c(cc2C)C)c(C)cc4C)C)c3C)C)C 170262
C1Oc2cc3OCOc4c5Cc3cc2Cc2c(O1)cc1OCOc3c(Cc1c2)cc1Cc(c5)c(c4)OCOc1c3 171609
c1ccc2c(c1)N1CN(C2)c2c(C1)c1N3CN(Cc1c1c2CN2CN1Cc1c2cccc1)c1c(C3)cccc1 172959
c1ccc2c(c1)c1cc3cc4cc5c(cc4cc3cc1c1c2cccc1)c1ccccc1c1c5cccc1 174268
c1ccc2-c3ccccc3C34C(c2c1)(c1ccccc1-c1c4cccc1)c1ccccc1-c1c3cccc1 175548
O=P12c3c(Oc4c2cccc4)c2Oc4ccccc4P4(=O)c2c(c3Oc2c1cccc2)Oc1c4cccc1 176829
O=C1NCC(=O)NCC(=O)O[C@H](C)CC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NC1 178119
O=C1N2CN3[C@H]4[C@H]5N(C3=O)Cc3c(CN5C(=O)N4CN4[C@H]2[C@@H]2N1Cc1ccccc1CN2C4=O)cccc3 179419
O1[CH-]COCCOc2cccc(c2)OCCOCCOCCOCCOc2cc(OCCOCC1)ccc2 180688
O1CCOCCOc2cccc(c2)OCCOCCOCCOCCOc2cc(OCCOCC1)ccc2 181953
C[C@H]1OC2=N[C@@H]1C(=O)NCc1scc(n1)C(=O)NCC1=N[C@H](C(=O)NCc3nc(C(=O)NC2)cs3)[C@H](O1)C 183257
C[C@@H]1CC[C@@H]2CC[C@H]([C@](O2)(O)C(=O)C(=O)N2CCCC[C@H]2C(=O)OC[C@@H]([C@H](CC(=O)C/C=C(/C1)\C)O)C)C 184578
CN1CCc2c3[C@@H]1Cc1cccc(c1)Oc1ccc(cc1)C[C@H]1c4cc(Oc3ccc2)ccc4CCN1C 185862
O=C1NCC(=O)N2CCC[C@H]2c2scc(n2)C(=O)NCC(=O)N2[C@H](C(=O)NCC3=N[C@H]1[C@@H](C)O3)CCC2 187163
c1cc2cc(c1)oc1cc3ccccc3cc1oc1cc(oc3c(o2)cc2ccccc2c3)ccc1 188405
c1cc2[n-]c1[CH+]c1ccc([n-]1)[CH+]c1ccc([nH]1)[CH+]c1ccc([CH+]c3[n-]c([CH+]c4[nH]c([CH+]2)cc4)cc3)[n-]1 189660
[SiH3]C#Cc1c2cc3c(cc2c(c2c1cc1c(c2)c(F)c(c(c1F)F)F)C#C[SiH3])c(F)c(c(c3F)F)F 190889
[Se]1Cc2cccc(c2)C[Se]Cc2cccc(c2)C[Se]Cc2cc(C[Se]Cc3cc(C1)ccc3)ccc2 192110
Oc1cc(O)c2cc1Cc1cc(Cc3cc(Cc4cc(C2)c(O)cc4O)c(cc3O)O)c(cc1O)O 193327
O=C1NCCCCNC(=O)c2cccc(n2)C(=O)NCCCCNC(=O)COc2cc(OC1)ccc2 194536
O1Cc2cccc(c2)COCc2cccc(c2)COCc2cc(COCc3cc(C1)ccc3)ccc2 195743
O1BO[B-]2(OB1)Oc1c(-c3c(O2)c2c(cc3)ccc3c2cccc3)ccc2c1c1ccccc1cc2 196960
N#Cc1c2[C@@H]3c4ccccc4[C@H](c2cc2c1[C@@H]1c4ccccc4[C@H]2c2c1cccc2)c1c3cccc1 198188
Cl[C@]12C[C@]([C@@H]3[C@H]1C[C@H]1[C@@H](C3)[C@@]3(C[C@@]1(Cl)c1c3nc3c(n1)cccc3)Cl)(c1c2nc2ccccc2n1)Cl 199443
C[Si]1(C)c2cccc(c2)[Si](C)(C)c2cccc(c2)[Si](c2cc([Si](c3cc1ccc3)(C)C)ccc2)(C)C 200678
C1=CC2=N/C/1=C\c1ccc([nH]1)/C=c\1/cc/c(=C/C3=N/C(=C\c4[nH]c(/C=c/5\[nH]/c(=C\2)/cc5)cc4)/C=C3)/[nH]1 201935
C1=C=[C-]c2cccc3c2cc2c(cccc2c3)[C-]=C=C=[C-]c2c3cc4c([C-]=1)cccc4cc3ccc2 203160
C1=C=[C-]c2cccc3c2cc2c(cccc2c3)[C-]=C=C=[C-]c2c3cc4c([C-]=1)cccc4cc3ccc2 204385
c1ccc2c(-c3nc4ccccc4nc3-c3c(C42c2ccccc2-c2c4cccc2)cccc3)c1 205596
c1cc2ccc1Cc1ccc(cc1)Cc1ccc(cc1)Cc1ccc(Cc3ccc(C2)cc3)cc1 206772
c1cc2c3cccc4c3c3c5c2c(c1)c1cccc2c1n5c1c3c3c4cccc3c3c1c2ccc3 207952
c1cc2Cc3cccc(c3)Cc3cccc(c3)Cc3cc(Cc4cc(Cc(c1)c2)ccc4)ccc3 209130
c1ccc2c(c1)c1cc3cc4c(cc3cc1c1c2cccc1)c1ccccc1c1c4cccc1 210305
c1ccc2c(c1)c1cc3cc4c(cc3cc1c1c2cccc1)c1ccccc1c1c4cccc1 211448
c1ccc2c(c1)[C@@H]1c3c([C@H]2c2c1cccc2)cc1c(c3)[C@@H]2c3c([C@H]1c1c2cccc1)cccc3 212615
O[C@H]1C[C@@H](O)[C@@]2(O[C@H]1Oc1c2cc(c2c1C(=O)c1cc3C[C@@](C)(O)CCc3c(c1C2=O)O)O)C 213787
O=C1N[C@@H]2[C@@H]3N1Cc1c(ccc(c1CN3C(=O)N2)C#Cc1ccncc1)C#Cc1ccncc1 214942
O=C1N[C@@H]2[C@@H]3N1Cc1c(ccc(c1CN3C(=O)N2)C#Cc1cccnc1)C#Cc1cccnc1 216097
O=C1NCCNCCNC(=O)c2cccc(n2)C(=O)NCCNCCNC(=O)c2nc1ccc2 217238
O=C1NC(=O)c2c3c1cc(Cl)c1c3c(c(c2)Cl)c2c3c1c(Cl)cc1c3c(cc2Cl)C(=O)NC1=O 218397
C1CNCc2cccc3c2SCCSc2c(CNCCN1)cccc2CNCCNCCNC3 219534
B1Oc2c3cccc2Cc2cccc4c2OBOc2c(Cc5c(O1)c(C3)ccc5)cccc2C4 220679
O=C1NC(=O)c2cccc(c2)C(=O)NC(=O)c2cc(C(=O)NC(=O)c3cc1ccc3)ccc2 221829
c1ccc2-c3ccc(-c4ccccc4-c4ccc(/C=C\c5ccc(-c2c1)cc5)cc4)cc3 222943
c1cc2cc(c1)Cc1cccc3c1OP1Oc4c(C2)cccc4Cc2c(O1)c(C3)ccc2 224022
[SiH3]C#Cc1c2cc3cc4ccccc4cc3cc2c(c2c1cc1ccccc1c2)C#C[SiH3] 225106
[OH2+]c1c2cccc1Cc1cccc(c1[OH2+])Cc1c(c(Cc3c(c(C2)ccc3)[OH2+])ccc1)[OH2+] 226205
[O-]c1c2cccc1Cc1cccc(c1[O-])Cc1c(c(Cc3c(c(C2)ccc3)[O-])ccc1)[O-] 227294
[O-]c1c2cccc1Cc1cccc(c1O)Cc1c(c(Cc3c(c(C2)ccc3)O)ccc1)O 228374
[O-][C@@H]1[C@H]2O[C@@]32Cc2cccc(c2)Cc2cccc(Cc4cc(C[C@]5([C@H]1O5)C3=O)ccc4)c2 229477
Oc1c2cccc1Sc1cccc(c1O)Sc1c(c(Sc3c(c(S2)ccc3)O)ccc1)O 230554
Oc1c2cccc1Cc1cccc(c1O)Cc1c(c(Cc3c(c(C2)ccc3)O)ccc1)O 231635
Oc1c2c[c-]cc1Cc1cccc(c1O)Cc1c(c(Cc3c(c(C2)ccc3)O)ccc1)O 232715
O=c1[nH]c(=O)c2c1c(C#Cc1ccccc1)c1c(=O)[nH]c(=O)c1c2C#Cc1ccccc1 233802
O=C1NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NC1 234883
O1Cc2cccc(c2)Cc2cccc(c2)COCc2cc(Cc3cc(C1)ccc3)ccc2 235958
Cc1cc2cc(c1)Cc1cccc(c1O)Cc1cc(Cc3c(c(C2)ccc3)O)cc(c1)C 237037
Cc1cc2Cc3cc(C)cc(c3)Cc3cc(cc(Cc4cc(Cc(c1)c2)cc(C)c4)c3)C 238118
C[C@H]1CC2=[N+]3C1=Cc1c(C)cc4n1[*@@]13n3c5=C2CC(=O)c5c(c3=CC2=[N+]1C(=C4)C(=C2)C)C 239225
C[C@@H]1c2cccc(c2)[C@H](C)c2cccc(c2)[C@@H](c2cc([C@@H](c3cc1ccc3)C)ccc2)C 240323
CN1CC[C@@]23[C@]41c1cccc5c1c([C@]4(O)[C@@H](C2)c1c(C3=O)cc2c(n1)cccc2)ccc5 241422
CC1(C)c2ccc([nH]2)C(C)(C)c2ccc([nH]2)C(c2[nH]c(C(c3[nH]c1cc3)(C)C)cc2)(C)C 242521
C1COCCOc2ccccc2OCCOCCOCCOc2c(OCCO1)cccc2 243586
C1COCCOc2cccc(c2)OCCOCCOCCOc2cc(OCCO1)ccc2 244653
Brc1cc2Cc3cc(Br)cc(c3)Cc3cc(cc(Cc4cc(Cc(c1)c2)cc(Br)c4)c3)Br 245738
c1ccc2c(c1)c1nc3c4ccccc4c4n3[BH-]3n1c2nc1-c2ccccc2-c([n+]31)n4 246829
c1ccc2c(c1)c1nc3=[N+]4[BH-]5n1c2n[c+]1[N+]5=c(c2c1cccc2)nc4c1c3cccc1 247890
c1ccc2c(c1)c1[n-]c3n4[BH-]5n1c2[n-]c1n5c(c2c1cccc2)[n-]c4c1c3cccc1 248949
c1ccc2c(c1)c1N=c3n4[BH-]5n1c2[N-]c1n5c(c2c1cccc2)N=c4c1c3cccc1 250004
[SiH3]C#C[c-]1c2sc3c(c2c2c1cccc2)sc1c3sc2c1c1c([c-]2C#C[SiH3])cccc1 251064
Oc1c2cccc1Cc1cccc(c1O)Cc1c(c(Cc3cc(C2)ccc3)ccc1)O 252111
O=C1NCc2c1c1c3ccccc3n3c1c1c2c2ccccc2n1[C@]1(O[C@@H]3CCC1)C 253162
O=C1NC(=O)C2=C1S[C@]13C(=O)NC(=O)[C@]3(S2)[C@H]2c3c([C@]1(Br)c1ccccc21)cccc3 254231
IC#Cc1ccc(cc1)C#Cc1c(F)cc(c(c1F)C#Cc1ccc(cc1)C#CI)F 255278
IC#Cc1ccc(cc1)C#Cc1c(F)cc(c(c1F)C#Cc1ccc(cc1)C#CI)F 256324
C[C@H]1CC[C@H](O)[C@H](C)/C=C(\C)/CC/C=C/C=C(\C(=O)NC2=C(C(=O)C=C(C1)C2=O)C)/C 257397
C[C@H]1CC[C@H](O)[C@H](C)/C=C(\C)/CC/C=C/C=C(\C(=O)NC2=C(C(=O)C=C(C1)C2=O)C)/C 258468
C[C@@H]1CC[C@]2([C@@H](C1)C1=CC(=O)[C@H]3[C@@]([C@@]1(CC2)C)(C)CC[C@@H]1[C@]3(C)CC[C@@H](C1(C)C)O)C 259560
C[C@@H]1CC[C@]2([C@@H](C1)C1=CC(=O)[C@H]3[C@@]([C@@]1(CC2)C)(C)CC[C@@H]1[C@]3(C)CC[C@@H](C1(C)C)O)C 260652
C1=CC2=CC=C3C4=C(C=CC(=C1)[C+]24)O[B@@-]1(O3)OC2=CC=C3[C+]4C2=C(O1)C=CC4=CC=C3 261723
C1=CC2=CC=C3C4=C(C=CC(=C1)[C+]24)O[B@@-]1(N3)NC2=CC=C3[C+]4C2=C(O1)C=CC4=CC=C3 262794
C1=CC2=CC=C3C4=C(C=CC(=C1)[C+]24)O[B@@-]1(N3)NC2=C3C(=CC=C4[C+]3C(=CC=C4)C=C2)O1 263867
C1=CC2=CC=C3C4=C(C=CC(=C1)[C+]24)O[B@-]1(O3)OC2=CC=C3[C+]4C2=C(O1)C=CC4=CC=C3 264937
C1=CC2=CC=C3C4=C(C=CC(=C1)[C+]24)O[B@-]1(N3)NC2=C3C(=CC=C4[C+]3C(=CC=C4)C=C2)O1 266009
C1=CC2=CC=C3C4=C(C=CC(=C1)[C+]24)N[B@@-]1(O3)NC2=C3C(=CC=C4[C+]3C(=CC=C4)C=C2)O1 267082
C1=CC2=CC=C3C4=C(C=CC(=C1)[C+]24)N[B@-]1(O3)NC2=C3C(=CC=C4[C+]3C(=CC=C4)C=C2)O1 268154
c1ccc2c(c1)c1cc3c(cc1c1c2cccc1)c1ccccc1c1c3cccc1 269195
c1ccc2c(c1)c(C#Cc1ccccc1)c1c(c2C#Cc2ccccc2)cccc1 270204
c1ccc2c(c1)[C-]=C=C=[C-]c1ccccc1[C-]=C=C=[C-]c1c([C-]=C=C=[C-]2)cccc1 271234
c1cc2/N=N/c3cccc(c3)Cc3cccc(/N=N/c4cc(Cc(c1)c2)ccc4)c3 272249
[SiH3]C#Cc1c2ccc3c4c2c(c2c1cccc2)ccc4c(c1c3cccc1)C#C[SiH3] 273268
[O-]c1c2cccc1Cc1cccc(c1)Cc1c(c(Cc3cc(C2)ccc3)ccc1)[O-] 274285
Oc1c2cccc1Sc1cccc(c1)Sc1c(c(Sc3cc(S2)ccc3)ccc1)O 275294
Oc1c2cccc1Cc1cccc(c1O)Cc1cc(Cc3cc(C2)ccc3)ccc1 276305
Oc1c2cccc1Cc1cccc(c1)Cc1c(c(Cc3cc(C2)ccc3)ccc1)O 277314
O=C1c2cccc(c2)Cc2cccc(c2)C(=O)c2cc(Cc3cc1ccc3)ccc2 278325
O=C1NC(=O)c2c3c1ccc1c3c(cc2)c2c3c1ccc1c3c(cc2)C(=O)NC1=O 279342
O=C1N2CNCN1Cc1cccc(n1)CN1C(=O)N(Cc3nc(C2)ccc3)CNC1 280353
O=C1CNNC(=O)CNNC(=O)CNNC(=O)CNNC(=O)CNNC(=O)CNN1 281362
O1[Si@@H]2O[Si@H]3O[Si@H]4O[Si@H]5O[Si@@H](O2)O[Si@H]2O[Si@@H]1O[Si@@H]1O[Si@H](O[Si@H](O2)O5)O[Si@H](O4)O[Si@H](O3)O1 282441
N#Cc1n(C)nc2c1-c1cnc(c(c1)O[C@H](C)c1c(C(=O)N(C2)C)ccc(c1)F)N 283475
Clc1nc2Nc3cccc(c3)Nc3nc(nc(Nc4cc(Nc(n1)n2)ccc4)n3)Cl 284488
Cc1ccc2c(c1)Cc1cc(C)ccc1OP1(O2)Oc2c(O1)c(Cl)c(c(c2Cl)Cl)Cl 285509
C[N@@H+]1Cc2ccc([nH]2)Cc2ccc([nH]2)C[N@H+](Cc2[nH]c(Cc3[nH]c(C1)cc3)cc2)C 286548
C[C@H]1CC[C@H](O)[C@@H](C)/C=C(\C)/CC/C=C\C=C(\C(=O)NC2=CC(=O)C=C(C1)C2=O)/C 287585
C[C@@H]1c2ccc([nH]2)C(C)(C)c2ccc([nH]2)[C@H](c2[nH]c(C(c3[nH]c1cc3)(C)C)cc2)C 288623
C[C@@H]1c2ccc([nH]2)C(C)(C)c2ccc([nH]2)[C@@H](c2[nH]c(C(c3[nH]c1cc3)(C)C)cc2)C 289662
C[C@@H]1CC[C@]2([C@@H](C1)C1=CC(=O)[C@H]3[C@@]([C@@]1(CC2)C)(C)CC[C@@H]1[C@]3(C)CCCC1(C)C)C 290714
C[C@@H]1CC[C@]2([C@@H](C1)C1=CC(=O)[C@H]3[C@@]([C@@]1(CC2)C)(C)CC[C@@H]1[C@]3(C)CCCC1(C)C)C 291766
Brc1cc2Cc3cccc(c3)Cc3cc(cc(Cc4cc(Cc(c1)c2)ccc4)c3)Br 292779
c1ccc2c(c1)c1Cc3c(-c1c1c2cccc1)c1ccccc1c1c3cccc1 293790
Oc1c2cccc1Cc1cccc(c1)Cc1cc(Cc3cc(C2)ccc3)ccc1 294764
O=C1c2c3OCCOCCOCCOCCOc4c1c(C(=N)c2ccc3)ccc4 295736
O=C1[C@@H]2CNC[C@H]1[C@H]1N[C@@H]2c2ccccc2OCCOCCOc2c1cccc2 296723
N/C(=C\1/C(=O)C[C@H]2[C@](C1=O)(O)C(=C1[C@H](C2)[C@](C)(O)c2c(C1=O)c(O)ccc2)O)/O 297732
CN1CC(=C)C(=O)[C@]2(C1)C[C@H]1N([C@]32C(=O)c2c4c3cccc4ccc2)CCCC1 298725
CN1CC(=C)C(=O)[C@@]2(C1)C[C@@H]1N([C@@]32C(=O)c2c4c3cccc4ccc2)CCCC1 299721
CC1=CC2=N3C1=Cc1cc(c4n1*13N3=C(C=c5n1c(=C2)cc5C)C(=CC3=C4)C)C 300711
CC1=CC2=Cc3n4*56N2=C1C=c1cc(c(=CC2=N6C(=Cc4cc3C)C=C2C)n51)C 301699
C1=CS/C(=C/2\c3sc4c(-c5c(/C/4=C\4/SC=CS4)cccc5)c3-c3c2cccc3)/S1 302691
n1ncc2c(c1)cc1c(c2)cc2c(c1)c1cccc3c1c1c2cccc1cc3 303673
n1cc2nc(c1)oc1ccccc1oc1nc(oc3c(o2)cccc3)cnc1 304614
c1ccc2c(c1)[C@@H]1c3c([C@H]2[C@@H]2c4c([C@H]1c1c2cccc1)cccc4)cccc3 305577
c1ccc2c(-c3cc4c(cc3C2)ccc2c4cc3-c4ccccc4Cc3c2)c1 306522
c1ccc2c(-c3cc4c(cc3C2)ccc2c4cc3-c4ccccc4Cc3c2)c1 307467
c1ccc(cc1)C#Cc1cccc2c1[nH]c1c2ccc2c1[nH]c1c2cccc1 308413
c1ccc(cc1)C#Cc1c2ocnc2c(c2c1nco2)C#Cc1ccccc1 309354
c1ccc(cc1)C#Cc1c2ocnc2c(c2c1nco2)C#Cc1ccccc1 310295
c1cc2cc(c1)Oc1ncnc(n1)Oc1cc(Oc3nc(O2)ncn3)ccc1 311238
c1cc2cc(c1)Nc1ncnc(n1)Nc1cc(Nc3nc(N2)ncn3)ccc1 312181
c1cc2Sc3cccc(c3)Sc3cccc(Sc4cc(Sc(c1)c2)ccc4)c3 313124
c1cc2Nc3cccc(c3)Nc3cccc(Nc4cc(Nc(c1)c2)ccc4)c3 314071
c1cc2Cc3cccc(c3)Cc3cccc(Cc4cc(Cc(c1)c2)ccc4)c3 315014
c1cc2Cc3cccc(c3)Cc3ccc4-c5ccc(Cc(c1)c2)cc5Cc4c3 315958
[SiH3]C#Cc1c2nc3c(nc2c(c2c1cccc2)C#C[SiH3])c(Cl)c(c(c3Cl)Cl)Cl 316917
[SiH3]C#Cc1c2cc3sc(cc3cc2c(c2c1cc1cc(sc1c2)F)C#C[SiH3])F 317876
[SiH3]C#Cc1c2cc3ccccc3cc2c(c2c1cc1ccccc1c2)C#C[SiH3] 318829
[SiH3]C#C[c-]1c2sc3c(c2c2c1cccc2)sc1c3c2ccccc2[c-]1C#C[SiH3] 319788
O=[P@]12Oc3ccc4c(c3-c3c(O[P@](=O)(N1)N2)ccc1c3cccc1)cccc4 320746
O=C1c2cccc3c2Cc2c1cccc2OCCOCCOCCOCCO3 321682
O=C1NCCOc2ccccc2OCCNC(=O)COc2cc(OC1)ccc2 322619
O=C1NC(=O)c2c3c1c1ccccc1c1c3c(c3c2cccc3)C(=O)NC1=O 323566
O=C1C[C@@H]2[C@@]3(O1)[C@@H](O)[C@]14CC[C@]5([C@@H]([C@](O1)(C(=O)[C@@H]4CC[C@H]3C(O2)(C)C)O)C5)C 324560
Cc1cc2[nH]c1/C=c/1\[nH]/c(=C\c3[nH]c(/C=c/4\[nH]/c(=C\2)/cc4C)c(c3)C)/cc1C 325531
Cc1c(C)c2CC[n+]3c(-c2c2-c4[n+](CCc12)ccc1c4cccc1)cccc3 326482
C[C@H]1C[C@]2(C[C@H](C(=O)O2)O)C[C@@]2(O1)Oc1cc3COC(=O)c3c(c1C[C@@H]2C)O 327451
C[C@H]1C[C@@H](C)C(=O)OC[C@@](C)(O)[C@H]2[C@H]([C@H]([C@@H](C[C@@](C1)(C)O)C)OC(O2)(C)C)C 328437
C[C@@H]1c2ccc([nH]2)[C@H](C)c2ccc([nH]2)[C@@H](c2[nH]c([C@@H](c3[nH]c1cc3)C)cc2)C 329415
CN1CC(=C)C(=O)[C@]2(C1)C[C@H]1N([C@]32C(=O)c2c4c3cccc4ccc2)CSC1 330375
CC1=C/C/2=C/c3cc(c([nH]3)[CH+]c3[n-]c(/C=c/4\[nH]/c(=C\C1=N2)/c(C)c4)cc3C)C 331348
CC1(C)c2cccc3c2N2c4c1cccc4C(c1c2c(C3(C)C)ccc1)(C)C 332295
CC1(C)CCc2c(-c3c1cccc3)cc1c(-c3ccccc3C(CC1)(C)C)c2 333242
CC#Cc1c2cc3ccccc3cc2c(c2c1cc1ccccc1c2)C#CC 334181
c1ccc2c(c1)[nH]c1c2c2[nH]c3c(c2c2c1c1ccccc1[nH]2)cccc3 335132
c1ccc2c(c1)C=Cc1c(C32c2ccccc2-c2c3cccc2)cccc1 336042
c1ccc2-c3c(Cc2c1)c1-c2ccccc2Cc1c1-c2c(Cc31)cccc2 336955
OC1=CC(=O)[C@@]2([C@H](C1)[C@@H](O)[C@H]1C(=C2O)C(=O)c2c([C@@]1(C)O)cccc2O)O 337896
O=C1OC2(c3c1cccc3)c1cc(Cl)c(cc1Oc1c2cc(Cl)c(c1)O)O 338811
O=C1Nc2cccc(c2)C(=O)Nc2cc(C(=O)Nc3cc1ccc3)ccc2 339724
O=C1NCc2scc(n2)C(=O)NCc2nc(C(=O)NCc3nc1cs3)cs2 340635
O=C1CC[C@]2([C@H](C1(C)C)CC[C@@]1([C@@H]2CC[C@H]2[C@@]1(C)CC[C@@H]1[C@@H]2CCC1)C)C 341585
O=C1C=C[C@]2(C(=C1)CC[C@@H]1[C@]2(F)[C@@H](O)C[C@]2([C@H]1C[C@@H]1[C@H]2OC(O1)(C)C)C)C 342536
O1Cc2cccc(c2)COCc2cccc(COCc3cc(C1)ccc3)c2 343442
N#CC1=C2[C@H](CCc3c2cccc3)C[C@@]2(C1=N)C(=O)Nc1c2cc(C)cc1 344364
Clc1ccc2c(c1)cc1c(n2)C[C@H]2C[C@@H]1Cc1c2cc2c(n1)ccc(c2)Cl 345287
Br[C@@H]1[C@@H]2S[C@H](c3c1cc1ccccc1n3)[C@H](c1c2nc2ccccc2c1)Br 346217
Br[C@@H]1[C@@H]2C[C@H](c3c1cc1ccccc1n3)[C@H](c1c2nc2ccccc2c1)Br 347148
c1nc2ccc3c4c2c(n1)ccc4c1c2c3ccc3c2c(cc1)ncn3 348059
c1nc2-c3cc4CCc5cc([C@@]6(n2c1)N=CC=N6)c(CCc3cc4)cc5 348943
c1ccc2c(c1)ccc1c2c2c(cc1)ccc1c2c2cccnc2cc1 349818
c1ccc2c(c1)ccc1c2c2c(cc1)ccc1c2c2ccccc2cc1 350693
c1ccc2c(c1)c1c(s2)[cH-]c2c1cc1[cH-]c3c(c1c2)c1c(s3)cccc1 351582
c1ccc2c(c1)c1[cH-]c3c(c1s2)cc1c(c3)c2sc3c(c2[cH-]1)cccc3 352473
c1ccc2c(c1)/[C-]=[C-]\c1ccccc1[C-]=C=C=[C-]c1c(/[C-]=[C-]\2)cccc1 353373
c1ccc2c(-c3ccc4n3[SiH-]3(O2)Oc2ccccc2-c2n3c([CH+]4)cc2)c1 354263
c1cc2[nH]c(=c3[nH]c4cccc5c4c([nH]3)ccc5)[nH]c3c2c(c1)ccc3 355154
[nH+]1cc2ccc3c4c2c(c1)ccc4c1c2c3ccc3c2c(cc1)c[nH+]c3 356039
[SiH3]C#Cc1c2cc3sccc3cc2c(c2c1cc1ccsc1c2)C#C[SiH3] 356922
O=C1O[C@@H]2C[C@H]3C(=C(O)C(=O)C[C@@]3([C@@H]3[C@@]42[C@@H](C1)[C@H](OC4)[C@H]([C@@H]3O)O)C)C 357852
O=C1OC[C@H](C)c2ccc(cc2C)CC(=O)N(Cc2cc(N1)ccc2)C 358733
O=C1NC(=O)c2c3c1c1sccc1c1c3c(c3c2ccs3)C(=O)NC1=O 359614
O=C1N2Cc3ccccc3CN3[C@H]2[C@@H]2N1Cc1ccccc1CN2C3=O 360498
N1CCOc2ccccc2OCCNCCOc2c(OCC1)cccc2 361365
Fc1ccc2c(c1)c(=O)c1c([nH]2)cc2c(c1)[nH]c1c(c2=O)cc(cc1)F 362254
Clc1ccc2c(c1)[C@]1(C[C@@H]([C@]3(C1)C(=O)Nc1c3cc(Cl)cc1)O)C(=O)N2 363152
C\1=C\c2ccc(s2)[CH+]c2ccc(s2)/C=C\c2sc([CH+]c3sc1cc3)cc2 364043
C[C@]12[C@@]3(C)c4c([C@]2(C)c2c([C@]1(C)c1c3cccc1)cccc2)cccc4 364941
C[C@@H]1C[C@@H](C)C[C@@H](C)C(=O)OC[C@@]2([C@@H]([C@H](C(=O)[C@@H](C1)C)C)NC(=O)O2)C 365858
CC1(C)c2cccc3c2B2c4c1cccc4C(c1c2c(C3)ccc1)(C)C 366737
CC1(C)CCC[C@]2([C@H]1CC[C@@]1([C@@H]2CC[C@H]2[C@@]1(C)CC[C@@H]1[C@@H]2CCC1)C)C 367648
c1ccc2c(c1)nc1c(c2)C[C@H]2C[C@@H]1Cc1c2nc2c(c1)cccc2 368533
c1ccc2c(c1)cc1c(c2)O[B-]2(O1)Oc1c(O2)cc2c(c1)cccc2 369384
c1ccc2c(c1)cc1c(c2)OC2(O1)Oc1c(O2)cc2c(c1)cccc2 370232
c1ccc2c(c1)CN1[SiH-]3(O2)Oc2ccccc2C=[N+]3c2c1cccc2 371083
c1ccc2-c3c([Si]4(c2c1)c1ccccc1-c1c4cccc1)cccc3 371931
c1ccc2-c3c(C4(c2c1)c1ccccc1-c1c4cccc1)cccc3 372776
c1cc2n3c1[CH+]c1ccc4n1[SiH2-2]13n3c([CH+]2)ccc3[CH+]c2n1c([CH+]4)cc2 373645
[SiH3]C#Cc1c2cc3ccccc3cc2cc2c1cc1ccccc1c2 374488
[SiH3]C#C[c-]1c2sc3c(c2c2c1cccc2)c1c([c-]3C#C[SiH3])cccc1 375347
S1Cc2cccc(c2)Cc2cccc(c2)CSCc2cc(C1)ccc2 376190
Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)ccc(c1)O 377037
Oc1ccc2c(c1)Oc1c(C32NC(=O)c2c3cccc2)ccc(c1)O 377882
Oc1cc2O[C@]3(C)CC[C@@H]4[C@@H](C(=C)CC[C@H]3Cc2c(c1)O)CC4(C)C 378744
O=[P@@H]1Oc2cccc(c2)[C@H](C)c2ccc([C@@H](c3cc(O1)ccc3)C)[nH]2 379606
O=[P@@H]1Oc2cccc(c2)[C@@H](C)c2ccc([C@H](c3cc(O1)ccc3)C)[nH]2 380469
O=C1c2ccccc2C[C@@]21CCN(C12C(=O)c2c(C1=O)cccc2)C 381319
O=C1NC(=O)c2c3c1ccc1c3c(cc2)c2c3c1cccc3ccc2 382163
O=C1C[C@@H]2OCC=C3[C@H]4[C@@H]2[C@@H]2N1c1ccccc1[C@]12CC[N@H+]([C@H]1C4)C3 383038
O=C1C[C@@H]2OCC=C3[C@H]4[C@@H]2[C@@H]2N1c1ccccc1[C@]12CCN([C@H]1C4)C3 383908
O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@]12CCC(=O)O1)C)C 384778
O1[Si@@H]2O[Si@@H]3O[Si@@H]4O[Si@H]1O[Si@@H]1O[Si@H](O2)O[Si@@H]2O[Si@H](O3)O[Si@H](O4)O[Si@H](O1)O2 385679
F[B-]1(F)n2cc3c(c2-c2c4n1c1ccccc1c4ccc2)cccc3 386535
Cc1ccc2c(c1)C1(NC(=O)c3c1cccc3)c1c(O2)ccc(c1)C 387382
Cc1ccc2c(c1)C(C)(C)CC1(O2)Oc2ccc(cc2C(C1)(C)C)C 388230
Cc1cc2ccccc2c2c1o[pH]oc1c2c2ccccc2cc1C 389069
C[C@H]1C[C@@H](C)C(=O)OC[C@@](C)(O)[C@@H]([C@H](C(=O)[C@@H](C[C@@](C1)(C)O)C)C)O 389951
CN1c2ccccc2C([C@@]21C=Nc1c(O2)ccc2c1cccc2)(C)C 390798
CN1Cc2c3OCOc3ccc2-c2c1c1cc3OCOc3cc1cc2 391637
CN1Cc2c3OCOc3ccc2-c2c1c1cc3OCOc3cc1cc2 392476
CN1CC[C@@]2([C@@]31C(=O)Nc1c3cccc1)Cc1ccccc1OC2=O 393326
CC1=C2[C@@H](O)C(=O)[C@]3([C@H](C[C@](CC1)(C2(C)C)O)[C@@H]1CO[C@@H]1C[C@@H]3O)C 394206
C1=CC2=N3C1=Cc1ccc4n1*13N3=C(C=CC3=C4)C=c3n1c(=C2)cc3 395060
c1ccc2c(c1)/[C-]=[C-]\c1ccccc1/[C-]=[C-]/c1c(/[C-]=[C-]\2)cccc1 395924
c1ccc2-c3ccccc3-c3c(-c4c(-c2c1)cccc4)cccc3 396735
c1cc2oc1/C=c\1/cc/c(=C/c3ccc(/C=c/4\o/c(=C\2)/cc4)o3)/o1 397560
c1cc2[nH]c1[CH+]c1ccc([nH]1)[CH+]c1ccc([CH+]c3[nH]c([CH+]2)cc3)[nH]1 398397
c1cc2[nH]c1Cc1ccc([nH]1)Cc1ccc(Cc3[nH]c(C2)cc3)[nH]1 399218
c1cc2[nH]c1/C=c\1/cc/c(=C/c3ccc(/C=c/4\[nH]/c(=C\2)/cc4)[nH]3)/[nH]1 400055
c1cc2[n-]c1[CH+]c1ccc([nH]1)[CH+]c1ccc([CH+]c3[nH]c([CH+]2)cc3)[n-]1 400892
c1cc2[n-]c1[CH+]c1ccc([nH]1)[CH+]c1ccc(/C=c/3\[nH]/c(=C\2)/cc3)[n-]1 401729
c1cc2[n-]c1[CH+]c1ccc([nH]1)/C=c\1/cc/c(=C/c3[nH]c([CH+]2)cc3)/[n-]1 402566
c1cc2[n-]c1[CH+]c1ccc([n-]1)[CH+]c1ccc([CH+]c3[n-]c([CH+]2)cc3)[n-]1 403403
c1cc2[n-]c1/C=c\1/cc/c(=C/c3ccc(/C=c/4\[nH]/c(=C\2)/cc4)[n-]3)/[nH]1 404240
c1cc2[n-]c1/C=c\1/cc/c(=C/C3=N/C(=C\C4=[NH+]/C(=C\2)/C=C4)/C=C3)/[nH]1 405079
c1c/c/2=C/c3ccc([nH]3)[CH+]c3[nH]c([CH+]c4[nH]c(/C=c/1\[nH]2)cc4)cc3 405916
c1c/c/2=C/c3ccc([nH]3)/C=c/3\[n-]/c(=C\c4[nH]c(/C=c/1\[n-]2)cc4)/cc3 406753
[SiH3]C#Cc1c2cc3ccccc3cc2c(c2c1cccc2)C#C[SiH3] 407568
[Se]=P1Oc2ccc3c(c2-c2c(O1)ccc1c2cccc1)cccc3 408382
P1Oc2ccc3c(c2Sc2c(O1)ccc1c2cccc1)cccc3 409191
O[C@H]1CO[C@H]2[C@H]1O[P@](=O)(O)OC[C@H]1OC[C@@H]([C@@H]1O[P@@](=O)(OC2)O)O 410037
O[C@H]1CCC([C@@H]2[C@]31CO[C@@]1([C@H]2OC(=O)[C@@]21[C@H]3CCC[C@H]2O)O)(C)C 410883
O[C@@H]1C[C@@H]2[C@@]3(C)CC[C@@H](C([C@@H]3CC[C@]2([C@]2([C@H]1CCC2)C)C)(C)C)O 411730
OC1=CC(=O)[C@@]2([C@H](C1)C[C@@H]1Cc3cccc(c3C(=O)C1=C2O)O)O 412558
O=c1c2cc3[nH]c4ccccc4c(=O)c3cc2[nH]c2c1cccc2 413371
O=P1Oc2ccc3c(c2-c2c(O1)ccc1c2cccc1)cccc3 414180
O=C1c2ccccc2C2=C1C=CCC12C(=O)c2c(C1=O)cccc2 414993
O=C1NCc2c1c1c([nH]c3c1cccc3)c1c2c2ccccc2[nH]1 415807
O=C1NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NC1 416618
O=C1C=C[C@]2(C(=C1)CC[C@@H]1[C@]2(F)[C@@H](O)C[C@]2([C@H]1C[C@H]([C@H]2O)C)C)C 417465
O=C1C=C[C@]2(C(=C1)CC[C@@H]1[C@@H]2[C@@H](O)C[C@]2([C@H]1C[C@@H]1[C@H]2OCO1)C)C 418313
N=c1c2cc3[nH]c4ccccc4c(=N)c3cc2[nH]c2c1cccc2 419126
N#CC1=C2NC(=O)c3c(N2C2=C(C1)C(=O)CC(C2)(C)C)cccc3 419944
N#CC(=c1c2ccccc2c(=C(C#N)C#N)c2c1cccc2)C#N 420755
F[B-]1(F)[NH+]=Cc2c(O1)c1C=[NH+][B-](Oc1c1c2O[B-](F)(F)[NH+]=C1)(F)F 421592
C[C@@H]1C[C@@H](C)C[C@@H](C)C(=O)OC[C@@]([C@@H]([C@H](C(=O)[C@@H](C1)C)C)O)(C)O 422440
CC1=C2CC(=O)[C@]3([C@H](C[C@](CC1)(C2(C)C)O)[C@@H]1CO[C@@H]1C[C@@H]3O)C 423280
C=c1c2cc3ccccc3cc2c(=C)c2c1cc1ccccc1c2 424087
C1CC2=N/C/1=C\c1ccc([nH]1)[CH+]C1=N/C(=C\c3[nH]c([CH+]2)cc3)/CC1 424920
C1=CC2=N/C/1=C\c1ccc([nH]1)[CH+]c1ccc(/C=c/3\[nH]/c(=C\2)/cc3)[n-]1 425756
C1=CC2=N/C/1=C\c1ccc([nH]1)/C=C\1/C=CC(=N1)/C=c/1\[nH]/c(=C\2)/cc1 426591
c1ccc2c(c1)c1cccc3c1[n+]1c2c[cH-]c1c1c3cccc1 427404
c1ccc2c(-c3nc4ccccc4nc3-c3c(N2)cccc3)c1 428180
c1cc2[n-]c1[CH+]c1ccc(-c3ccc([CH+]c4[nH]c([CH+]2)cc4)[nH]3)[nH]1 428981
[pH]1oc2ccc3c(c2c2c(o1)ccc1c2cccc1)cccc3 429758
O[C@@H]1Cc2c([C@H]([C@@H]1O)O)cc1c3c2ccc2c3c(cc1)ccc2 430549
O[C@@H]1C[C@@H]2[C@@]3(C)CCCC([C@@H]3CC[C@]2([C@]2([C@H]1CCC2)C)C)(C)C 431356
O[C@@H]1CCc2c(C1)cc1c(c2O)C(=O)c2c(C1=O)cccc2O 432139
O[C@@H]1CCc2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2 432924
O[C@@H]1CC[C@]2([C@H](C1(C)C)CC=C1[C@@H]2CC[C@@]2([C@]1(C)CCC2)C)C 433727
O=S1(=O)NS(=O)(=O)c2cc3CCc4cc1c(cc4)CCc2cc3 434507
O=C1OC2(c3c1cccc3)c1ccccc1Oc1c2cccc1 435282
O=C1NCC(=O)OC/C=C/COC(=O)N2[C@H](C(=O)NC1)CCC2 436065
O=C1NC2(c3c1cccc3)c1ccccc1Oc1c2cccc1 436838
O=C1CC[C@]23[C@H](C1(C)C)CC[C@@H]1[C@@]3(C2)CC[C@]2([C@@]1(C)CCC2)C 437642
O=C1CC[C@]2([C@H](C1(C)C)CC=C1[C@@H]2CC[C@@]2([C@]1(C)CCC2)C)C 438441
O=C1CCCC/C=C/CCNC(=O)c2c(C1)c(*)c(cc2O)O 439218
O=C1CC2=C(c3c(N1)ccc(c3)F)C(=O)c1c(C2=O)cccc1 440000
O=C1C=C2[C@@H]([C@@]3([C@H]1C[C@@H](O)[C@H](C3)O)C)CC[C@]1([C@@]2(O)CCC1)C 440811
N=C1c2ccccc2[N+]2=C1c1[nH]c3c(c1N[B-]2(F)F)cccc3 441596
N=C1SC2(c3c1cccc3)c1ccccc1Oc1c2cccc1 442369
FC1(F)C(F)(F)C2=C3C=CS[C@@]3([C@@]3(C(=C2C1(F)F)C=CS3)C)C 443164
Clc1ccc2c(c1)[C@]1(CCCc3c1[nH]c1c3cccc1)C(=O)N2 443950
Cc1ccc2c(-c3cccc4-c5c(O[BH-](O2)[n+]34)ccc(c5)C)c1 444738
Cc1cc2O[C@@]3(c4c2c(c1)ccc4O)NC(=O)c1c3cccc1 445519
C[Si]1(C)C(=CC=C1C#Cc1ccccc1)C#Cc1ccccc1 446296
C[C@H]1C[C@@H]2[C@](C1)(C)C[C@@H]([C@]1([C@H]2CCC2=CC(=O)C=C[C@]12C)Cl)O 447106
C[C@@H]1CCC[C@]2([C@H]1CC(=O)C1=C2C(=O)C[C@]2([C@@]1(C)CCC2)C)C 447907
CC1=C2CC(=O)[C@]3([C@H](C[C@](CC1)(C2(C)C)O)[C@@H]1CO[C@@H]1CC3)C 448709
C=C1CCC(=O)C(C)(C)/C=C/[C@H](C(=O)[C@@H]2[C@@H](C1)C[C@](C2)(C)O)C 449512
c1sc2c(c1)c1ccsc1c1c2c2sccc2c2c1scc2 450285
c1cnc2c(c1)c1nc3ccccc3nc1c1c2nccc1 451028
c1ccc2c(c1)nc1c(n2)c2ccccc2c2c1cccc2 451769
c1ccc2c(c1)nc1-c3c(OCc1c2)ccc1c3cccc1 452511
c1ccc2c(c1)ccc1c2c2c(cc1)ccc1c2cccc1 453252
c1ccc2c(c1)cc1c(c2)cc2c(c1)cc1c(c2)cccc1 453997
c1ccc2c(c1)cc1c(c2)cc2c(c1)cc1c(c2)cccc1 454742
c1ccc2c(c1)c1ccc3c(c1cc2)ccc1c3cccc1 455483
c1ccc2c(c1)[C@@H]1[C@@H]3[C@H]2c2ccccc2[C@@H]3c2c1cccc2 456243
c1ccc2c(c1)Nc1c(N2)c2ccccc2c2c1cccc2 456984
c1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccccc1 457723
c1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccccc1 458462
c1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccccc1 459201
c1ccc(cc1)C#Cc1c2ccccc2cc2c1cccc2 459939
c1ccc(c(c1)C#Cc1ccccc1)C#Cc1ccccc1 460678
c1cc2ccc3c4c2c(c1)[o+]c1c4c2c([o+]3)cccc2cc1 461427
c1cc2[o+]c3C=CC=c4[c+]3c3=c2c(c1)[o+]c1=CC=Cc([c+]31)[o+]4 462190
c1cc2[nH+]c3C=CC=c4[c+]3c3=c2c(c1)[nH+]c1=CC=Cc([c+]31)[nH+]4 462956
c1cc(C#Cc2ccccc2)nc(c1)C#Cc1ccccc1 463695
c1cc(C#Cc2ccccc2)cc(c1)C#Cc1ccccc1 464434
c1cc(C#Cc2ccccc2)cc(c1)C#Cc1ccccc1 465173
c1cc(C#Cc2ccccc2)[nH+]c(c1)C#Cc1ccccc1 465916
[OH2+][C@H]1CC[C@]2([C@H](C1(C)C)CCC1=C2CC[C@]2(C1=CCC2)C)C 466680
O[C@H]1CO[C@H]2[C@@H]1c1c(O2)ccc2c1oc(=O)c1c2CCC1=O 467436
O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC(=C)C2=O)C)C1)C 468206
O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CCC2)C)O)C 468989
O=P1c2ccc3c(c2-c2c1ccc1c2cccc1)cccc3 469730
O=C1c2ccccc2[C@@H](/C/1=C\1/[C@H](O)c2c(C1=O)cccc2)O 470488
O=C1c2ccccc2O[C@@H]2[C@H]1[C@@H]1[C@H]2Oc2c(C1=O)cccc2 471247
O=C1[C@H](O)[C@@H]2[C@@]34N1CCC[C@@H]3CCC(=O)N4c1c2cccc1 472008
O=C1C[C@@]2([C@@]34N1CCC[C@@H]3CCC(=O)N4c1c2cccc1)O 472764
O=C1CC[C@]2([C@@H](C1)CC(=O)[C@@H]1[C@@H]2CC(=O)[C@]2([C@H]1CCC2)C)C 473537
O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2[C@@H](O)C[C@]2([C@H]1CC[C@H]2O)C)C 474311
O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC(=C)C2=O)C)C 475078
O=C1CC[C@H]2CCCN3[C@]2(C(=CC3=O)c2c(N1)cccc2)O 475829
O=C1CC[C@@H]2[C@]34N1CC[C@]14c4ccccc4N([C@H]1[C@H](O3)C2)C 476592
O=C1C=C[C@]2(C(=C1)CC[C@@H]1[C@@H]2[C@@H](O)C[C@]2([C@H]1CC[C@H]2O)C)C 477367
Fc1c(F)c(F)c(c2c1cc1cc3ccccc3cc1c2)F 478108
Fc1c(F)c(F)c(c2c1cc1c(c2)c(F)c(c(c1F)F)F)F 478855
F[B-]1(F)n2cc3c(c2[CH+]c2n1cc1c2CCCC1)CCCC3 479603
Cc1ccc2c(c1)Cc1cc(C)ccc1OP1(O2)NN=CO1 480345
Cc1c2Cc3c(C)c4c(n3Bn2c2c1cccc2)cccc4 481087
C\1=C\Nc2ccccc2/N=C/C=C\Nc2c(/N=C1)cccc2 481832
CN1Cc2ccccc2-c2c1c1cc3OCOc3cc1cc2 482570
CN1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1c3c([C@H]2c2c1cccc2)cccc3 483333
CN1C(=O)[C@@H]2[C@H](C1=O)C[C@@H]1C(=CC[C@H]3[C@@H]1C(=O)N(C3=O)C)C2 484106
CC1(C)[C@H]2OBO[C@H]2c2c1cc1[C@@H]3OBO[C@@H]3C(c1c2)(C)C 484867
CC1(C)[C@@H]2OBO[C@@H]2c2c1cc1[C@H]3OBO[C@H]3C(c1c2)(C)C 485628
CC1(C)CCC[C@]2([C@H]1CC[C@@]1([C@@H]2CC[C@H]2[C@@]1(C)CCC2)C)C 486395
C1OCCOc2ccccc2OCCOCCOCCOC1 487126
C1COc2ccccc2OCCCOc2c(OC1)cccc2 487861
C1CNc2ccc(cc2)NCCCNc2ccc(NC1)cc2 488598
C1/N=C/c2ccccc2NCC/N=C/c2c(NC1)cccc2 489339
Brc1cccc2c1C(C)(C)[C@]1(N2C)C=Cc2c(O1)cccc2 490087
Brc1cccc2c1C(C)(C)[C@@]1(N2C)C=Cc2c(O1)cccc2 490837
c1ccc2c(c1)Cc1ccccc1Cc1c(C2)cccc1 491576
c1ccc2-c3cccc4-c5c(O[BH-](Oc2c1)[n+]34)cccc5 492293
c1ccc(cc1)C#Cc1ccc(s1)C#Cc1ccccc1 492999
c1ccc(cc1)C#Cc1ccc(s1)C#Cc1ccccc1 493706
c1cc2n(c1)[SiH2-2]13[N+](=C2)c2c([N+]3=Cc3n1ccc3)cccc2 494434
c1cc2[nH]c3ccccc3[c+]3c2c(c1)[nH]c1c3cccc1 495150
Oc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC(=C)C2=O)C 495877
O[P@@]1(=O)Oc2cc3ccccc3cc2-c2c(O1)cccc2 496589
O[C@H]1C[C@H]2CCN3[C@H]2[C@]2([C@@H]1N(C)c1c2cccc1)CC3=O 497319
O[C@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@]1(O)CCC2)C)C 498057
O[C@H]1CC[C@]2(C(=C[C@H]([C@@H]3[C@@H]2CC[C@]2([C@H]3CCC2)C)O)C1)C 498796
O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC(=O)C2)C)C1)C 499532
O[C@@H]1C[C@@H]2C=CCN3[C@@H]2[C@@]2([C@H]1N(C)c1c2cccc1)CC3 500264
O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C)O)C 501008
O[C@@H]1CC[C@]2([C@@H](C1)C[C@@H]([C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C)O)C 501753
O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CCC2)C)C 502497
O=c1[nH]c(=O)c2c1c1c(=O)[nH]c(=O)c1c1c2c(=O)[nH]c1=O 503222
O=C1[C@H]2C[C@H]3C([C@@H]1C(=O)[C@]1(C2=O)CCC([C@H]1C3)(C)C)(C)C 503959
O=C1OC(=O)[C@H]2[C@@H]1[C@@H]1c3c([C@H]2c2c1cccc2)cccc3 504687
O=C1NC(=O)c2c1cc1-c3cccc4c3c(-c1c2)ccc4 505399
O=C1NC(=O)[C@H]2[C@@H]1[C@@H]1c3c([C@H]2c2c1cccc2)cccc3 506127
O=C1NC(=O)[C@@]2([C@@H](C1)[C@@H]1CCc3c([C@H]1CC2)cccc3)C 506857
O=C1N2Cc3ccccc3CN3[C@H]2[C@@H]2N1COCN2C3=O 507572
O=C1C[C@@H]2C[C@H](N1)c1c(C32SCCS3)[nH]c2c1cccc2 508293
O=C1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2=O)C)C 509029
O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1C[C@@H]1[C@H]2O1)C)C 509770
O=C1CC[C@@]2([C@@]34[C@H]1Oc1c4c(C[C@H]2[NH2+]CC3)ccc1O)O 510500
O=C1CCCCCC/C=C\[C@H]2[C@H](NC(=O)[C@H]3N1CCC3)C2 511221
O=C1CC(C)(C)CC2=C1Cc1c(O2)ccc2c1cccc2 511931
O=C1CC(C)(C)CC2=C1CC1=C(N2)c2c(C1=O)cccc2 512645
O=C1C=C[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2=O)C)C 513377
NN1C2=C(CC3=C1CC(C)(C)CC3=O)C(=O)CC(C2)(C)C 514093
N#C[C+]1c2ccnc[n+]2[B-]([n+]2c1sc1c2cccc1)(F)F 514812
FC1=C(F)C(=C(C2=c3c(=[BH-][C+]12)c(F)c(c(c3F)F)F)F)F 515538
C[C@H]1CCC[C@@]2([C@@H]1C[C@@H](O)[C@]13[C@H]2CC[C@H](C1)[C@](C3)(C)O)C 516282
C[C@H]1/C=C/C(=O)OCC/C=C/C=C/C(=O)[C@@H](C[C@@H](C1)C)C 517010
C[C@@H]1CCC[C@]2([C@H]1CC[C@@]1([C@@H]2CC[C@H]2[C@@]1(C)CCC2)C)C 517747
C[C@@H]1C2=C(NC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C 518468
CN1c2ccccc2C([C@@]21C=Cc1c(O2)cccc1)(C)C 519181
CC1(C)CC2(c3c1cccc3)CC(c1c2cccc1)(C)C 519891
C=C1C[C@@]23C[C@H]1CC[C@H]3[C@@]13[C@H](C2)[C@@](C)([C@H](CC1)O)C(=O)O3 520635
C=C1C[C@@H]2[C@]([C@H]1O)(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CCCC2 521368
C1Oc2c(O1)cc1-c3cc4ccccc4c[n+]3CCc1c2 522078
C1C=C2CCCN3[C@@H]2[C@H](C1)c1[nH]c2c(c1CC3)cccc2 522799
C/C=C\1/C(=O)C=C2[C@](C1=O)(C)c1c(O2)cc(c(c1O)C)O 523521
Brc1ccc2c(c1)[C@H]1CN3[C@@H]([C@H]1CO2)Sc1c3cccc1 524243
c1ccc2c(c1)oc1c2cc2c(c1)c1c([nH]2)cccc1 524957
c1ccc2c(c1)oc1c2cc2c(c1)[nH]c1c2cccc1 525635
c1ccc2c(c1)c1cc3[nH]c4c(c3cc1[nH]2)cccc4 526316
c1ccc2c(c1)[C@@H]1c3c([C@H]2c2c1cnnc2)cccc3 527000
c1ccc2c(c1)[C@@H]1c3c([C@H]2c2c1cccc2)cccc3 527684
c1ccc2c(c1)[C@@H]1OO[C@H]2c2c1cc1c(c2)cccc1 528368
c1ccc2c(c1)[C-]=C=C=[C-]c1c([C-]=C=C=[C-]2)cccc1 529057
c1ccc2c(c1)O[B-]1(O2)n2cccc2[CH+]c2n1ccc2 529739
c1ccc2c(-c3cc4Cc5c(-c4cc3C2)cccc5)c1 530416
c1ccc(cc1)C#CC#CC#CC#Cc1ccccc1 531087
c1cc2cccc3c2c(c1)c1cccc2c1c3ccc2 531760
c1cc2c(s1)c1cc3ccc4c(c3cc1cc2)scc4 532435
[SiH3]C#Cc1c2ccccc2c(c2c1cccc2)C#C[SiH3] 533118
Oc1cccc2c1NC1=C(CN2)S(=O)(=O)CC(C1)(C)C 533800
Oc1ccc2c(c1)c1c3C(=O)NC(=O)c3ccc1n2C 534478
Oc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2O)C 535173
Oc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2=O)C 535864
O[C@H]1C[C@H]2CCc3c(CCN(C1)C2)c1c([nH]3)cccc1 536550
O[C@H]1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C)C 537253
O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CCC2)C)C1)C 537953
O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC=C2)C)C1)C 538654
O[C@H]1CC[C@]2(C(=CC=C3[C@@H]2CC[C@]2([C@H]3CCC2)C)C1)C 539350
O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C)C 540055
O=C1c2ccccc2[C@](c2c1ccc1c2nc[nH]1)(C)O 540735
O=C1c2ccccc2N/C/1=C\1/Nc2c(C1=O)cccc2 541413
O=C1c2ccccc2C/C/1=C\1/Cc2c(C1=O)cccc2 542091
O=C1c2ccccc2C(=O)c2c1c1[nH]c(=O)[nH]c1cc2 542773
O=C1c2cccc3c2c([C@]21CC[C@H]1N2CCC1)ccc3 543454
O=C1[C@@H]2[C@@H]3C(=O)c4c([C@@H]3[C@@H]2c2c1cccc2)cccc4 544151
O=C1O[C@H]2[C@@H](C1)[C@](C)(O)[C@H]1[C@@]3(CC2)C[C@@H](CC1)[C@H](C3)C 544862
O=C1OCCOC(=O)c2c(-c3c1cccc3)cccc2 545536
O=C1OCC2=C[C@@H]3[C@@H]4[C@](C2=C1)(C)CCC[C@]4(C)C(=O)O3 546233
O=C1Nc2c(/C/1=C/1\C(=O)Nc3c1cccc3)cccc2 546913
O=C1NCCSSCCC(=O)N2[C@H](C(=O)NC1)CCC2 547591
O=C1NCCCCCCn2cc(CC1)c1ccccc21 548263
O=C1NC/C=C\Cc2ccc(C[C@H](C(=O)NC1)O)cc2 548943
O=C1NC(=O)c2c3c1ccc1c3c(cc2)C(=O)NC1=O 549622
O=C1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C)C 550322
O=C1CC[C@]2([C@H](C1)CC=C1[C@@H]2CC[C@]2([C@H]1CCC2)C)C 551018
O=C1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C)C 551719
O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C)C 552416
O=C1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CCCC2 553110
O=C1CC(C)(C)CC2=C1CC1=C(O2)CC(CC1=O)(C)C 553791
O=C1CC(C)(C)CC2=C1CC1=C(N2)CC(CC1=O)(C)C 554472
O=C1CC(C)(C)CC(=O)C21CNc1c(C2)c(=O)[nH]cn1 555155
O=C1C=C[C@]2([C@H](N1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C)C 555856
O=C1C=C[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C)C 556554
O=C1C=C[C@H]2[C@]3(C1)CCN([C@H]2Cc1c3c(O)ccc1)C 557242
O=C1C(=O)c2ccccc2-c2c1cc1c(C)n[nH]c1n2 557921
O1[Si@@H]2O[Si@@H]3O[Si@@H]4O[Si@H]1O[Si@@H]1O[Si@H](O2)O[Si@H](O3)O[Si@@H](O1)O4 558643
O1[C@@H]2[C@@H]3[C@H]([C@H]1c1c2cccc1)[C@@H]1O[C@H]3c2c1cccc2 559353
N=C1C[C@@H]2[C@@H]([C@@]3([C@@H]1CCCC3)C)CC[C@]1([C@H]2CCC1)C 560055
N1=[PH2]N=P2(N=[PH2]1)Oc1ccccc1-c1c(O2)cccc1 560740
N#CC1=C2Cc3ccccc3C=C2C(C1=O)(C#N)C#N 561420
F[B-]1(F)n2c(cc3c2ccs3)[N-]c2n1c1ccsc1c2 562101
F[B-]1(F)n2c(cc3c2cco3)[CH+]c2n1c1ccoc1c2 562785
Clc1ccc2c(c1)C[C@H]1[C@@H](O2)[C@@H](O)c2c(C1)cccc2 563477
Cl[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CCC2)C)C1)C 564179
Cc1ccc2c(c1)Cc1cc(C)ccc1OP(=O)(O2)[O-] 564859
Cc1ccc2c(c1)CN1CCN2Cc2c1ccc(c2)C 565533
Cc1ccc(c2-c3c4c(-c12)c(C)ccc4ccc3C)C 566210
Cc1cc(=O)c2c(o1)cc1c(c2O)[C@@H](O)[C@@H]2[C@H](C1=O)O2 566905
Cc1c(I)c(c2n1[B-](F)(F)n1c([CH+]2)c(c(c1C)I)C)C 567593
C[Si]1(C)[Si@@H]2[Si](C)(C)[Si]([Si@H]([Si]1(C)C)[Si]([Si]2(C)C)(C)C)(C)C 568309
C[N@H+]1CC[C@@]23[C@@H]4[C@H]1Cc1c3c(O[C@H]2[C@H](C=C4)O)ccc1 569019
C[C@]12CCCC[C@H]1CC[C@@H]1[C@@H]2CC[C@]2([C@]1(O)CCC2)C 569715
C[C@H]1CC[C@]2(C)[C@H](C)CC[C@]3([C@H]([C@@H]1O)C)[C@H]2C(=O)CC3 570420
C[C@H]1CCC[C@@]2([C@@H]1CC[C@]13[C@H]2CC[C@@](C3)(C(=O)C1)C)C 571122
C[C@H]1CCC[C@@]2([C@@H]1CC[C@]13[C@H]2CC[C@@](C3)(C(=N)C1)C)C 571824
C[C@H]1CCCC(=O)N(C)/C=C\CC[C@@H](C(=O)OCC1)C 572509
CN1CC[C@@]23[C@@H]4[C@H]1Cc1c3c(O[C@H]2[C@H](C=C4)O)ccc1 573206
CN1CC(=O)N2[C@@H](C1=O)Cc1c(C2)[nH]c2c1cccc2 573891
CC1(C)c2ccccc2N[C@]21C=Cc1c(O2)cccc1 574568
C=C1C(=O)O[C@H]2[C@H]1C[C@]1(O)O[C@@H](C[C@H]1C)C[C@](C2)(C)O 575270
C1CN2[C@@]3(C1)C=CC[C@H]3c1c(CC2)cc2c(c1)OCO2 575956
Brc1ccc2c(c1)c1ccccc1c1c2ccc(c1)Br 576631
Brc1c(Br)c(c2n1[B-](F)(F)n1c([CH+]2)c(c(c1Br)Br)Br)Br 577327
c1ccc2c(c1)[nH]c1c2CCN2[C@@H]3[C@H]1C[C@H](C2)CC3 578023
c1ccc2c(c1)[C@@H]1[NH+]=C3[C@@]2(SC=C3)c2c1cccc2 578680
c1cc2n3c1[CH+]c1ccc4n1[BH-]3n1c([CH+]2)ccc1[CH+]4 579339
c1cc2ccc3c4c2c(c1)c1O[BH2-]Oc1c4ccc3 579984
c1cc2c(s1)c1sc3c(c1cc2)ccc1c3scc1 580626
c1cc2Cc3c4c2c(c1)c1ccccc1c4ccc3 581269
c1cc2-c3ccccc3C3c2c(-c2ccccc32)c1 581911
Oc1ccc2c(c1)c1c([nH]2)ccc2c1C(=O)NC2=O 582558
Oc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C 583215
Oc1cc2OC(C)(C)C=Cc2c2c1C=CC(O2)(C)C 583859
O[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCc2c1cccc2 584517
O[C@@H]1[C@@H]2O[C@H](C)[C@H](O[C@H]2C[C@@H]2[C@@H]1O[C@@H](C)[C@@H](O2)C)C 585201
O=c1c2ccccc2cc2n1ccc1c2cccc1 585838
O=c1c2=CCCNn2c2=NCc3c(Cn12)cccc3 586479
O=S1(=O)N[C@@]2(c3c1cccc3)CCc1c2cccc1 587125
O=C1c2ccccc2[C@]2(N1CCc1c2cccc1)O 587768
O=C1c2ccccc2[C@@]2(N1CCc1c2cccc1)O 588411
O=C1c2ccccc2C(=O)c2c1ccc1c2[nH]cn1 589054
O=C1OP2(c3c1cccc3)OC(=O)c1c2cccc1 589696
O=C1OC(C)(C)OC(=O)C21CCC1(CC2)OCCO1 590341
O=C1Nc2c(/C/1=C/C#Cc1ccccc1)cccc2 590983
O=C1NCCc2ccc(cc2)OCCCC(=O)NC1 591621
O=C1NCCCOc2ccc(CCC(=O)NC1)cc2 592259
O=C1NC(=O)c2c1cc1SC(=C3SC=CS3)Sc1c2 592903
O=C1C[C@H]2[C@H](O1)[C@H]1O[C@]1(C)CC[C@@H]1[C@]([C@@H](C2)O)(C)O1 593582
O=C1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCc2c1cccc2 594237
O=C1CCN2N1CC1(C2)C(=O)c2c(C1=O)cccc2 594882
O=C1CCC2=C3CC[C@]4([C@H]([C@@H]3CCC2=C1)CCC4)C 595537
O=C1C=C[C@H]2[C@]3(C1)CCN([C@H]2Cc1c3cccc1)C 596190
O=C1C=C2OC(C)(C)CC[C@@]32C(=O)[C@H]1C(C)(C)CC3 596845
O1CCOCCOc2c(OCCOCC1)cccc2 597479
O1CCOCCO[P@@H]2=N[PH2]=N[P@@H](=N2)OCCOCC1 598130
NC1=N[C@@]2(CO1)c1ccccc1Oc1c2ccnc1 598776
NC1=NC2(CO1)c1ccccc1Oc1c2cccc1 599415
N1C[C@@H]2[C@H](C1)[C@@H]1c3c([C@H]2c2c1cccc2)cccc3 600075
N#Cc1cnc2-c3[nH]c4c(c3CCc2c1)cccc4 600718
N#Cc1c(N)c(C#N)cc2c1-c1ccccc1CC2 601359
N#CC1(C#N)[C@@H]2C[C@H](C1(C#N)C#N)c1c2cccc1 602012
Fc1c(C#Cc2ccncc2)c(F)c(c(c1F)F)F 602653
F[B-]1(F)Nc2ccccc2-c2[n+]1c1ccccc1o2 603298
Cn1cc2-c3ccccc3NCc3c2c(c1=O)[nH]c3 603941
ClP1(=NP2(=NP(=N1)(Cl)Cl)NCc1c(O2)cccc1)Cl 604592
Cc1nc2sc3c(c2c2c1c(=O)[nH]cn2)CCCC3 605243
Cc1ccc2c(c1)Cc1cc(C)ccc1OP(=O)O2 605885
Cc1ccc2c(c1)CN1CN2Cc2c1ccc(c2)C 606526
Cc1cc(c2n1[B-](F)(F)n1c([C+]2C)c(cc1C)C)C 607176
Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)ccc1 607822
Cc1c(C)ccc2c1c1c(ccc(c1C)C)o[pH]o2 608465
C[C@]12CCC[C@H]2[C@H]2[C@H](CC1)[C@@]1(C)CC[C@H]3[C@]1(CC2)C3 609136
C[C@]12CCC[C@H]2[C@H]2[C@H](CC1)[C@@]1(C)CCCCC1=CC2 609796
C[C@]12CCCC[C@H]1CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C 610458
C[C@]12CCCC[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2)C 611121
C[C@]12C=CC[C@H]2[C@H]2[C@H](CC1)[C@@]1(C)CCCCC1=CC2 611782
C[C@H]1CCC[C@@]2([C@@H]1CC[C@@]13[C@H]2CC[C@H](C3)C(=C)C1)C 612450
C[C@@]12CCC[C@@H]2[C@@H]2[C@@H](CC1)[C@]1(C)CCCCC1=CC2 613113
C[C@@H]1CC[C@]2([C@H](C3=C(CC[C@H]13)C)OC(=O)[C@@]2(C)O)O 613779
C[C@@H]1CC[C@@H]2[C@@]34[C@H]1CC[C@@](OO3)(O[C@H]4OC[C@@H]2C)C 614450
CN1CC[C@@]23[C@@H]4[C@H]1Cc1c3c(O[C@H]2CC=C4)ccc1 615108
CN1CCOCc2c(-c3c(C1)cccc3)cccc2 615747
CC1=CCC[C@H]2[C@@H]1[C@H]1[C@@H]2C(=O)[C@@]2(O1)[C@H](C)COC2=O 616418
C=C1CC[C@H]2[C@@](C1)(C)CC[C@@H]1[C@@]2(C)COC(O1)(C)C 617080
C1C[C@@H]2CCn3c4[C@@H]2N(C1)CCc4c1c3cccc1 617730
*c1ccc2c(c1)nc1c(c2N)[C@@H]2CC=C[C@H](C1)C2 618382
c1cnc2c(n1)c1nccnc1c1c2nccn1 619019
c1ccc2c(c1)nc1c(n2)ccc2c1cccc2 619626
c1ccc2c(c1)ccc1c2c2ccccc2cc1 620231
c1ccc2c(c1)cc1c(c2)ccc2c1cccc2 620838
c1ccc2c(c1)cc1c(c2)cc2c(c1)cccc2 621447
c1ccc2c(c1)c1ccccc1c1c2cccc1 622052
c1ccc2c(c1)c1ccc3c(c1cc2)cccc3 622659
c1ccc2c(c1)[C@@H]1CNc3c([C@H]1CN2)cccc3 623275
c1ccc2c(c1)Oc1ccccc1[C@H]1N2CC=C1 623885
c1ccc2c(c1)O[C@@]1(CC2)Cc2c(O1)cccc2 624498
c1ccc2c(c1)O[BH-]1[BH-](O2)Oc2c(O1)cccc2 625115
c1ccc2-c3nc4ccccc4cc3CCc2c1 625719
c1ccc2-c3[nH]c4c(c3CC=Nc2c1)cccc4 626329
c1ccc(cc1)C#Cc1ccc2c(c1)cccc2 626935
[SiH2]1O[Si@@H]2O[SiH2]O[Si@H](O1)O[Si@@H]1O[SiH2]O[Si@H](O2)O[SiH2]O1 627582
[NH2+]1CCOCCOCC[NH2+]CCOCCOCC1 628197
SC1=C(S)[C@H]2[C@@H](OC1)Nc1c(N2)c(=O)[nH]c(n1)N 628822
Oc1cccc2c1C(=O)c1c(C2=O)cccc1O 629431
Oc1ccc(c2c1C(=O)c1ccccc1C2=O)O 630038
Oc1cc2OC(C)(C)C=Cc2c2c1c(=O)cco2 630647
O[C@H]1CC2=CCC[C@]2(C)C=C2[C@H]([C@H]1C)CC[C@H]2O 631273
O[C@@H]1c2ccccc2N2[C@@]3([C@H]1C=CO3)CCC2=O 631893
OCC#CC(=C(C#CCO)C#CCO)C#CCO 632497
O=c1ccc2c(o1)c1CCCN3c1c(c2)CCC3 633105
O=c1ccc2c(o1)c1C=CC(Oc1cc2O)(C)C 633714
O=[N+]1C(C)(C)C=C(C1(C)C)C#Cc1ccccc1 634327
O=C1c2ccccc2[C@@H]2C1=Cc1ccccc1O2 634937
O=C1c2ccccc2N(c2c(N1C)cncn2)C 635543
O=C1c2ccccc2C(=O)C21CC[C@H]1N2CCC1 636154
O=C1c2ccccc2-c2c3c1cccc3ccc2 636759
O=C1c2ccccc2-c2c1c1ccccc1cc2 637364
O=C1OC[C@@]23C(=C1)C[C@@]1(C=C2)C(=CC(=O)OC1)C3 637988
O=C1OCC[C@H]2C1=CC[C@@H]1[C@]2(C)CCCC1(C)C 638607
O=C1NCC21c1ccccc1Oc1c2cccc1 639211
O=C1NC(=O)[C@H]2[C@@H]1[C@@]1(Cl)C(=C([C@@]2(C1(Cl)Cl)Cl)Cl)Cl 639850
O=C1NC(=O)N=C2[C@@H]1Nc1cc(C)c(cc1N2)C 640471
O=C1N(C)c2c([C@]31CC[C@H]1N3CCC1)cccc2 641086
O=C1C[C@H]2[C@H](O1)[C@H]1O[C@]1(C)CC/C=C(/[C@@H](C2)O)\C 641720
O=C1C[C@@H]2[C@@H](O1)[C@@H]1O[C@@]1(C)CC/C=C(/[C@H](C2)O)\C 642357
O=C1CO[C@]2(CN1)OC[C@@H]1[C@H](C2=O)OC(O1)(C)C 642980
O=C1CCCc2c1c(O)c1c(c2)ccc(c1O)C 643588
O=C1CCC[C@]2([C@H]1[C@@]1(C)CCOC(=O)[C@@H]1CC2)C 644213
O=C1CCC[C@H]2N1CCc1c2[nH]c2c1cccc2 644824
O=C1CCC[C@H]2N1CC[C@@]12CNc2c1cccc2 645436
O=C1CCC[C@@H]2N1CCc1c2[nH]c2c1cccc2 646048
O=C1CC(C)(C)CC2=C1CNc1c(N2)cccc1 646657
O=C1CC(C)(C)CC(=O)C21CNc1c(C2)cn[nH]1 647271
O=C1C=C[C@]2([C@@H](C1)C)Oc1c(C2=O)cccc1Cl 647890
O1CCOCCOCCOCCOCCOCC1 648488
N=C1C(=N)[C@@H]2c3c([C@H]1c1c2cccc1)cccc3 649106
N1CCOCCOCCOCCOCCOCC1 649703
N#Cc1c(C#N)ccc2c1[n-]c1[n+]2cccc1C 650314
N#CC1=C(N)Oc2c(C1)c(=O)oc1c2cccc1 650924
N#CC(=C1c2ccccc2-c2c1cccc2)C#N 651531
Ic1c[n+]2c3ccccc3[nH]c2c2c1cccc2 652140
Fc1cc(F)c(c(c1F)[I-2][H][n+]1ccccc1)F 652755
Fc1c(F)cc(c(c1C#Cc1ccccc1)F)F 653362
F[B-]1(F)n2cccc2[CH+]c2n1c1ccccc1c2 653974
F[B-]1(F)n2cc(c(c2[CH-]c2n1cc(c2C)C)C)C 654590
F[B-]1(F)n2c(Cl)c(cc2[CH+]c2n1c(Cl)c(c2)Cl)Cl 655212
F[B-]1(F)n2c(Br)c(cc2[CH+]c2n1c(Br)c(c2)Br)Br 655838
FC1(F)c2ccc3c(c2C(C1(F)F)(F)F)ccs3 656453
Cn1c2nc3ccccc3cc2c(=O)n(c1=O)C 657061
Cn1c2Oc3ccccc3Cc2c(=O)n(c1=O)C 657668
Cl[SiH-2]12(Oc3[n+](O2)cccc3)Oc2[n+](O1)cccc2 658290
Cc1nc2cc[n-][n+]2c2-c3c(CCc12)cccc3 658904
Cc1n[nH]c2c1cc1CCc3c(-c1n2)cccc3 659513
Cc1n[nH]c2c1cc1-c3ccccc3CCc1n2 660120
Cc1ccc2c3c1-c1cnncc1-c3c(cc2)C 660727
Cc1ccc2c(c1)cc1c(n2)[nH]c2c1cccc2 661337
Cc1ccc2c(c1)CN1CN2Cc2c1cccc2 661942
Cc1cc2nc3-c([nH]c2cc1C)nc(=O)[nH]c3=O 662556
Cc1cc2[nH+]c3-c([nH]c2cc1C)nc(=O)[nH]c3=O 663174
Cc1cc2Nc3c(Nc2cc1C)[nH]c(=O)[nH]c3=O 663787
Cc1cc(c2n1[BH-](F)n1c(C)cc(c1[C+]2C)C)C 664403
Cc1cc(c2n1[B-](F)(F)n1c([CH-]2)c(cc1C)C)C 665021
Cc1cc(c2n1[B-](F)(F)n1c([CH+]2)c(cc1C)C)C 665639
Cc1c2CCc3c(-c2nc2[n+]1[n-]cc2)cccc3 666251
C[Si](C#Cc1ccc(cc1)C#C[Si](C)(C)C)(C)C 666866
C[Si](C#Cc1ccc(cc1)C#C[Si](C)(C)C)(C)C 667483
C[C@]12c3ccc4[C@@]2(C)c(ccc1ccc3)ccc4 668099
C[C@]12CCC[C@H]2[C@H]2[C@H](CC1)c1ccccc1CC2 668719
C[C@H]1COC(=O)[C@H](C)C[C@H](C[C@H](C(=O)/C=C/1)C)C 669347
C[C@H]1CC[C@]23[C@H](C1)C(C)(C)CCC[C@]2(C3(Cl)Cl)C 669974
C[C@H]1CCC[C@]2([C@H]1CC[C@]13[C@@H]2C[C@H](CC1)C=C3)C 670607
C[C@@H]1Oc2ccccc2-c2c(O[C@H]1C)cccc2 671220
C[C@@H]1CCC[N@@H+]2[C@@H]1c1oc3c(c1CC2)cccc3 671841
CN1c2ccccc2N2[PH2]1N(C)c1c2cccc1 672450
CN1CC[C@@H]2[C@H]1c1c(OC2)ccc2c1cccc2 673065
CN1CCOCc2c(-c3c(C1)cccc3)csc2 673671
CN1CCC[C@]21C(=O)c1c3c2cccc3ccc1 674281
CC1c2cc(C)ccc2N(c2c1cc(C)cc2)C 674888
CC1=[N+]2C(=Cc3n([B-]2(F)F)c(C)cc3C)C(=C1)C 675508
CC1=Cc2cc(C)c3c([n+]2[B-](O1)(F)F)nccc3 676124
CC1(C)COC2=[N+]1[BH-]1CC[BH-]2C2=[N+]1C(C)(C)CO2 676749
CC(C#Cc1cccc(c1)C#CC(O)(C)C)(O)C 677358
C1[C@@H]2C[C@@H]3[C@@H]4[C@H]1[C@@H]1[C@]5(C2)[C@H]3[C@@H]2[C@H](C4)[C@H]1C[C@H](C5)C2 678021
C1NCCOCCOCCNCCOCCOC1 678618
C1CSC2=C(S1)S/C(=C/1\SC3=C(S1)SCCS3)/S2 679234
C1=C[C-]=C=C[C-]=C=C[C-]=C=C[C-]=C=C[C-]=C=C[C-]=1 679869
C1=CSC(=C2c3cccnc3-c3c2cccn3)S1 680477
C1=CSC(=C2Sc3c(S2)cc2c(c3)nccn2)S1 681090
C1=CS/C(=C\2/SC3=C(S2)S/C(=C/2\SC=CS2)/S3)/S1 681716
C/C/1=C\CC[C@@]2(C)O[C@@H]2[C@@H]2[C@@H](CC1)C(=C)C(=O)O2 682358
C#Cc1ccc(cc1)C#Cc1c[nH]c(=O)nc1N 682967
Brc1c2cccc3c2c2c(c1Br)cccc2cc3 683574
c1ccc2c(n1)c1ncccc1c1c2[nH]cn1 684183
c1ccc2c(c1)nc1c(n2)[nH]c2c1cccc2 684760
c1ccc2c(c1)ccc1c2[cH-]c2[n+]1cccc2 685339
c1ccc2c(c1)cc1c(c2)sc2c1cccc2 685913
c1ccc2c(c1)cc1c(c2)[nH]c2c1cccc2 686491
c1ccc2c(c1)c1ccccc1c1c2c[nH]c1 687066
c1ccc2c(c1)c1ccccc1c1c2[nH]cn1 687641
c1ccc2c(c1)c1[nH]c3c(c1cc2)cccc3 688218
c1ccc2c(c1)P1(OC2)OCc2c1cccc2 688792
c1ccc2c(c1)O[B-]1(O2)Oc2c(O1)cccc2 689372
c1ccc2c(c1)N1CN(C2)c2c(C1)cccc2 689948
c1ccc2c(c1)C=[N+]1[BH-](O2)Oc2c1cccc2 690530
c1ccc2c(-c3cc4cccc[n+]4cc3C2)c1 691106
c1ccc2[n+](c1)O[SiH2-2]1(O2)Oc2[n+](O1)cccc2 691695
c1ccc2-c3sc4c([n+]3[BH2-]Oc2c1)cccc4 692277
c1ccc2-c3oc4c([n+]3[BH2-]Oc2c1)cccc4 692859
c1ccc2-c3nc4c(n3CNc2c1)cccc4 693432
c1ccc2-c3cc4c(n3CCc2c1)cccc4 694005
c1ccc(cc1)[I+]c1ccc2c(c1)cccc2 694580
c1ccc(cc1)C#Cc1cccc2c1nsn2 695152
c1ccc(cc1)C#C[SiH2]C#Cc1ccccc1 695728
c1cc2c(s1)c1c([nH]2)c2c(s1)c1c([nH]2)ccs1 696315
c1[nH+]cc2c(c1)ccc1c2c2ccccc2[nH]1 696897
[BH2-]1Oc2c(O1)c1ccccc1c1c2cccc1 697474
Oc1cccc2c1C(=O)c1ccccc1C2=O 698046
Oc1ccc2c3c1ccc1c3c(cc2)ccc1 698618
Oc1ccc2c(c1)[nH]c1-c(c2)c(=O)[nH]c(=O)n1 699203
Oc1ccc2c(c1)C(=O)c1c(C2=O)cccc1 699779
O[C@H]1CN2[C@@H](C1)C(=O)Nc1c(C2=O)cccc1 700364
O[C@H]1CC2=CCC[C@]2(C)C=C2[C@H]([C@H]1C)CCC2 700953
O[C@@]1(C#Cc2ccccc2)CN2CC[C@H]1CC2 701532
OC1=C[C@H]2[C@@H]([C@H](C1)C)C(=O)C=CC12OCCO1 702122
OC1=CC(=O)[C@@]2(C(=C1)Oc1c2c(O)ccc1)C 702705
O=c1cccc2-c3ccccc3CCCc2c1 703275
O=c1[nH]c(=O)c2c(c3c1cccc3)cccc2 703852
O=CC#CC1c2ccccc2-c2c1cccc2 704423
O=C1c2ccccc2-c2c3c1cccc3n[nH]2 704998
O=C1c2ccccc2-c2c3c1cccc3[nH]n2 705573
O=C1OC[C@H]2[C@H]1Cc1cc3OCOc3cc1C2 706152
O=C1OC[C@@H]2[C@@H]1Cc1cc3OCOc3cc1C2 706733
O=C1Nc2c([C@]31CC[C@H]1N3CCC1)cccc2 707313
O=C1Nc2c([C@@]31CC[C@@H]1N3CCC1)cccc2 707895
O=C1Nc2c(Nc3c1cccn3)nccc2C 708466
O=C1NC[C@@H](n2c1c(O)c1c2cn[nH]c1=O)C 709048
O=C1NCCc2c3c(N(C1)C)cccc3[nH]c2 709624
O=C1NC(=O)[C@]23[C@@]1([C@H]1C=C[C@@H]3O1)[C@@H]1C=C[C@H]2O1 710229
O=C1C[C@H]2[C@H](O1)[C@H]1O[C@]1(C)CC/C=C(/CC2)\C 710823
O=C1C[C@@H]2[C@@](N1)(C)OC1=C2C(=O)CC(C1)(C)C 711413
O=C1CC[C@H]2N1CCc1c2[nH]c2c1cccc2 711991
O=C1CCN2[C@H]3N1CCN1[C@H]3N(CC2)CCC1 712572
O=C1CCCC2=C1C[C@H]1C(=O)CCC[C@@]1(O2)O 713155
O=C1CCCC2=C1C(=O)c1ccccc1C2=O 713729
O=C1CC(C)(C)Cc2c1cc1c(C)n[nH]c1n2 714307
O=C1CC(C)(C)CC2=C1Cc1c(N2)n[nH]c1C 714886
Nc1cccc2c1Oc1ccccc1C2(C)C 715456
Nc1cccc2c1C(=O)c1ccccc1C2=O 716028
Nc1ccc(cc1)C#CC#Cc1ccccc1 716598
Nc1ccc(cc1)C#CC#Cc1ccccc1 717168
Nc1ccc(cc1)C#CC#Cc1ccccc1 717738
N#Cc1cc2CCc3c(-c2[nH]c1=O)cccc3 718314
N#C[C@@H]1CCN([C@]21C(=O)Nc1c2cccc1)C 718896
N#CC1=C(N)Oc2c(C1)ccc1c2cccc1 719470
N#CC1=C(N)Oc2c(C1)c1ccccc1cc2 720044
N#CC1=C(N)OC2=C(C1)c1ccccc1CC2 720619
Fc1cc2[C@]3(CCOc2cc1)NC(=O)NC3=O 721196
Cc1sc2c(c1C)c1nc[nH]c(=O)c1c(n2)C 721774
Cc1csc2c1c1c(cc2)sc2c1cccc2 722347
Cc1ccc[n+](c1)[H][O-]c1c(Cl)cccc1Cl 722929
Cc1ccc2c(c1)nc1-c([nH]2)nc(=O)[nH]c1=O 723514
Cc1cc(c2n1[BH2-]n1c(C)cc(c1[C+]2C)C)C 724096
Cc1c[n+]([O-])c2c(c1)CC[C@H]1[C@@H]2OC(O1)(C)C 724687
Cc1[nH]nc2-c3ccccc3S(=O)(=O)N(c12)C 725267
C[SiH]1[Si](C)(C)[Si](C)(C)[Si]([Si]([Si]1(C)C)(C)C)(C)C 725869
C[SiH-]12Sc3c(N1Cc1[n+]2cccc1)cccc3 726455
C[N@@H+]1CCc2c(C1)[nH]c1c2C(=O)CC(C1)(C)C 727043
C[N@@H+]1CCC=C2[C@H]1Cc1c[nH]c3c1c2ccc3 727627
C[N+](=c1ccc2-c(c1)oc1c(c2)cccc1)C 728206
C[C@]12C=C[C@H](c3c1cccc3)c1c2cccc1 728786
C[C@H]1CC[C@@]2([C@@H]3[C@@]1(O)OOC([C@@H]3CC2)(C)C)C 729384
CN1CCc2c(C1)[nH]c1c2C(=O)CC(C1)(C)C 729964
CN1CCC=C2[C@H]1Cc1c[nH]c3c1c2ccc3 730542
CC1=C[C@@H]2[C@@](CC1)(C)[C@@]1(C)CC[C@@H](O2)[C@]21CO2 731142
CC1(C)Oc2ccccc2-c2c(O1)cccc2 731715
CC1(C)CCc2c(O1)ccc1c2oc(=O)cc1 732290
CC1(C)CCC[C@]2([C@H]1CCc1c2cccc1)C 732869
CC1(C)CCC[C@@]2([C@@H]1CCc1c2cccc1)C 733450
CC#Cc1ccccc1C#Cc1ccncc1 734018
C1C[C@H]2[C@@H](O1)c1c(NC2)ccc2c1cccc2 734601
C1C[C@@H]2CCC[C@H](C1)[B@@-]12C=Cc2[n+]1cccc2 735191
C1CC[C@@H]2N(C1)CCc1c2[nH]c2c1cccc2 735771
Brc1cc2C[C@H]3CCN(c2c2c1cccc2)O3 736348
Brc1cc2CCc3ccc(CCc1cc2)cc3 736920
n1ncc2-c3c4c(-c2c1)cccc4ccc3 737494
n1cc2ccc3c4c2c(c1)ccc4c[nH+]c3 738037
c1nc2ccc3c4c2c(n1)ccc4ncn3 738576
c1ccc2c(c1)c1sc3c(c1s2)cccc3 739117
c1ccc2c(c1)c1cc[nH]c1c1c2cc[nH]1 739664
c1ccc2c(c1)c1[se]c3c(c1[se]2)cccc3 740211
c1ccc2c(c1)c1N3CC[C@@H](O3)Cc1cc2 740759
c1ccc2c(c1)[nH]c1-c3cccn3CCc21 741302
c1ccc2c(c1)[C@H]1Cc3c([C@H]1C2)cccc3 741851
c1ccc2c(c1)[C@@H]1[C@H]3[C@@H]1[C@@H]2c1c3cccc1 742411
c1ccc2c(c1)C[C@@H]1N2Cc2c1cccc2 742955
c1ccc2c(c1)C1=Cc3c(C1=C2)cccc3 743498
c1ccc2[n+](c1)[BH2-]Cc1[n+]([BH2-]C2)cccc1 744053
c1ccc2-c3c4c(-c2c1)cccc4ccc3 744594
c1ccc2-c3c([SiH2]c2c1)c1c([nH]3)cccc1 745144
c1ccc(cc1)C#CC#Cc1ccccc1 745682
c1ccc(cc1)C#CC#Cc1ccccc1 746219
c1cc2ccc3c4c2c(c1)ccc4ccc3 746758
c1cc2c(s1)ccc1c2ccc2c1ccs2 747297
c1cc2c(s1)c1ccc3c(c1cc2)scc3 747840
[nH]1cc2c(c1)SC(=C1Sc3c(S1)c[nH]c3)S2 748392
[O-]N1/C(=C\2/C=N[NH+]=C2)/[N+](=O)C(C1(C)C)(C)C 748957
[O-]/C=c/1\[n+]2ccccc2n2c1cccc2=O 749503
S=c1[nH]c2-c3[nH]c(=S)[nH]c3SSSSc2[nH]1 750055
S=C1N2CNCN3[C@H]2[C@@H]2N1CNCN2C3=S 750609
Oc1cccc2c1nc1c(O)cccc1c2 751148
Oc1ccc2c(c1)oc1-c(c2)ccc(=O)c1 751691
Oc1ccc2c(c1)[C@@H]1CC(C[C@@H]1CO2)(F)F 752242
Oc1ccc2c(c1)Oc1c(C2)ccc(c1)O 752783
O[C@@H]1c2ccccc2[C@H](c2c1cccc2)O 753329
O[C@@H]1c2ccccc2C=Cc2c1cccc2 753870
O[C@@H]1NC(=O)c2c1cc1C(=O)N[C@@H](c1c2)O 754423
O=c1oc2ccccc2c2c1N=CCC=C2 754961
O=c1oc2ccccc2c2c1CCCCC2 755497
O=c1c2ccccc2ccc2c1cccn2 756033
O=c1[nH]c(=O)c2c1sc1c(=O)[nH]c(=O)c1s2 756584
O=c1[nH]c(=O)c2c1cc1c(=O)[nH]c(=O)c1c2 757137
O=S1(=O)c2ccccc2Nc2c1cccc2 757676
O=P1c2ccccc2SSc2c1cccc2 758213
O=P1Oc2ccccc2-c2c(O1)cccc2 758755
O=C1c2ccccc2OCc2c1cccc2 759292
O=C1c2ccccc2CCc2c1cccc2 759828
O=C1c2ccccc2CCC[C@]21NN=CC2 760368
O=C1c2ccccc2CCC[C@@]21NN=CC2 760909
O=C1c2ccccc2C(=O)c2c1cccc2 761448
O=C1c2ccccc2C(=C)c2c1cccc2 761987
O=C1Nc2ccccc2Nc2c1cccc2 762523
O=C1NS(=O)(=O)c2c1c1ccccc1cc2 763065
O=C1NC[C@H]2[C@@H](c3c1[nH]c1c3cccc1)N2 763618
O=C1NCC(=O)NCC(=O)NCC(=O)NC1 764159
O=C1NC2(CCCCC2)Oc2c1cccc2 764697
O=C1NC(=O)c2c3c1cccc3c(cc2)N 765238
O=C1NC(=O)[C@H]2[C@@H]1[C@@H]1O[C@H]2c2c1cccc2 765797
O=C1N2c3ccccc3[C@@H]([C@@H]2NC1(C)C)O 766347
O=C1N2COCN3[C@H]2[C@@H]2N1COCN2C3=O 766895
O=C1N2CNCN3[C@H]2[C@@H]2N1CNCN2C3=O 767443
O=C1CSc2c(CN1)c1c(n2C)cccc1 767983
O=C1CC[C@]23[C@H]([C@H]1C)[C@@H]1C[C@H](C2)[C@](C3)(O1)C 768553
O=C1CC[C@H]2C(=CC[C@@H]3[C@H]2C(=O)NC3=O)N1 769109
O=C1CCCC2=C1CC1=C(O2)CCCC1=O 769650
O=C1CCCC2=C1CC1=C(N2)CCCC1=O 770191
O=C1CC(C)(C)Cc2c1cc1cn[nH]c1n2 770734
O=C1CC(C)(C)CC2=C1CC=C1N2CCS1 771276
O=C1C=C[C@]2(C=C1)CCOc1c2cccc1 771820
O=C1C(=O)C2=C(c3c1cccc3)OCCC2 772362
O1C[C@@H]2[C@H](C1)O[B@-]1(O2)OCc2c1cccc2 772916
Nc1ncc2c(n1)Nc1ccccc1C=N2 773454
Nc1ccc2c(c1)[nH+]cc1c2ccc(c1)N 773997
Nc1cc2cccc3c2c(c1)C(=O)NC3=O 774538
NC1=CCc2c(O1)c1ccccc1oc2=O 775077
N1=C/C(=c\2/o[n-]/c(=C\3/[N-]ON=C3)/o[n-]2)/[N-]O1 775640
N#Cc1ccccc1C#Cc1ccccc1 776175
N#C[C@]12CON([C@@H]2c2c(OC1)cccc2)C 776723
N#CC1=C(N)OC2=C(C1)C(=O)CC(C2)(C)C 777270
N#CC(=c1ccc(=C(C#N)C#N)cc1)C#N 777813
N#CC(=C1c2ccsc2-c2c1ccs2)C#N 778354
N#CC(=C1c2ccccc2C(=O)C1=C)C#N 778898
Fc1cc2OC[C@@H](n3c2c(c1)c(=O)cc3)C 779445
Fc1c(F)c(F)c2c(c1F)ccc(c2F)F 779986
F[B-]1(F)[NH+]=Cc2c(O1)ccc1c2cccc1 780533
F[B-]1(F)OC=Cc2[n+]1c1ccccc1nc2 781077
F[B-]1(F)OC=Cc2[n+]1c1ccccc1cc2 781621
Clc1cn2c(c1)[CH+]c1n([B-]2(F)F)cc(c1)Cl 782173
Clc1ccc2c(c1)Nc1ccccc1CC2 782713
Clc1ccc2c(c1)N=Cc1c(O2)nccc1 783255
Clc1ccc2c(c1)N=Cc1c(N2)cccc1 783797
Clc1ccc2c(c1)C=Nc1c(O2)cccc1 784339
Cc1nc(C)cc(c1)C#Cc1ccccc1 784878
Cc1cn2c(c1)[CH-]c1n([B-]2(F)F)cc(c1)C 785428
Cc1ccn2c1[CH+]c1c(C)ccn1[B-]2(F)F 785974
Cc1ccc2n1[B-](F)(F)n1c([CH+]2)ccc1C 786522
Cc1ccc2c(n1)oc1c(c2=O)cccc1 787062
Cc1ccc2c(c1)cc1c([o+]2)ccc(c1)C 787606
Cc1ccc2c(c1)[PH-]=c1c(=[O+]2)ccc(c1)C 788156
Cc1ccc2c(c1)C(C)(C)[C@@H](CC2(C)C)C 788705
Cc1ccc2c(c1)C(=O)[C@]1(C(=N2)NCC1)O 789253
Cc1cc[n+]2c(-c3cccc[n+]3CCC2)c1 789797
Cc1cc(c2n1[BH2-]n1c(C)cc(c1[CH+]2)C)C 790347
Cc1cc(c2n1[B-](F)(F)n1c([CH-]2)ccc1)C 790897
Cc1cc(C#Cc2cccnc2)nc(n1)N 791435
Cc1c(C)sc2-n3c(C)nnc3CN=Cc12 791976
C[Si@@H]1[Si](C)(C)[Si](C)(C)[Si@H]([Si]([Si]1(C)C)(C)C)C 792547
C[N+]1(C)Cc2c([B-]31OBOBO3)cccc2 793098
C[C@]12CCC[C@@]2(C)[C@H]2[C@]3(CC1)C[C@@H]3CCC2 793658
C[C@H]1O[C@@]2(N(C1=O)CC(=O)N1[C@H]2CCC1)O 794213
C[C@H]1N=C2C[C@@H]3[C@H](C[C@@]2(OC1=O)C)C3(C)C 794773
C[C@H]1CCCc2c1cc(O)c1c2cccc1 795314
C[C@H]1CCC[C@]2([C@H]1CCc1c2cccc1)C 795862
C[C@H]1CCC[C@]2([C@H]1CCC1=C2CCCC1)C 796411
C[C@@H]1NCc2c3n(C1)c(=S)[nH]c3cc(c2)* 796961
C[C@@H]1C[C@H](O)[C@@]23[C@H]([C@H]1C)CCC=C3COC2 797523
C[C@@H]1CCC[C@@]2([C@@H]1CCc1c2cccc1)C 798074
C[C@@H]1CCC[C@@]2([C@@H]1CC[C@H]1[C@@]2(C)CCC1)C 798635
C[C@@H]1CCC[C@@]2(C1)N(C)C(=O)[C@H]1N2OCC1 799190
CN1c2ccccc2-c2c(S1(=O)=O)cn[nH]2 799735
CC1N(C)c2cccc3c2c(N1C)ccc3 800275
CC1(C)c2ccccc2Oc2c1cccc2 800812
CC1(C)Sc2c(S1)cc1c(c2)SC(S1)(C)C 801357
CC1(C)O[C@H]2[C@@H](O1)CO[C@H]1[C@@H]2OC(O1)(C)C 801922
CC1(C)O[C@@H]2[C@H](O1)CO[C@@H]1[C@H]2OC(O1)(C)C 802483
CC1(C)OC[C@H]2[C@@H](O1)[C@@H]1OC(O[C@@H]1O2)(C)C 803045
CC1(C)C=Cc2c(O1)ccc1c2OCCC1 803585
C=C1c2ccccc2OCc2c1cccc2 804121
C=C1c2ccccc2CCc2c1cccc2 804657
C=C1c2ccccc2C=Cc2c1cccc2 805194
C=C1CO[C@H]2[C@H]([C@@H]1O)O[C@@]1(CC2)CCCO1 805751
C1Cc2ccc(cc2)CCc2ccc1cc2 806288
C1C[C@H]2[C@@H](N1)c1ccccc1N1[C@@H]2CCC1 806841
C1C[C@H]2C[C@@H]1c1c2cc2c(c1)[C@@H]1CC[C@H]2C1 807400
C1C[C@@H]2c3c([C@H]1c1c2cccc1)cccc3 807948
C1CN[P@@]2(=N[PH2]=N[P@]3(=N2)NCCCO3)OC1 808501
C1CNCCN2CNC[C@@H]2CNCCNC1 809042
C1CC[C@]2(OC1)OCCC1(C2)SCCCS1 809584
C1=C[C@@H]2c3c([C@H]1c1c2cccc1)cccc3 810135
*c1ccc2-c3ncncc3CN=Cc2c1 810672
*c1ccc(cc1)C#Cc1ccccc1* 811208
c1ccc2c(c1)nc1c(n2)[C@@H]2C[C@H]1cc2 811757
c1ccc2c(c1)c1ccccc1o[pH]o2 812264
c1ccc2c(c1)Sc1ccccc1C=N2 812770
c1ccc2c(c1)Oc1ccccc1C=N2 813276
c1ccc2c(c1)Nc1ccccc1CC2 813780
c1ccc2c(c1)CCc1c(C2)cccc1 814286
c1ccc2c(c1)C=Cc1c(N2)cccc1 814793
c1ccc2c(c1)C=Cc1c(C2)cccc1 815300
c1ccc2c(-c3ccccc3COC2)c1 815805
c1ccc2c(-c3ccccc3CNC2)c1 816310
c1ccc2c(-c3ccccc3C32CC3)c1 816817
c1ccc2-c3[n+]4c(-c2c1)cccc4c[cH-]3 817332
c1cc2c(s1)c1ccsc1c1c2scc1 817838
[SiH2]1[C@@H]2c3c([C@H]1c1c2cccc1)cccc3 818361
[O-][n+]1c2ccccc2cc2c1cccc2 818870
[NH2+]=C1c2cccn2[B-](n2c1ccc2)(F)F 819385
[CH-]=C=C1NC(C[C@@]21CCC[C@H](C2)C)(C)C 819905
[C-3]c1c2nc[c-]cc2[c-]c2c1nc[c-]c2 820420
Oc1cccc2c1c1ccccc1cc2 820922
Oc1ccc2c(c1)n(C)c1c2cccc1 821428
Oc1cc2ccccc2c2c1cccc2 821930
O[C@@H]1[C@@H](O)[C@H](O)CO[C@]21SC(=N)NC2=O 822455
O[C@@H]1[C@@H](O)[C@H](O)CO[C@]21NC(=O)NC2=O 822981
OC1c2ccccc2Oc2c1cccc2 823483
OC1c2ccccc2Cc2c1cccc2 823985
OC1(CCCCC1)C#Cc1ccccc1 824488
O=c1occc2c1n(C)c1c2cccc1 824993
O=c1occ2c(-c3ccccc3C2=O)c1 825500
O=c1oc2ccccc2c2c1CCCO2 826003
O=c1oc2ccccc2c2c1CC=CO2 826507
O=c1ccoc2c1ccc1c2cccc1 827010
O=c1ccc2c(o1)ccc1c2cccc1 827515
O=c1ccc2c(o1)c1ccccc1cc2 828020
O=c1c2ccccc2sc2c1cccc2 828523
O=c1c2ccccc2oc2c1cccc2 829027
O=c1c2ccccc2nc2n1cccc2 829530
O=c1c2ccccc2[nH]c2c1cccc2 830036
O=c1[nH]ccc2-c3c(OCc12)cccc3 830545
O=c1[nH]c2cccnc2c2c1cccc2 831051
O=c1[nH]c2ccccc2c2c1cccc2 831557
O=c1[nH]c(=O)n(c2c1n1cc[nH]c1n2)C 832071
O=c1[nH]c(=O)c2c(c3c1ccs3)scc2 832582
O=[P@H]1OC[C@@H]2[C@H](O1)[C@H]1OC(O[C@H]1O2)(C)C 833114
O=[P@@H]1OC[C@@H]2[C@H](O1)[C@H]1OC(O[C@H]1O2)(C)C 833646
O=[P@@H]1NCc2c(O1)ccc1c2cccc1 834157
O=S1c2ccccc2Nc2c1cccc2 834661
O=S1(=O)c2ccccc2-c2c1cccc2 835169
O=C1c2ccccc2OC[C@@]21ON=CC2 835678
O=C1c2ccccc2Cc2c1cccc2 836181
O=C1c2ccccc2C(=O)c2c1[nH]cc2 836690
O=C1c2ccccc2C(=O)C21NCCN2 837196
O=C1[C@@H]2C[C@@H]3C([C@H]1C(=O)[C@H](C2=O)C3)(C)C 837727
O=C1O[C@@H]2[C@H](C1)[C@H]1C(=O)CC[C@]1(CC2)C 838253
O=C1OCOc2c1ccc1c2cccc1 838756
O=C1OCOc2c1cc1ccccc1c2 839259
O=C1OC2(c3c1cccc3)CCNCC2 839764
O=C1OC(=O)c2c3c1cccc3ccc2 840270
O=C1NCCCc2c1[nH]c1c2cccc1 840776
O=C1NC(=O)c2c3c1cccc3ccc2 841282
O=C1NC(=O)c2c1c1ccccc1nc2 841788
O=C1NC(=O)c2c1c(F)c(c(c2F)F)F 842298
O=C1NC(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl 842812
O=C1NC(=O)[C@H]2[C@@H]1[C@@]1(C)cc[C@@]2(C1=O)C 843344
O=C1N2CCC[C@H]2CNc2c1cccc2 843851
O=C1C[C@]2(C)C=C[C@H]1[C@@H]1[C@H]2CC(C1)(C)C 844377
O=C1CNC[C@@H]2N1CCc1c2cccc1 844885
O=C1CN=C2[C@H](O1)[C@H]1CC[C@@]2(C1(C)C)C 845407
O=C1CN=C2[C@@](O1)(C)[C@@H]1C[C@H](C2)C1(C)C 845932
O=C1CN=C2[C@@H](O1)[C@]1(C)CC[C@H]2C1(C)C 846454
O=C1CN2CN(CN1C)CC(=O)N(C2)C 846962
O=C1CC[C@@H]2[C@]1(C)CCC1(C2)OCCO1 847477
O=C1CCC[C@H]2N1CCc1c2cccc1 847984
O=C1CCC[C@@H]2N1CCc1c2cccc1 848492
O=C1CCC2(CC1)C(=O)OC(=CC2=O)C 849002
O=C1C2(OCCO2)[C@@H]2C([C@@]1(C)CC2)(C)C 849522
O=C1C(=O)c2cc[nH]c2-c2c1nccc2 850032
Nc1nccc2c1cnc1c2cccc1 850534
Nc1ncc2c(-c3ccccc3CC2)n1 851039
Nc1nc2cc3nc[nH]c3cc2c(=O)[nH]1 851550
Nc1nc2cc3[nH]cnc3cc2c(=O)[nH]1 852061
Nc1ccccc1C#Cc1ccccc1 852562
Nc1c2ccccc2nc2c1cccc2 853064
Nc1c2ccccc2[nH+]c2c1cccc2 853570
Nc1[nH]c2cc3nc[nH]c3cc2c(=O)[nH+]1 854085
Nc1[nH]c(=O)c2c(n1)sc1c2cccc1 854595
NC1=N[C@@H]2[C@H](O1)CNc1n2cnc1C#N 855111
NC1=CCc2c(O1)ccc1c2cccc1 855616
NC1=CCc2c(O1)c1ccccc1cc2 856121
N=c1ccc2-c(c1)[nH]c1c(n2)cccc1 856632
N=C1c2ccccc2N(S(=O)(=O)[C@H]1Cl)C 857146
N1C[C@]23C=C[C@H](O2)[C@H]2[C@@H]3[C@]3(C1)C=C[C@H]2O3 857683
N1CCOCCOCCOCCOCC1 858181
N1CC#CCNCC#CCNCC#CC1 858682
N#Cc1ncc2c(c1)c1cccnc1[nH]2 859190
N#Cc1cc2CCCCCCc2[nH]c1=N 859695
N#Cc1c2CCCCc2cc(c1N)C#N 860199
N#CC(=C1OC(C(=C)[C+]1C#N)(C)C)C#N 860713
N#CC(=C1CCSc2c1cccc2)C#N 861218
N#CC(=C1CCCc2c1cccc2)C#N 861724
F[B-]1(F)OC=Cc2[n+]1c1ccccc1s2 862235
Clc1ccc2c(n1)c1ccccc1cc2 862741
Clc1ccc2c(c1)c1cc(Cl)ccc1[nH]2 863253
Clc1ccc2c(c1)NC(=O)[C@@]12CC=CC1 863768
Clc1ccc2-c3c(Cc2c1)cc(cc3)Cl 864278
Clc1c2ccccc2cc2c1cccc2 864783
Cl[P@@H]1=N[P@]2(=NP(=N1)(Cl)Cl)NCCCN2C 865304
ClP1(=NP23(P([N-]1)([N-]3)(Cl)OCCCO2)Cl)Cl 865833
Cc1noc2c1-c1ccccc1C=NC2 866344
Cc1nnc2n1-c1ccccc1C=NC2 866848
Cc1cnc2c(n1)n(C)c(=O)n(c2=O)C 867358
Cc1cccc2c1nc1[nH]nc(c1c2)C 867865
Cc1cccc2c1Nc1ccccc1S2 868367
Cc1ccc2c(c1)c1ccccc1cn2 868872
Cc1ccc2c(c1)c1ccccc1cc2 869376
Cc1ccc2c(c1)c1cc(C)ccc1[nH]2 869885
Cc1ccc2c(c1)C(C)(C)CCC2(C)C 870393
Cc1cc2n[nH]c(=O)n2c2c1cccc2 870901
Cc1cc2c(s1)Nc1c([NH+]=C2)cccc1 871412
Cc1cc2c(s1)Nc1c(N=C2)cccc1 871920
Cc1cc2C=C(O)C(=O)C(=C)c2c(c1)O 872432
Cc1cc(C)c2c(n1)n1ccnc1cc2 872938
Cc1c2ncccc2cc2c1nccc2 873440
Cc1c2ccccc2cc2c1cccc2 873942
C[n+]1c2ccccc2cc2c1cccc2 874447
C[n+]1c2ccccc2[s+]c2c1cccc2 874955
C[N+]1=c2ccccc2=[BH-]c2c1cccc2 875467
C[C@H]1CCc2c(O1)c(C)c(c(c2C)O)C 875979
C[C@@]12C[C@]3(C)O[C@]([P@H]2=O)(C[C@](O1)(O3)C)C 876509
C[C@@]1(O)CC[C@@H]2[C@](C1)(C)CCCC2(C)C 877030
C[C@@H]1C[C@H]2CC(=O)C[C@@]3(C1)[C@@H]2CCCN3 877555
C[C@@H]1CCc2c(O1)c(C)c(c(c2C)O)C 878068
CN1c2ccccc2Sc2c1cccc2 878570
CN1c2ccccc2Cc2c1cccc2 879073
CN1CN(C)c2c3c1cccc3ccc2 879577
CN1CCC[C@]21C(=O)Nc1c2cccc1 880085
CN1CCC[C@@]21C(=O)Nc1c2cccc1 880594
CN1C(=O)CC(=O)N(c2c1cccc2)C 881102
CC1=C(C)c2c(C1)c(C)c(c(c2C)C)C 881613
CC1(C)c2ccccc2-c2c1cccc2 882118
CC1(C)[C@@H]2CCCC=C2c2c1cccc2 882628
CC1(C)O[C@@H]2[C@H](O1)c1ncccc1CC2 883143
CC1(C)C=[NH+]c2c1c1ccccc1cc2 883652
CC(C#Cc1nccc2c1nc[nH]2)(O)C 884160
C=C=C1c2ccccc2-c2c1cccc2 884665
C=C1c2cccn2[B-](n2c1ccc2)(F)F 885175
C=C1c2ccccc2Oc2c1cccc2 885678
C=C1C[C@@]23CC[C@H]1C[C@H]3[C@H](C(=O)C=C2)C 886203
C1C[NH2]2CC[NH2]3*42[NH2](C1)CC[NH2]4CCC3 886725
C1COCCOCC[NH2+]CCOCCO1 887228
C1COC2(O1)c1ccsc1-c1c2ccs1 887735
C1CCC2(CC1)OCc1c(O2)cccc1 888243
C1=Cc2cc3ccccc3cc2C=CS1 888747
C1=CCc2c(NC1)cc1c(c2)cccc1 889255
Brc1cn2c(c1)[CH+]c1n([B-]2(F)F)ccc1 889771
Brc1ccc2c(c1)ccc1c2cc(o1)C 890279
Brc1ccc2c(c1)c1cc(Br)ccc1[nH]2 890791
Brc1ccc2c(c1)[C@]1(CNCC1)C(=O)N2 891306
Brc1ccc2c(c1)C(=N)CS(=O)(=O)N2C 891819
Brc1ccc2-c3c(Cc2c1)cc(cc3)Br 892330
Brc1cc2n(c1Br)cc1n(c2=O)CCC1 892841
Brc1c2ccccc2cc2c1cccc2 893346
*c1ccccc1C#Cc1ccccc1 893848
*c1ccc2c(c1)c1nc[nH]c(=O)c1o2 894358
*c1ccc2c(c1)Nc1c(S2)cccc1 894864
*c1ccc2c(c1)NC(=O)[C@]12CNCC1 895375
c1n[nH+]c2c(n1)cc1c(c2)[nH+]ncn1 895888
c1cnc2c(n1)cc1c(c2)nccn1 896361
c1cnc2c(c1)ccc1c2[nH+]ccc1 896836
c1cnc2c(c1)cc1c(c2)nccc1 897309
c1ccc2c(n1)c1ncccc1cc2 897780
c1ccc2c(c1)ncc1c2cncn1 898251
c1ccc2c(c1)nc1c(n2)cccc1 898724
c1ccc2c(c1)nc1c(c2)cncc1 899197
c1ccc2c(c1)nc1c(c2)cccc1 899670
c1ccc2c(c1)cnc1c2cccc1 900141
c1ccc2c(c1)ccc1c2nccc1 900612
c1ccc2c(c1)ccc1c2cccn1 901083
c1ccc2c(c1)cc1c(c2)cccc1 901556
c1ccc2c(c1)c[nH+]c1c2cccc1 902031
c1ccc2c(c1)c1ccccc1cc2 902502
c1ccc2c(c1)[s+]c1c(n2)cccc1 902978
c1ccc2c(c1)[o+]c1c(c2)cccc1 903455
c1ccc2c(c1)[nH+]c1c(n2)cccc1 903932
c1ccc2c(c1)[nH+]c1c(c2)cccc1 904409
c1ccc2c(c1)[nH+]c1c([s+]2)cccc1 904889
c1ccc2c(c1)[nH+]c1c([o+]2)cccc1 905370
c1ccc2c(c1)[nH+]c1c([nH+]2)cccc1 905851
c1ccc2c(c1)[SH+]c1c(S2)cccc1 906328
c1ccc2c(c1)[SH+]c1c(O2)cccc1 906807
c1ccc2c(c1)[BH-]=c1c(=[BH-]2)cccc1 907291
c1ccc2c(c1)Sc1c(N2)cccc1 907764
c1ccc2c(c1)Sc1c(C2)cccc1 908238
c1ccc2c(c1)Oc1c(N2)cccc1 908712
c1ccc2c(c1)Oc1c(C2)cccc1 909185
c1ccc2c(c1)Nc1c(C2)cccc1 909658
c1ccc2c(c1)Cc1c(C2)cccc1 910131
c1ccc2c(-c3sccc3CCO2)c1 910603
c1ccc2c(-c3nccn3CCO2)c1 911076
c1ccc2c(-c3ccccc3CC2)c1 911548
c1ccc2-c3ccccc3OCc2c1 912018
c1ccc2-c3ccccc3NCc2c1 912488
c1ccc(cn1)C#Cc1ccncc1 912958
c1ccc(cc1)C#Cc1ccncc1 913428
c1ccc(cc1)C#Cc1cccnc1 913898
c1ccc(cc1)C#Cc1ccccn1 914368
c1ccc(cc1)C#Cc1ccccc1 914838
c1cc2csc3c2c2c1scc2cc3 915309
[O-]C1=CN(C)S(=O)(=O)c2c1cccc2 915790
[H+]1[BH+3]234[BH+3]561[BH+3]173[BH+3]34([H+]2)[BH+3]247[BH+3]761[BH+3]165[H+][BH+3]586[BH+3]32([BH+3]4715)[H+]8 916352
[H+]1[BH+2]23[H+][BH+3]452[BH+3]263[BH+2]31[BH+3]178[BH+3]923[BH+3]246[BH+3]345[BH+3]7([H+]1)([BH+3]8923)[H+]4 916911
[BH3-][P@@H]1=c2ccccc2=C2[C+]1C=CC=C2 917397
[BH-]1=[NH+]c2c(C=C1)cc1c(c2)cccc1 917881
S=C1NC(=S)S/C/1=C\1/SC(=S)NC1=S 918361
P=C1c2ccccc2-c2c1cccc2 918838
Oc1cccc2c1c1ccccc1[nH]2 919311
Oc1cccc2c1[nH]c1c2cccc1 919783
Oc1ccc2c3c1CCCN3CCC2 920252
Oc1ccc2c(c1)[nH]c1c2cccc1 920726
Oc1ccc2c(c1)[C@@H]1CCC[C@@H]1CO2 921207
Oc1cc2occc(=O)c2c(c1O)O 921679
Oc1cc(O)c2c(c1Br)occc2=O 922152
Oc1cc(O)c2c(c1)occ(c2=O)O 922627
Oc1cc(O)c2c(c1)[o+]cc(c2[O-])O 923106
Oc1cc(O)c2c(c1)OC[C@@H](C2=O)O 923585
O[I-]N1C(=O)c2c(S1(=O)=O)cccc2 924064
O[C@@]12CCCCC[C@@H]1c1c2cccc1 924544
O[C@@H]1[C@@H]2CC[C@@]1(O)c1c(O2)cccc1 925031
O[C@@H]1Cc2c1c(C)c1c(c2C)[C@H](C1)O 925515
O[C@@H]1CC[C@H]2[C@]1(O)c1ccccc1O2 925998
OC1c2ccccc2-c2c1cccc2 926468
OC1=CN(C)S(=O)(=O)c2c1cccc2 926944
OC1=CCC[C@H]2[C@@H]1Oc1c2cccc1 927424
OC1=CC=C[C+](/C/1=C/1\C(=CC1=O)[O-])O 927910
OB1OBO[B-]2(O1)OB(O)OB(O2)O 928386
O=c1oc2ccccc2c2c1cco2 928856
O=c1oc2ccccc2c2c1CCO2 929326
O=c1oc2ccccc2c2c1CCC2 929796
O=c1oc2[nH]ncc2c2c1cccc2 930269
O=c1oc2CCCCCCc2c(c1)O 930739
O=c1ccoc2c1cc1OCOc1c2 931209
O=c1cccc2n1C[C@@H]1CNC[C@H]2C1 931688
O=c1ccc2c(o1)cc1c(c2)cco1 932162
O=c1ccc2c(o1)cc1c(c2)CCO1 932636
O=c1cc[nH]c2c1cc1OCOc1c2 933109
O=c1cc(O)c2c(o1)cc(c(c2)C)C 933585
O=c1[nH]ncn2c1nc1c2cccc1 934058
O=c1[nH]nc2n1c1ccccc1cc2 934531
O=c1[nH]cnc2c1sc1c2cccc1 935004
O=c1[nH]cnc2c1oc1c2cccc1 935478
O=c1[nH]cnc2c1cc1nc[nH]c1c2 935954
O=c1[nH]cnc2c1cc1[nH]cnc1c2 936430
O=c1[nH]cnc2c1c1CCSCc1s2 936903
O=c1[nH]cnc2c1c1CCNCc1s2 937378
O=c1[nH]cnc2c1c1CCCCc1s2 937852
O=c1[nH]c2nncn2c2c1cccc2 938326
O=c1[nH]c2ncnn2c2c1cccc2 938799
O=S1(=O)N[C@H]2[C@]3(C1)CC[C@H](C2)C3(C)C 939289
O=S1(=O)N[C@@H]2[C@@]3(C1)CC[C@@H](C2)C3(C)C 939783
O=P1c2ccccc2-c2c1cccc2 940255
O=C1c2ccccc2[C@H]2N1CCCC2 940730
O=C1c2ccccc2-c2c1ccnn2 941201
O=C1c2ccccc2-c2c1cccn2 941672
O=C1c2ccccc2-c2c1cccc2 942143
O=C1[C@]2(Cl)CC[C@]([C@@]31CCCO3)(C2)Cl 942631
O=C1[C@H](O)c2ccccc2C(=O)N1C 943110
O=C1[C@@H]2CCCN2C(=O)[C@@H]2N1CCC2 943593
O=C1Oc2ccccc2[C@H]2[C@@H]1COC2 944072
O=C1OCc2c3c1cccc3ccc2 944542
O=C1OCc2c1cc1ccccc1c2 945012
O=C1OC[C@H]2[C@@H]1[C@H]1C(=C([C@@H]2[P@H]1=S)C)C 945510
O=C1OC[C@H]2[C@@H](C1)C1=CC(=O)C[C@@H]1C2 946002
O=C1OC2(CCCCC2)OC(=O)C1=C 946476
O=C1Nc2ccccc2C(=O)N(C1)C 946949
O=C1Nc2c([C@]31C[NH2+]CC3)cccc2 947429
O=C1Nc2c([C@]31CNCC3)cccc2 947904
O=C1Nc2c([C@]31CCCN3)cccc2 948379
O=C1Nc2c([C@]31C=CCC3)cccc2 948855
O=C1Nc2c([C@@]31NN=CC3)cccc2 949332
O=C1Nc2c([C@@]31CNCC3)cccc2 949808
O=C1Nc2c([C@@]31CCCN3)cccc2 950284
O=C1Nc2c([C@@]31CCC=N3)cccc2 950761
O=C1Nc2c([C@@]31C=NCC3)cccc2 951238
O=C1N[C@]2(C)C[C@@H]3[C@H]1CC[C@@H]3C(=O)N2 951730
O=C1NN=Cc2c3c1cccc3[nH]c2 952204
O=C1NCCn2c3c1cccc3nc2 952674
O=C1NC=NS(=O)(=O)c2c1cccc2 953149
O=C1NC(=O)c2c1cc1[nH+]c[nH]c1c2 953630
O=C1N2CCC[C@H]2C=C[C@@]21CCCN2 954109
O=C1N2CCC[C@@H]2C=C[C@@H]2[C@@H]1NCC2 954595
O=C1C[C@H]2OC[C@H]3[C@H]4[C@]1(CCC4)O[C@@H]23 955089
O=C1CCc2c(O1)cc1c(c2)OCO1 955563
O=C1CCc2c(O1)[nH]c1c2cccc1 956038
O=C1CC[C@@H]2C1=Cc1ccccc1O2 956514
O=C1CCNc2c1cc1OCOc1c2 956984
O=C1CCNc2c(N1C)cccc2C 957454
O=C1CCCc2n1c1ccccc1c2 957924
O=C1CCCc2c1c1ccccc1[nH]2 958397
O=C1CCCc2c1[nH]c1c2cccc1 958870
O=C1CCC[C@@]21C[C@@]1(C2)CCCC1=O 959351
O=C1CCC2=C(O1)CC(CC2=O)(C)C 959827
O/C=C/1\C(=O)OC(=O)c2c1cccc2 960304
Nc1nn2c(n1)c1ccccc1nc2 960775
Nc1nc2ccccc2c2c1nc[nH]2 961247
Nc1cc2c([nH]1)nc1c(n2)cccc1 961723
Nc1[nH]c(=O)c2c(n1)n(C)ncc2=O 962201
NC1=CCc2c(O1)c1ccccc1s2 962673
NC1=CCC2=C(O1)CC(CC2=O)(C)C 963150
NC1=C(Cc2c(O1)ccc(c2)Br)C#N 963626
N=C1c2cccnc2-c2c1cccn2 964098
N=C1c2ccccc2-c2c1cccc2 964569
N=C1c2cccc3c2C(=CCC3)C1=N 965043
N=C1CS(=O)(=O)N(c2c1cccc2)C 965519
N=C1C(=O)c2c3c1cccc3ccc2 965993
N=C1C(=N)c2c3c1cccc3ccc2 966466
N1COc2c(C1)c1ccccc1cc2 966937
N1CCc2c(C=C1)[nH]c1c2cccc1 967412
N1CCC2(CC1)Oc1c(O2)cccc1 967885
N1CCC2(CC1)OCc1c2cccc1 968356
N1CCC2(CC1)COc1c2cccc1 968827
N#Cc1cncc2c1CC(C)(C)OC2 969299
N#Cc1cnc2c(c1)CCCCCC2 969769
N#C[C@H]1ON2[C@@]3([C@H]1CCC3)CCCC2 970253
N#CC=c1ccc(=C(C#N)C#N)cc1 970727
N#CC1=CC(OC1=C(C#N)C#N)(C)C 971203
N#CC1=C(N)Oc2c([C@@H]1C)c(C)[nH]n2 971686
N#CC1=C(N)OC2=C(C1)C(=O)CCC2 972163
N#CC1(C#N)C=CC2=CC=CC=C[C@H]12 972642
Fc1ccc2c(c1)c1cncnc1[nH]2 973116
Fc1ccc2c(c1)CCCNS2(=O)=O 973589
Fc1cc(F)c2c(c1N)c(=O)cc[nH]2 974067
Fc1c(F)c(F)c(c2c1cccc2)F 974540
F[B-]1(F)n2cccc2[N-]c2n1ccc2 975017
F[B-]1(F)n2cccc2[CH+]c2n1ccc2 975495
FC1(F)c2cscc2C(C1(F)F)(F)F 975970
Cn1ncc2c1-c1ncncc1CC2 976441
Cn1cnc2c1c(=O)n(C)c(=O)n2C 976916
Cn1ccc2c1c1ccccc1cc2 977385
Cn1cc[n+]2c1[BH2-][n+]1ccn(c1[BH2-]2)C 977872
Cn1c2nccnc2c2c1cccc2 978341
Cn1c2ncccc2c(=O)n(c1=O)C 978814
Cn1c2ccccc2c2c1cccc2 979283
Cn1c2ccccc2c2c1CNCC2 979752
Cn1c2ccccc2c2c1CCCC2 980221
Clc1ccc2c(c1C)N1CC[C@@H](C2)O1 980700
Clc1ccc2c(c1)c1ccccc1[nH]2 981176
Clc1cc(Cl)c2c(c1)C(=O)C(=C)CO2 981656
ClC1=C(Cl)[C@@]2(Cl)CC[C@]1(Cl)C(=O)C2=O 982147
Cc1oc2c(c1)c1ccccc1cc2 982622
Cc1nnc2n1ncc1c2cccc1 983091
Cc1nnc2n1-c1sccc1C=NC2 983562
Cc1nc2ccccc2n2c1nnc2 984032
Cc1n[nH]c2c1cc1c(C)n[nH]c1n2 984509
Cc1cccc2c1c1ccccc1[nH]2 984981
Cc1ccc2c(c1)c1ccccc1[nH]2 985455
Cc1cc2c(o1)c1ccccc1cc2 985926
Cc1cc(O)c2c(c1)cc(c(c2)O)O 986401
Cc1[nH]cc2-c3c(CCc12)cccc3 986876
C[n+]1ccn2c1ccc1c2nccc1 987348
C[c-]1c2cccc[n+]2c2c1cccc2 987823
C[Si]1(C)[SiH2][Si](C)(C)[Si]([SiH2][Si]1(C)C)(C)C 988322
C[O+]1[BH2-]c2c([BH2-]1)c(F)c(c(c2F)F)F 988816
C[N+]1(C)Cc2c3c1cccc3ccc2 989290
C[C@]12O[C@@]3(C)C[C@@](O2)(P[C@@](C1)(O3)C)C 989784
C[C@H]1O[C@@]2(C)C[C@]3(O[C@@H]1[C@](O2)(C)O3)C 990281
C[C@H]1OCC2=C(C1)C(=O)[C@H]1[C@@H]([C@H]2O)O1 990775
C[C@H]1Nc2ccccc2SC(C1)(C)C 991250
C[C@H]1CC[C@]2([C@H]([C@H]1C)CCC=C2C)C 991738
C[C@@]12O[C@]3(C)C[C@](O2)(P[C@](C1)(O3)C)C 992230
C[C@@H]1Nc2ccccc2NC(C1)(C)C 992707
C[C@@H]1C[C@]2(C)C[C@@](C1)(C)C(=O)NC2=O 993196
C[C@@H]1CC[C@@]2([C@@H]([C@@H]1C)CCCC2=C)C 993687
CN1c2ccccc2[C@]2([C@@H]1NCC2)C 994166
CN1N=C(N)c2c3c1ncnc3[nH]c2 994641
CN1C[C@H]2C(=N1)c1ccccc1OC2 995117
CN1CCc2c(C1)cc1c(c2)OCO1 995590
CN1CC[C@H]2[C@@H]1N(C)c1c2cccc1 996070
CN1CC[C@@H]2[C@H]1c1ccccc1OC2 996548
CN1CCN2CCN([P@@H]1=[N+](C)CC2)C 997028
CN1C=C([O-])c2c(S1(=O)=O)cc(s2)Cl 997511
CC1c2ccccc2-c2c1cccc2 997984
CC1=CCC2=C(N1)CCC(C2=O)(C)C 998460
CC1=CCC2=C(N1)CC(CC2=O)(C)C 998936
CC1=CC(=[N+]2[Si-](O1)(C)(C)OC(=O)C2)C 999423
CC1(C)[N+](=O)C(c2c1cccc2)(C)C 999903
CC1(C)CCC(c2c1nncn2)(C)C 1000376
CC1(C)CCC(c2c1cccc2)(C)C 1000849
CC1(C)C=Nc2c(N1)nc([nH]c2=O)N 1001327
CC#Cc1cc(F)c(cc1F)C#CC 1001798
CC#Cc1c[nH]c2c1c(=O)[nH]c(n2)N 1002277
C=c1sc2n(c1=O)c1c(n2)cccc1 1002752
C=C1c2ccccc2-c2c1cccc2 1003224
C=C1CCc2c(O1)[nH]c1c2cccc1 1003699
C=C1CC[C@@H]2[C@](C1)(C)CCCC2(C)C 1004181
C=C1C(=O)Nc2c1c1scnc1cc2 1004654
C1[C@@H]2C[C@@H]3[C@@H]4[C@H]1[C@@H]1[C@H](C2)[C@H]3C[C@@H](C1)C4 1005169
C1NC[C@H]2C(=Cc3c2cccc3)C=C1 1005646
C1Cc2nc[nH]c2[C@H]2[C@@H]1C(=O)NC2=O 1006131
C1Cc2nc[nH]c2[C@@H]2[C@H]1C(=O)NC2=O 1006616
C1Cc2c([C@@H]3[C@H]1C(=O)NC3=O)nc[nH]2 1007103
C1C[NH2+]CC[NH2+]CCC[NH2+]CC[NH2+]C1 1007588
C1CSC2=C(S1)S/C(=C/1\SC=CS1)/S2 1008068
C1COC2=C(O1)S/C(=C/1\SC=CS1)/S2 1008554
C1CNCC[NH2+]CCCNCC[NH2+]C1 1009033
C1CNCCNCCCNCCNC1 1009498
C1CCc2c(C1)nc1c(c2)cccc1 1009971
C1CCc2c(C1)cc1c(c2)cccc1 1010444
C1CCc2c(C1)[nH+]c1c(c2)cccc1 1010921
C1CC[C@H]2[C@@H](O1)c1ccccc1NC2 1011401
C1CCC2=C(C1)S/C(=C/1\SC=CS1)/S2 1011881
C1=Cc2c(OC1)ccc1c2cccc1 1012357
C1=COc2c(C1)c1ccccc1cc2 1012829
C1=CO[B-]2(O[CH+]1)Oc1c(O2)cccc1 1013310
C1=CCc2c(C1)cc1c(c2)CC=CC1 1013785
C/C=C/1\C(=O)Oc2c(C1=O)cccc2 1014262
Brc1ccc2c(c1)ccc1c2cco1 1014734
Brc1ccc2c(c1)c1ccccc1[nH]2 1015210
Brc1ccc2c(c1)c1CCOc1cc2 1015683
Brc1ccc2-c3c(Cc2c1)cccc3 1016157
*c1ccc2c(c1)c1CCCCc1[nH]2 1016632
n1ccc2c(c1)[nH]c1c2cncn1 1017105
c1ncc2c(-c3[nH]ncc3CC2)n1 1017547
c1cnc2-c3c(Cc2c1)cccn3 1017986
c1cn[n+]2c(c1)[n-]c1c2cccc1 1018430
c1ccc2c(c1)sc1c2cccc1 1018868
c1ccc2c(c1)oc1c2cccc1 1019307
c1ccc2c(c1)nc1c(c2)cco1 1019747
c1ccc2c(c1)ccc1c2cco1 1020185
c1ccc2c(c1)cc[n+]1c2cc[n-]1 1020629
c1ccc2c(c1)cc[n+]1c2cc[cH-]1 1021074
c1ccc2c(c1)cc1c(c2)cco1 1021514
c1ccc2c(c1)c1n[n-]c[n+]1nc2 1021958
c1ccc2c(c1)c1n[n-]c[n+]1cc2 1022402
c1ccc2c(c1)c1c[cH-]c[n+]1cc2 1022847
c1ccc2c(c1)c1[nH]cnc1cn2 1023288
c1ccc2c(c1)c1[nH]ccc1cc2 1023729
c1ccc2c(c1)[pH]c1c2cccc1 1024170
c1ccc2c(c1)[nH]c1c2nccc1 1024612
c1ccc2c(c1)[nH]c1c2ccnc1 1025053
c1ccc2c(c1)[nH]c1c2cccn1 1025494
c1ccc2c(c1)[nH]c1c2cccc1 1025935
c1ccc2c(c1)[n+]1[cH-]ccc1cn2 1026380
c1ccc2c(c1)[n+]1[cH-]ccc1cc2 1026825
c1ccc2c(c1)[cH-]c1c2cccc1 1027267
c1ccc2c(c1)[C@@H]1ON=C[C@H](C2)O1 1027717
c1ccc2c(-n3cccc3CN2)c1 1028156
c1ccc2c(-c3sccc3CC2)c1 1028595
c1ccc2=C3[C+]([BH-]=c2c1)C=CC=C3 1029045
c1ccc2-c3cccn3CCc2c1 1029482
c1ccc2-c3c([SiH2]c2c1)cccc3 1029926
c1ccc2-c3c([BH2-]c2c1)cccc3 1030371
c1ccc2-c3c(Cc2c1)cccc3 1030810
c1ccc2-c3c(Bc2c1)cccc3 1031249
c1ccc2-c3[n+]([SiH4-2][n+]2c1)cccc3 1031701
c1ccc2-c3[n+]([BH2-]c2c1)cccc3 1032149
c1ccc(cc1)C#Cc1n[nH]cn1 1032589
c1ccc(cc1)C#Cc1cccs1 1033026
c1ccc(cc1)C#Cc1c[nH]nn1 1033467
c1cc[n+]2c(c1)[cH-]c1c2cccc1 1033912
[NH2+]1CCc2c(C1)[nH]c1c2cccc1 1034358
[H+]1[BH+3]234[BH+2]51[BH+3]162[BH+3]274[BH+3]483[H+][BH+3]394[BH+3]478[BH+3]762[BH2+3]51[BH+3]347[H+]9 1034878
P=C1NC(CC21CCCCC2)(C)C 1035317
P1Sc2cccc3c2c(S1)ccc3 1035756
Oc1ccc2c(c1O)c(=O)cco2 1036198
Oc1ccc2c(c1)occ(c2=O)O 1036637
Oc1ccc2c(c1)oc(=O)cc2C 1037076
Oc1ccc2c(c1)c(=O)c(co2)O 1037517
Oc1cc2OCCC(=O)c2c(c1)O 1037956
Oc1cc2OC(=C)C(=O)c2c(c1)O 1038398
Oc1cc2CCOC(=O)c2c(c1)O 1038837
Oc1cc(O)c2c(c1)occc2=O 1039276
Oc1cc(=O)n(c2c1cccc2)C 1039715
O[C@H]1CNc2c(NC1=O)cccc2 1040156
O[C@H]1CCNc2c(C1)cc(F)cc2 1040598
O[C@@]12CCN[C@@H]1Nc1c2cccc1 1041043
O[C@@H]1[C@H](O)CO[C@]21NC(=O)NC2=O 1041495
O[C@@H]1[C@@H]2[C@@H]3[C@@H]([C@@H]4[C@H]1[C@@H]1[C@H]2C[C@H]3[C@H]41)O 1041983
O[C@@H]1[C@@H](O)[C@H](O)CO[C@]21CCNO2 1042438
O[C@@H]1OOC2([C@](C1)(C)O)CCCC2 1042886
OC1=CNS(=O)(=O)c2c1cccc2 1043327
OC1=CC(=O)C(C(=O)C1(C)C)(C)C 1043773
O=c1ccc2c(o1)c(O)c(cc2)O 1044214
O=c1c2-c(ssn2)cc2c1n[s+]s2 1044657
O=c1c(C)coc2c1cccc2O 1045098
O=c1[nH]c2nccn2c2c1[nH]cn2 1045541
O=[P@H]1C=CC(c2c1cccc2)(C)C 1045985
O=C1[O-][H+][O-]C(=O)c2c1cccc2 1046433
O=C1O[H][O-]C(=O)c2c1cccc2 1046876
O=C1O[C@H]2[C@]3(N1)CC[C@H](C2)C3(C)C 1047330
O=C1OC[C@H]2[C@@H]1Cc1c2cccc1 1047776
O=C1OC(C)(C)Cc2c1cccc2 1048215
O=C1Nc2ncccc2OC1(C)C 1048652
O=C1Nc2ccccc2OC1(C)C 1049089
O=C1Nc2ccccc2N=CC1=C 1049526
O=C1Nc2c3c1cccc3ccc2 1049963
O=C1Nc2c(C1(C)C)cccc2F 1050402
O=C1N[N-]C(=NN1)C#C[Si](C)(C)C 1050849
O=C1N[C@@H]2[C@@H]3N1CNCN3C(=O)N2 1051300
O=C1NN[C@H]2[C@]31CC[C@@H](C3(C)C)C2 1051753
O=C1NCCc2c1c(*)ccc2* 1052190
O=C1NC(C)(C)Nc2c1cccc2 1052629
O=C1NC(=O)c2c1cc(Cl)c(c2)Cl 1053073
O=C1NC(=O)[C@H]2[C@@H]1[C@H]1cc[C@@H]2C1=O 1053534
O=C1NC(=O)[C@H]2[C@@H]1[C@@H]1CCCN1C2 1053988
O=C1NC(=O)[C@@H]2[C@H]1[C@@H]1CC[C@H]2CC1 1054446
O=C1NC(=O)C(=O)c2c1cccc2 1054887
O=C1N2CCC[C@@H]2c2c1cccc2 1055329
O=C1C[C@H]2C(=C1)c1c(O2)cccc1 1055775
O=C1CNC(=O)c2c(N1)cccc2 1056215
O=C1CCNc2c(N1C)cccc2 1056652
O=C1CCC[C@@]2([C@@H]1O)CCCC2=C 1057099
O=C1CCCCCCCCCCC1 1057532
O=C1CC(C)(C)Oc2c1cccc2 1057971
O=C1CC(C)(C)Cc2c1cccn2 1058410
O=C1CC(C)(C)Cc2c1cc([nH]2)C 1058854
O=C1CC(C)(C)Cc2c1c(C)c[nH]2 1059298
O=C1CC(C)(C)CC2=C1CC=CO2 1059739
O=C1CC(=O)Nc2c(N1)cccc2 1060179
O=C1C=C[C@]2(C=C1)N=CC(=O)N2C 1060625
O=C1C=C[C@]2(C=C1)C=CC(=O)N2C 1061071
O=C1C=CC(=O)c2c1n(C)c(c2)C 1061514
O=C1C=CC(=O)c2c1c(O)ccc2 1061955
O=C1C=C(O)C(=O)c2c1cccc2 1062396
O=C1C=C(Cl)C(=O)c2c1cccc2 1062838
O=C1C=C(C)C(=O)c2c1cccc2 1063280
O=C1C=C(Br)C(=O)c2c1cccc2 1063722
O1C[C@@H]2[C@H](N1)c1ccccc1OC2 1064170
O1CCc2c(C1)[nH]c1c2cccc1 1064611
Nc1nc[nH]c2-c1c(=O)[nH]c(=O)n2 1065058
Nc1nc2nccc(c2c(n1)N)C 1065496
Nc1nc2cccc(c2c(n1)N)C 1065934
Nc1nc2[nH]ncc(=O)c2c(=O)[nH]1 1066380
Nc1nc(C)c2c(n1)[nH]c(=O)cc2 1066824
Nc1cnc2c(n1)nc(nc2N)N 1067262
Nc1ccc2c(c1)c(=O)[nH]c(n2)N 1067706
Nc1cc(=O)n(c2c1cccn2)O 1068145
NC1=N[C@H]2[C@@H](S1)CNc1n2cnc1 1068593
N=C1Cc2c3c1cccc3ccc2 1069031
N=C1CNS(=O)(=O)c2c1cccc2 1069472
N1C[C@H]2[C@H](C1)Nc1c(C2)cccc1 1069921
N1CCc2c3c(C1)cccc3[nH]c2 1070362
N1CCc2c(C1)[nH]c1c2cccc1 1070803
N1=Cc2c(CC1)c1c([nH]2)cccc1 1071247
N#Cc1cnc2c(c1)CCCCC2 1071684
N#Cc1cnc(c2c1nccc2)N 1072121
N#Cc1ccc2c(c1)c(C)ccc2 1072560
N#Cc1ccc2c(c1)CNCCN2 1072997
N#Cc1cc2ccccc2oc1=O 1073433
N#Cc1c[nH]c2c1c(=O)[nH]c(n2)N 1073879
N#CC1=C(N)Oc2c(C1)cccc2 1074319
N#CC1=C(N)Oc2c(C1)c(C)[nH]n2 1074764
N#CC1=C(N)N2C(=CCC=C2C)C1 1075206
N#CC1=C(C)C(=N)C(=O)N(C1=O)C 1075651
N#CC(=C1OC(=O)C(=C)C1=C)C#N 1076095
N#CC(=C1C=CCC(C1)(C)C)C#N 1076537
Fc1ccc2c(c1)c(O)cc(=O)[nH]2 1076981
Fc1ccc2c(c1)S(=O)(=O)NCN2 1077423
Fc1ccc2c(c1)C[C@H]1ON2CC1 1077866
Fc1ccc2c(c1)C[C@@H]1ON2CC1 1078309
Fc1c2ss[n-]c2[nH+]c2c1ss[n-]2 1078755
Fc1c2[BH2-]C[PH2+]c2c(c(c1F)F)F 1079207
Fc1c(F)c(F)c2c(c1F)n[nH]c2 1079651
Fc1c(F)c(F)c2c(c1F)[nH]nc2 1080094
Fc1c(F)c(F)c2c(c1F)[nH]cn2 1080537
F[B-]1(F)OCC(=[N+]2CCOCC2)O1 1080982
FC1(F)C=CC(C(C=C1)(F)F)(F)F 1081426
Cn1cnc2c1c1cc[nH]c1nc2 1081865
Cn1cnc2c1c(=O)[nH]c(=O)n2C 1082308
Cn1c2ccccc2c2c1scc2 1082744
Cn1c2-c(ssn2)c(c(=S)c1=N)F 1083188
Cn1c2-c(s[se]n2)c(c(=S)c1=N)F 1083637
Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 1084085
Cn1c(=O)[nH]c2c(c1=O)cccn2 1084528
Clc1nc[n+]2c(c1)C=CO[B-]2(F)F 1084974
Clc1ccc2c(c1)S(=O)(=O)N=CN2 1085419
Clc1ccc2c(c1)NCNS2(=O)=O 1085862
Clc1ccc2c(c1)NC=NS2(=O)=O 1086306
Clc1ccc2c(c1)C[C@H]1ON2CC1 1086751
Clc1ccc2c(c1)C(C)(C)CCO2 1087193
Clc1cc2[nH]ccc(=O)c2cc1F 1087635
Clc1c2s[se+]nc2[nH+]c2c1[s+][se]n2 1088087
Clc1c2[se][se+]nc2[nH+]c2c1[se][se+]n2 1088547
Clc1c(Cl)c(Cl)c2c(c1Cl)CCC2 1088996
ClC1=C(Cl)[C@@]2(C([C@@]1(Cl)CC2)(Cl)Cl)Cl 1089459
Cc1oc2c(c1)c(C)cc(c2C)C 1089905
Cc1oc2c(c1)c(C)c(c(c2)C)Cl 1090348
Cc1oc2c(c1)c(C)c(c(c2)C)C 1090791
Cc1oc2c(c1)c(C)c(c(c2)C)Br 1091234
Cc1nc2cc[n-][n+]2c2c1CCC2 1091677
Cc1ccc2c(c1)n(C)c(=O)n2C 1092118
Cc1ccc2c(c1)c(N)nc(n2)N 1092558
Cc1ccc2c(c1)c(N)nc([nH+]2)N 1093002
Cc1ccc2c(c1)C[C@H]1ON2CC1 1093444
Cc1ccc2c(c1)COC(O2)(C)C 1093884
Cc1cc(C)c2c(c1)oc(=O)cc2 1094325
Cc1cc(=O)n(c2c1cccc2)C 1094764
Cc1c2CCCn2c2c1cccc2 1095200
C[n+]1c2[N-][SeH+]Sc2cc2c1n[se][s+]2 1095653
C[Si]1(C)c2cscc2-c2c1scc2 1096099
C[Si]1(C)[Si@@H]2CCCC[Si@H]1CCCC2 1096552
C[Si]1(C)O[Si](c2c1cccc2)(C)C 1097001
C[Si]1(C)C[Si](c2c1cccc2)(C)C 1097449
C[N+]1(C)N=CO[SiH2-2]21OC=N[N+]2(C)C 1097904
C[C@]12CCCC[C@H]2[C@](CCC1)(C)O 1098353
C[C@H]1CCC(=O)O[C@@H](CC(=O)O1)C 1098802
C[C@H]1CC(C)(C)Sc2c1cccc2 1099244
C[C@H]1CC(C)(C)Oc2c1cccc2 1099687
C[C@@H]1OC[C@@H]2[C@@H](O1)[C@H](O)[C@H](CO2)O 1100150
C[C@@H]1C[C@@]2(C)CNC(=O)[C@@](C1)(C2)C 1100606
C[C@@H]1CC[C@@H]2[C@@H](C1)OCNC2(C)C 1101059
C[C@@H]1CC(C)(C)Oc2c1cccc2 1101502
C[C@@H]1CC(=O)Nc2c(N1)cccc2 1101946
CN1c2ccccc2C2(C1=O)CC2 1102385
CN1c2ccccc2C(C1=C)(C)C 1102824
CN1C[C@]2(C)CN([P@@]1(=N)N(C2)C)C 1103274
CN1CCNc2c1c(=O)[nH]c(n2)N 1103717
CN1CCCNc2c1cccc2C 1104151
CN1CC=Nc2c1nc(N)[nH]c2=O 1104592
CN1C=Cc2c(S1(=O)=O)cccc2 1105033
CN1C=C([O-])c2c(S1(=O)=O)ccs2 1105480
CCC#Cc1c(N)nc([nH+]c1C)N 1105923
CCC#Cc1c(C)nc(nc1N)N 1106360
CC=C1C(=O)N(C)C(=O)N(C1=O)C 1106804
CC1=C[C@]2(OCC1)OCCC[C@H]2O 1107248
CC1=CS/C(=C/2\SC(=C(S2)C)C)/S1 1107695
CC1=CC[C@H]2[C@@H](C1)C(=O)N(C2=O)C 1108151
CC1=C(C)CP[P-](=c2[nH]cc[nH]2)C1 1108600
CC1(C)c2ccsc2-c2c1ccs2 1109041
CC1(C)[C@H]2C[C@@H]1c1c(C2)nccc1 1109492
CC1(C)[C@H]2C[C@@H]1c1c(C2)ccnc1 1109941
CC1(C)[C@@H]2C[C@H]1c1c(C2)nccc1 1110390
CC1(C)[C@@H]2C[C@H]1c1c(C2)ccnc1 1110839
CC1(C)[C@@H]2CC[C@@]1(C)c1c2c[nH]n1 1111291
CC1(C)O[C@@H]2[C@H](O1)[C@@H]1[C@H](O2)CCO1 1111751
CC1(C)NC(c2c1cccc2)(C)C 1112191
CC1(C)N=Cc2c(C1)cc(cc2)Cl 1112633
CC1(C)N=Cc2c(C1)cc(cc2)* 1113075
CC1(C)CCc2c(O1)cc(cc2)O 1113515
CC1(C)C=Cc2c(O1)cccc2O 1113954
CC#Cc1ccc2c(c1)cncc2 1114391
CC#Cc1c[nH]c2c1c(N)ncn2 1114831
C=C1[C@@H]2CO[C@@H](O2)c2c1cccc2 1115280
C=C1Cn2c(C1)cc1c2cccc1 1115719
C=C1CSc2c(NC1=O)cccc2 1116157
C=C1CC[C@@H]2[C@](C1)(C)CCC[C@H]2C 1116609
C=C1CC(=O)Nc2c(N1)cccc2 1117049
C=C1C=Cc2c(C1=O)c(O)ccc2 1117490
C=C1C(=O)Oc2c(C1=O)cccc2 1117931
C1Oc2c(C1)c1ccccc1cc2 1118369
C1OCc2c(C1)oc1c2cccc1 1118807
C1Nc2cccc3c2c(N1)ccc3 1119245
C1Cc2c(N1)c1ccccc1cc2 1119683
C1C[C@@H]2[C@H](O1)c1ccccc1NC2 1120130
C1CN2CCCc3c2c(C1)ccc3 1120568
C1CCc2c(C1)sc1c2cncn1 1121006
C1CCc2c(C1)cc1c(c2)nc[nH]1 1121450
C1CCc2c(C1)[nH]c1c2cccc1 1121891
C1CC[C@]2(OC1)OC[C@H]1O[C@@H]2OC1 1122341
C1CC2=Nc3c(CN2C1)cccc3 1122780
C1CC2(C1)CCc1c(O2)nccc1 1123220
C1CC2(C1)CCc1c(O2)cccc1 1123660
C1=NO[Si-2]23(O1)(ON=CO3)ON=CO2 1124108
C1=NN2[C@H](C1)c1ccccc1NC2 1124552
C1=NC2=NC=NC3=NC=NC(=N1)[C+]23 1124999
C1=NC2=NC=NC3=NC=NC(=N1)N23 1125443
C1=Cc2c(C1)cc1c(c2)cccc1 1125884
C1=Cc2[n+]([BH2-]O1)c1c(s2)cccc1 1126333
C1=C[C@@H]2[C@H](C1)CNc1c2cccc1 1126782
C1=CSC(=C2Sc3c(S2)c[nH]c3)S1 1127227
C1=CC2=[NH+][C-]=[NH+]C3=CC=CC(=C1)[C+]23 1127689
C1=CC2=[NH+][BH-]=[NH+]C3=CC=CC(=C1)[C+]23 1128148
C1=CC2=CC=CC3=[NH+]C=[NH+]C(=C1)[C+]23 1128603
C1=CC2=CC=CC3=CC=CC(=C1)[C+]23 1129050
Brc1ccc2c3c1cccc3CC2 1129487
Brc1c2[se][se+]nc2[nH+]c2c1[se][se+]n2 1129943
*c1ccc2c(c1)NCNS2(=O)=O 1130388
*c1c(*)c(*)c2c(c1*)[nH]cn2 1130832
c1sc2c(c1)cc1c(n2)scn1 1131271
c1nc2c(s1)cc1c(c2)scn1 1131680
c1nc2c([nH]1)c1cc[nH]c1nc2 1132093
c1cn2c(c1)[CH+]c1n([BH2-]2)ccc1 1132509
c1ccc2c(c1)sc1c2scc1 1132914
c1ccc2c(c1)n1ccsc1n2 1133321
c1ccc2c(c1)n1ccnc1s2 1133727
c1ccc2c(c1)n1CSCc1n2 1134133
c1ccc2c(c1)n1CCNc1n2 1134539
c1ccc2c(c1)n1CCCc1c2 1134944
c1ccc2c(c1)[n+]1ccsc1[n-]2 1135355
c1ccc2c(c1)N1CC[C@H](C2)O1 1135767
c1ccc2c(c1)N1CC[C@@H](C2)O1 1136179
c1ccc2c(-c3n[nH]cc3C2)c1 1136588
c1ccc2c(-c3[nH]ncc3C2)c1 1136997
c1ccc2-c3c(-c2c1)cccc3 1137404
c1cc2cccc3c2c(c1)[BH2-][PH2+]3 1137819
c1cc2cccc3c2c(c1)CC3 1138225
c1cc2cccc3c2c(c1)C=C3 1138631
c1cc2ccc[n+]3c2c(c1)O[BH2-]3 1139044
c1cc2c(s1)cc1c(c2)scc1 1139451
c1cc2c(o1)cc1c(c2)occ1 1139860
c1cc2CCCn3c2c(c1)cc3 1140265
c1c[n+]2n(c1)[BH2-]n1[n+]([BH2-]2)ccc1 1140688
c1c[n+]2n(c1)[BH2-][n+]1n([BH2-]2)ccc1 1141111
c1[nH]c2c(n1)c1nccn1cn2 1141519
c1[nH]c2c([nH+]1)cc1c(c2)[nH+]c[nH]1 1141940
[O-][n+]1ccc(c2c1cccc2)O 1142349
[O-][n+]1cc[n+](c2c1cccc2)[O-] 1142764
[O-]C1=CC(=O)/C/1=C\1/[CH-]C=CC=C1 1143183
[O-]C1=CC(=O)/C/1=C/1\[CH-]C=CC=C1 1143602
[H+]1[BH+2]23[BH2+2]4[BH+3]563[BH+3]372[BH+2]21[BH2+2]1[BH+3]832[BH+3]267[BH+3]345[BH+3]182[H+]3 1144083
[BH+3]1234[BH+3]567[BH+3]891[BH+3]1%102[BH+3]2%113[BH+3]345[BH+3]456[BH+3]678[BH+3]791[BH+3]1%102[BH+3]%1134[BH+3]5671 1144586
S=c1cc2-c(n(c1=N)C)n[se]s2 1144997
S=c1c(=N)[nH]c2-c(c1F)ssn2 1145411
S=c1[nH]c2ccccc2c(=O)[nH]1 1145825
S=[P@]12C[C@@H]3[C@](C1)([C@@](C2)(C)OC3)C 1146253
S=C1NCC2=C(N1)CCCC2=O 1146661
S1[N-]c2c([N-]1)cc1c(c2)nsn1 1147075
S1[N-]c2c(=N1)cc1c(=NS[N-]1)c2 1147492
On1c(=O)ccc2c1cccc2 1147898
Oc1cccc2c1nc[nH]c2=O 1148303
Oc1cccc2c1c(O)ccc2 1148706
Oc1cccc2c1c(=O)cco2 1149110
Oc1ccc2c(c1)occc2=O 1149514
Oc1ccc2c(c1)oc(=O)cc2 1149920
Oc1ccc2c(c1)cccc2C 1150323
Oc1ccc2c(c1)ccc(c2)O 1150728
Oc1ccc2c(c1)ccc(c2)Br 1151134
Oc1ccc2c(c1)cc(cc2)O 1151540
Oc1ccc2c(c1)c(=O)cco2 1151946
Oc1ccc2c(c1)OCCC2=O 1152350
Oc1ccc2c(c1)CCN[C@H]2C 1152757
Oc1ccc2c(c1)C(=O)CCO2 1153163
Oc1ccc(c2c1cccc2)O 1153566
Oc1cc2ccccc2cc1O 1153967
Oc1cc2ccccc2cc1Br 1154369
Oc1cc2OCCCc2c(c1)O 1154773
Oc1cc2C[NH2+]CCc2cc1O 1155179
Oc1cc2CNCCc2cc1O 1155580
O[C@]12CCCC[C@@]2(O)CCCC1 1155990
O[C@H]1CO[C@H]2[C@H]1O[P@](=O)([O-])OC2 1156414
O[C@H]1CO[C@H]2[C@H]1O[P@](=O)(O)OC2 1156836
O[C@H]1CO[C@H]2[C@H]1O[P@@](=S)(O)OC2 1157259
O[C@H]1CO[C@H]2[C@H]1O[P@@](=O)(S)OC2 1157683
O[C@H]1CO[C@H]2[C@H]1O[P@@](=O)(O)OC2 1158107
O[C@H]1COC[C@H]2[C@@H]1OC(O2)(C)C 1158526
O[C@H]1CN[C@H]2[C@H]1OC(C)(C)OC2 1158943
O[C@H]1CCc2c(C1=O)cccc2 1159351
O[C@H]1CCC=C[C@@]21CCOC2=O 1159762
O[C@H]1CC(C)(C)[C@@H]([C@@H]([C@@H]1O)C)O 1160188
O[C@@H]1[C@@H]2O[C@@H]3O[C@H]1[C@@H]([C@H](C2)O3)O 1160623
O[C@@H]1Cn2ccnc2[C@@H]([C@H]1O)O 1161040
O[C@@H]1Cn2cc[nH+]c2[C@@H]([C@H]1O)O 1161461
O[C@@H]1C[n+]2cc[nH]c2[C@@H]([C@H]1O)O 1161884
O[C@@H]1C[N@@H+]2[C@@H]([C@@H]1O)[C@H](O)CCC2 1162314
O[C@@H]1C[C@@H](O)c2c([C@H]1O)scc2 1162733
O[C@@H]1COC[C@@H]2[C@H]1OC(O2)(C)C 1163153
O[C@@H]1CN2[C@@H]([C@@H]1O)[C@H](O)CCC2 1163577
O[C@@H]1CCNc2c(C1)cccc2 1163985
O[C@@H]1CC=C[C@@H]2[C@H]1OC(O2)(C)C 1164405
O[C+]1C=Cc2c(C1=N)cccc2 1164813
O[C+]1C=Cc2c(C1=C)cccc2 1165221
O[BH-]1[NH+]=Cc2c(O1)c(O)ccc2 1165635
OC1CC(C)(C)N(C(C1)(C)C)[O-] 1166047
OC1C(=O)c2c(C1=O)cccc2 1166454
O=c1occ(c2c1cccc2)I 1166858
O=c1n(C)c2c(n1C)cccc2 1167265
O=c1cc[nH]c2n1ncc2C#N 1167671
O=c1cc[nH]c2c1c(N)ncn2 1168078
O=c1cc(O)c2c(o1)cccc2 1168484
O=c1cc(O)c2c([nH]1)cccc2 1168893
O=c1cc(Cl)c2c(o1)cccc2 1169300
O=c1cc(C)c2c(o1)cccc2 1169707
O=c1cc(C)c2c([nH]1)cccc2 1170116
O=c1c(O)coc2c1cccc2 1170520
O=c1c(C)coc2c1cccc2 1170924
O=c1c(C)c[nH]c2c1cccc2 1171331
O=c1c(=N)c(=O)c2c1cccc2 1171739
O=c1[nH]nc(c2c1cccc2)O 1172146
O=c1[nH]nc(c2c1cccc2)C 1172553
O=c1[nH]cnc2c1[nH]cc2C#N 1172962
O=c1[nH]c2ncccc2c(=O)[nH]1 1173373
O=c1[nH]c2cnccc2cc1C 1173778
O=c1[nH]c2ccccc2nc1C 1174183
O=c1[nH]c2ccccc2cc1O 1174588
O=c1[nH]c2ccccc2cc1C 1174993
O=c1[nH]c2ccccc2c(=O)[nH]1 1175404
O=c1[nH]c2ccccc2[nH]c1=O 1175813
O=c1[nH]c2c([nH]1)[nH]c(=O)[nH]c2=O 1176233
O=[S@H]1=Nc2c(CC1)cccc2C 1176642
O=S1(=O)[N-]Cc2c(O1)cccc2 1177053
O=S1(=O)NCc2c(O1)cccc2 1177461
O=S1(=O)NCNc2c1cncc2 1177867
O=S1(=O)NCNc2c1cccc2 1178273
O=S1(=O)NCCc2c1cccc2 1178679
O=S1(=O)NC=Nc2c1cccc2 1179086
O=S1(=O)N=CNc2c1cncc2 1179493
O=S1(=O)N=CNc2c1cccc2 1179900
O=S1(=O)C=CNc2c1cccc2 1180307
O=P1c2ccsc2-c2c1ccs2 1180713
O=P1OCc2c(CO1)cccc2 1181120
O=C1c2ccccc2[C@@H](N1C)O 1181530
O=C1c2ccccc2C(=C)N1C 1181935
O=C1[C@]2(C)CCC[C@@]1(C)CNC2 1182348
O=C1[C@H](O)c2c(N1C)cccc2 1182758
O=C1[C@H](F)c2c(N1C)cccc2 1183168
O=C1[C@@H]2CCC[C@H]1OC(O2)(C)C 1183583
O=C1[C@@H](O)c2c(N1C)cccc2 1183994
O=C1SC=C/C/1=C\1/C=CSC1=O 1184404
O=C1Oc2ccccc2C[C@H]1C 1184812
O=C1OCc2c1c(O)ccc2C 1185216
O=C1OC[C@H](c2c1cccc2)O 1185624
O=C1OC[C@@H](c2c1cccc2)O 1186033
O=C1OCC[C@@]21CCC[C@]2(C)O 1186444
O=C1OCCOc2c1cccc2 1186846
O=C1Nc2cncnc2N[C@@H]1C 1187253
O=C1Nc2ccccc2SC1=C 1187656
O=C1Nc2ccccc2CN1C 1188059
O=C1Nc2c([C@H]1O)cc(cc2)F 1188469
O=C1Nc2c([C@@H]1O)cc(cc2)Br 1188881
O=C1Nc2c(C31CC3)cccc2 1189288
O=C1Nc2c(C1(C)C)cncn2 1189694
O=C1NS(=O)(=O)c2c1cccc2 1190102
O=C1NS(=O)(=O)Nc2c1nc[nH]2 1190514
O=C1NCc2c1c(O)c(cc2)O 1190921
O=C1NCc2c(N1)ccc(c2)Cl 1191328
O=C1NC[C@@H]2[C@H]1C[N@@H+]1[C@H]2CCC1 1191752
O=C1NC[C@@H]2[C@H]1CN1[C@H]2CCC1 1192169
O=C1NCCC[C@]21CCNC2=O 1192575
O=C1NCCCC21CCCCC2 1192977
O=C1NC2(CC2)NC(=O)C1(C)C 1193386
O=C1NC2(C=C2)NC(=O)C1(C)C 1193796
O=C1NC(=O)c2c1c(N)ccc2 1194203
O=C1NC(=O)c2c1c(C)ccc2 1194610
O=C1NC(=O)c2c(C1)cccc2 1195017
O=C1NC(=O)[C@@]2(N1C)CNCC2 1195428
O=C1NC(=O)[C@@H]2[C@H]1[C@H]1CC[C@@H]2O1 1195853
O=C1NC(=O)[C@@H]2[C@H]1[C@H]1C=C[C@@H]2O1 1196279
O=C1NC(=O)[C@@H]2[C@H]1[C@H]1C=C[C@@H]2C1 1196705
O=C1NC(=O)[C@@H]2[C@H]1[C@H](C)C=CC2 1197126
O=C1NC(=O)[C@@H]2[C@H]1[C@@H]1CC[C@H]2C1 1197551
O=C1NC(=O)[C@@H]2[C@H]1[C@@H]1C=C[C@H]2C1 1197977
O=C1NC(=O)NC21CCCCC2 1198382
O=C1N(C)c2c([C@H]1C)cccc2 1198792
O=C1N(C)c2c([C@@H]1C)cccc2 1199203
O=C1COc2c(N1)ccc(c2)F 1199609
O=C1COc2c(N1)ccc(c2)Cl 1200016
O=C1COc2c(N1)c(O)ccc2 1200423
O=C1CNc2c(N1C)cncn2 1200827
O=C1CNC(=O)[C@H]2N1CCCC2 1201236
O=C1CCc2c(O1)ccc(c2)Cl 1201643
O=C1CCc2c(O1)ccc(c2)Br 1202051
O=C1CCc2c(N1C)cccc2 1202456
O=C1CC[C@]2([C@]1(C)CCCC2)O 1202868
O=C1CC[C@H]2C(=O)[C@]1(C)CCC2 1203282
O=C1CC[C@@]2([C@@]1(C)CCCC2)O 1203696
O=C1CCSc2c(N1)cccc2 1204100
O=C1CCOc2c1c(O)ccc2 1204505
O=C1CCNc2c(N1)cccc2 1204909
O=C1CCCCc2c1cccc2 1205311
O=C1CC=Nc2c(N1)cccc2 1205716
O=C1CC(N2N1CCC2=O)(C)C 1206123
O=C1CC(C)(C)Cc2c1cn[nH]2 1206532
O=C1CC(C)(C)Cc2c1cc[nH]2 1206941
O=C1CC(C)(C)CC2=C1CCO2 1207348
O=C1CC(=O)c2c(O1)cccc2 1207755
O=C1CC(=Nn2c(N1)nnc2)C 1208162
O=C1C=Cc2c(CN1)cccc2 1208567
O=C1C=Cc2c(C1=O)cccc2 1208973
O=C1C=Cc2c(C1=N)cccc2 1209379
O=C1C=Cc2c(C1=C)cccc2 1209785
O=C1C=C[C@]2(C=C1)C=CC(=O)O2 1210198
O=C1C=CSc2c(N1)cccc2 1210603
O=C1C=CC(=O)c2c1cccc2 1211010
O=C1C=CC(=N)c2c1cccc2 1211416
O1Cc2c(C1)ccc1c2COC1 1211821
O1BO[C@H]2[C@@H](C1)O[C@H]1[C@@H]2OBO1 1212244
O/C=C\1/Cc2c(C1=O)cccc2 1212652
Nn1cnc2c(c1=O)cccc2 1213056
Nc1ncc(c2c1cccc2)F 1213459
Nc1nc2nccnc2c(n1)N 1213862
Nc1nc2nccnc2c(=O)[nH]1 1214269
Nc1nc2ncccc2c(n1)N 1214672
Nc1nc2ccccc2c(n1)O 1215075
Nc1nc2ccccc2c(n1)N 1215478
Nc1nc2ccccc2c(=O)[nH]1 1215885
Nc1nc2[nH]c(=O)[nH]c2c(=O)[nH]1 1216301
Nc1nc2NCCNc2c(=O)[nH]1 1216708
Nc1nc2NCC=Nc2c(=O)[nH]1 1217116
Nc1nc(N)c2c(n1)scc2C 1217521
Nc1nc(N)[nH+]c2c1cccn2 1217929
Nc1nc(N)[nH+]c2c1cccc2 1218336
Nc1nc(=O)c2c([nH]1)nccn2 1218745
Nc1nc(=O)c2c([nH]1)NCCN2 1219154
Nc1cccc2c1cc[nH]c2=O 1219559
Nc1cccc2c1c(O)ccc2 1219962
Nc1ccc2c(n1)nc(nc2)N 1220367
Nc1ccc2c(c1)C(=C)C(=O)N2 1220776
Nc1cc(C)c2c(n1)cccc2 1221181
Nc1cc(C)[nH+]c2c1cccc2 1221588
Nc1[nH]c(=O)c2c(n1)[nH]c[n+]2C 1222003
Nc1[nH]c(=O)c2c(n1)[nH+]cn2C 1222416
N[C@H]1CO[C@H]2[C@H]([C@@H]1O)OCOC2 1222836
NC1=NCC2=NCC(CN12)(F)F 1223243
N=C1c2ccccc2N(C1=O)C 1223648
N=C1NCCC2(S1)CCCCC2 1224052
N1[C@@H]2N[C@@H]3[C@H]1N[C@@H]1N[C@H]2N[C@@H]1N3 1224486
N1Cc2c(C1)c1c([nH]2)cccc1 1224896
N1CCNCC[NH2+]CCNCC1 1225300
N1CCNCCNCCNCC1 1225699
N#Cc1cnc2c(c1)cccc2 1226103
N#Cc1cccc2c1cccc2 1226505
N#Cc1ccc2c(c1)cccc2 1226909
N#Cc1ccc2c(c1)CCCN2 1227313
N#Cc1ccc(c(c1)C#N)C#N 1227719
N#Cc1cc(C)cc(c1N)C#N 1228124
N#Cc1cc(C#N)c(=O)[nH]c1N 1228533
N#Cc1c[nH]c2c1cnc(n2)N 1228940
N#Cc1c[nH]c2c1c(N)ncn2 1229347
N#Cc1c(N)[nH]c2c1cccc2 1229754
N#Cc1c(F)c(F)cc(c1F)F 1230160
N#Cc1c(C)[nH]c2c1cccc2 1230567
N#C[C@H]1NCCc2c1cccc2 1230973
N#C[C@H]1CCCc2c1cccc2 1231379
N#CC1=C(C)NC(=C(C1)C#N)C 1231788
N#CC1=C(C)C(=N)C(=O)NC1=O 1232198
N#CC1=C(C#N)C(=O)C=CC1=O 1232607
N#CC(=c1ccc(=C)cc1)C#N 1233014
N#C/C=C\C#Cc1ccccc1 1233418
N#C/C=C\1/OC(C=C1C#N)(C)C 1233828
Ic1ccc2c(c1O)nccc2 1234231
Ic1ccc2c(c1)c(=O)cc[nH]2 1234641
Ic1cc2C=[NH+][BH2-]Oc2c(c1)I 1235055
Ic1cc(C)c2c(c1)cc(o2)C 1235464
I/C=C\1/OC(=N)c2c1cccc2 1235873
I/C=C/1\OC=Nc2c1cccc2 1236280
Fc1cnc2c(c1)c(=O)cc[nH]2 1236690
Fc1cccc2c1c(=O)[nH]cc2 1237097
Fc1ccc2c(c1)sccc2=O 1237501
Fc1ccc2c(c1)nc[nH]c2=O 1237909
Fc1ccc2c(c1)ccc(=O)o2 1238315
Fc1ccc2c(c1)cc(cn2)C 1238720
Fc1ccc2c(c1)c([O-])cc[nH+]2 1239132
Fc1ccc2c(c1)c(=O)cco2 1239538
Fc1ccc2c(c1)c(=O)cc[nH]2 1239947
Fc1ccc2c(c1)c(=O)[nH]cn2 1240356
Fc1ccc2c(c1)[nH]ccc2=O 1240763
Fc1ccc2c(c1)C=C(C2=C)C 1241170
Fc1ccc2c(c1)C(=O)C(=O)N2 1241579
Fc1ccc2c(c1)C(=N)C(=O)N2 1241988
Fc1ccc2c(c1)C(=C)C(=O)N2 1242397
Fc1cc2nccnc2cc1F 1242798
Fc1cc2ccccc2cc1F 1243199
Fc1cc(F)c2c(c1F)ncs2 1243604
F[B-]1(F)[NH+]=Cc2c(O1)cccc2 1244018
F[B-]1(F)OC=Cc2[n+]1cncc2 1244428
F[B-]1(F)OC=Cc2[n+]1cccc2 1244838
F/C=C/1\CNCC2=CCCC[C@H]12 1245248
Cn1cnc2c(c1=O)cccc2 1245652
Cn1ccc2c(c1=O)cccc2 1246056
Cn1c(=O)ccc2c1ncnc2 1246460
Cn1c(=O)ccc2c1cccc2 1246864
Cn1c(=O)[nH]c2c(c1=O)c[nH]n2 1247277
Clc1cnc2c(c1)ccc(c2)Cl 1247684
Clc1ccc2c(n1)c(C)ccc2 1248092
Clc1ccc2c(c1)oc(=O)cc2 1248500
Clc1ccc2c(c1)ccc(n2)C 1248907
Clc1ccc2c(c1)ccc(=O)o2 1249315
Clc1ccc2c(c1)ccc(=O)[nH]2 1249726
Clc1ccc2c(c1)c(=O)cco2 1250134
Clc1ccc2c(c1)C(=O)C(=O)N2 1250545
Clc1ccc2c(c1)C(=N)C(=O)N2 1250956
Clc1ccc2c(c1)C(=C)C(=O)N2 1251367
Clc1cc2nccnc2cc1Cl 1251771
Clc1cc2ccccc2cc1Cl 1252176
Clc1cc(C)c2c(c1)cc(o2)C 1252586
Cl[Si-]1(Cl)(Cl)NCc2[n+]1cccc2 1253002
Cc1nc2ccccc2nc1C 1253407
Cc1nc2ccccc2c(n1)N 1253810
Cc1nc2ccccc2c(=O)o1 1254214
Cc1nc2ccccc2c(=O)[nH]1 1254621
Cc1n[nH]c2c1cc(cn2)C#N 1255028
Cc1cccc2c1nc[nH]c2=O 1255433
Cc1cccc2c1cc[nH]c2=O 1255838
Cc1cccc2c1c(=O)[nH]cn2 1256245
Cc1ccc2c(n1)[nH]ccc2=O 1256652
Cc1ccc2c(c1)oc(=O)cc2 1257058
Cc1ccc2c(c1)cccc2C 1257461
Cc1ccc2c(c1)ccc(n2)Cl 1257867
Cc1ccc2c(c1)ccc(c2)O 1258273
Cc1ccc2c(c1)ccc(=O)o2 1258679
Cc1ccc2c(c1)ccc(=O)[nH]2 1259088
Cc1ccc2c(c1)c(C)ccn2 1259493
Cc1ccc2c(c1)c(=O)cco2 1259899
Cc1ccc2c(c1)C(=O)C(=O)N2 1260308
Cc1ccc(c2c1cccc2)C 1260711
Cc1ccc(c2c1CCCO2)F 1261114
Cc1cc2ccccc2c(=O)o1 1261518
Cc1cc(N)c2c(n1)cccc2 1261923
Cc1cc(C)nc2c1c(=O)[nH]s2 1262332
Cc1cc(C)c2c(n1)nccc2 1262738
Cc1cc(C)c2c(n1)cccc2 1263143
Cc1cc(C)c2c(c1)oc(c2)C 1263550
Cc1cc(C)c2c(c1)cc(o2)C 1263957
Cc1cc(=O)n2c(n1)cccc2 1264363
Cc1cc(=O)n2c(n1)CCCC2 1264769
Cc1cc(=O)c2c(o1)cccc2 1265175
Cc1cc(=O)c2c([nH]1)cccc2 1265584
C[Si]1(C)NC=C2C1=CN[Si]2(C)C 1265997
C[Si](C#Cc1cccnc1)(C)C 1266406
C[Si](C#Cc1ccccn1)(C)C 1266814
C[Si](C#Cc1ccccc1)(C)C 1267222
C[N+]1=CC(c2c1cccc2)(C)C 1267632
C[C@]12C[C@@H]3C[C@H](C1)C[C@](C2)(C3)C 1268056
C[C@H]1c2ccccc2[BH2-][N+]1(C)C 1268471
C[C@H]1O[C@@H]2[C@H](C1)[C@@H](O)[C@@H](CO2)O 1268901
C[C@H]1Nc2ccccc2NC1=O 1269307
C[C@H]1NC(=O)c2c(N1)cccc2 1269717
C[C@H]1N=NC=Cc2c1cccc2 1270124
C[C@H]1CCc2c(S1(=O)=O)scc2 1270535
C[C@H]1CC[C@@]2(OC1)CCCCO2 1270948
C[C@@H]1CCc2c(C1=O)cccc2 1271357
C[C@@H]1CC[C@H]2[C@H](C1)C=C[C@@H](C2)C 1271781
C[C@@H]1CC[C@H]2C(=C1)C=C[C@@H](C2)C 1272202
C[C@@H]1CC(c2c1cccc2)(C)C 1272612
CN1c2ccccc2CS1(=O)=O 1273017
CN1[C@@H]2CCCC[C@H]2N([P@H+]1[BH3-])C 1273440
CN1C[C@@H]2CN(C[C@H](C1)C2=O)C 1273856
CN1CNc2c1c(=O)[nH]c(n2)N 1274265
CN1CCc2c(C1=O)cccc2 1274669
CN1CC(=O)N2[C@H](C1=O)CCC2 1275080
CN1C(=O)c2c(C1=O)cccc2 1275487
CN1C(=O)[C@@H]2[C@H](C1=O)CC=CC2 1275904
CN1C(=O)N(C)C(=O)C(=C)C1=O 1276315
CN1C(=N)N[C@@H]2[C@H](C1=O)CNC2 1276731
CCC#Cc1cnc(nc1N)N 1277133
CC=C1C(=O)OC(OC1=O)(C)C 1277541
CC1C(=O)c2c(C1=O)cccc2 1277948
CC1=Cc2c(C1)c(C)ccc2C 1278354
CC1=CCn2c(=N1)sc(=C)c2=O 1278763
CC1=CCC[C@]2([C@H]1CCCC2)C 1279175
CC1=CCC[C@@]2([C@@H]1CCCC2)C 1279588
CC1=CCC2=C(N1)CCCC2=O 1279994
CC1=C2C(=O)OC[C@@]2(CCC1)C 1280405
CC1=C(C)S/C(=C/2\SC=CS2)/S1 1280817
CC1(C)[NH+]=CC2(C1)CCCCC2 1281231
CC1(C)OCc2c(O1)cccc2 1281636
CC1(C)COC2(OC1)C=CC=C2 1282043
CC1(C)CCc2c(O1)cccc2 1282448
CC1(C)CCNc2c1cccc2 1282851
CC1(C)CCCc2c1cccc2 1283254
CC1(C)CC=Cc2c1cccc2 1283658
CC1(C)C=Cc2c(O1)cccc2 1284064
CC(C#Cc1ccccc1)(O)C 1284468
CC#[N+][BH-]1[C@@H]2CCC[C@H]1CCC2 1284886
CC#Cc1ccc(cc1)C#CC 1285289
C=C1c2ccsc2-c2c1ccs2 1285694
C=C1c2ccccc2N(C1=O)C 1286101
C=C1Nc2c(C1(C)C)cccc2 1286507
C=C1NC(=O)c2c(N1)cccc2 1286914
C=C1C[C@H]2O[C@@H]1c1c2cccc1 1287327
C=C1COc2c(C1=O)cccc2 1287732
C=C1CCc2c(C1=O)cccc2 1288137
C=C1C(=O)c2c(C1=O)cccc2 1288545
C=C1C(=O)C(=C)C(=O)C(=C)C1=O 1288958
C1Oc2c(O1)cc1c(c2)occ1 1289365
C1O[C@H]2[C@@H](C1)c1c(N2)cccc1 1289781
C1O[C@@H]2[C@H](N1)c1c(C2)cccc1 1290197
C1O[C@@H]2[C@H](C1)c1c(N2)cccc1 1290613
C1Nc2c(C1)c1cc[nH]c1cc2 1291021
C1N[C@H]2[C@@H](C1)c1c(N2)cccc1 1291437
C1N[C@@H]2[C@H](C1)c1c(N2)cccc1 1291853
C1NCC[NH2+]CC[NH2+]CC[NH2+]C1 1292267
C1NCCSCCSCCSC1 1292666
C1NCCC[NH2+]CCC[NH2+]CC1 1293078
C1Cc2c(C1)cc1c(c2)CCC1 1293485
C1Cc2c(C1)c1c([nH]2)cccc1 1293895
C1C[C@H]2NCCn3c2c(C1)cc3 1294304
C1C[C@@H]2CC[C@H](C1)[N+]12CCCC1 1294721
C1CNCC[NH2+]CCNCC[NH2+]1 1295130
C1CNCCOCCNCCO1 1295529
C1CC[C@]23[C@@H](C1)C[C@@H](O3)OC=C2 1295950
C1CCCc2c(CC1)nccc2 1296353
C1CCCCCCCCCCC1 1296752
C1=Cc2c3c([CH-]1)[cH-]cc3ccc2 1297166
C1=Cc2[cH-]cc3c2c([CH-]1)ccc3 1297580
C1=C[C@H]2O[C@@H]1[C@@H]1[C@H]2[C@@H]2O[C@H]1C=C2 1298014
C1=CC2=CC=CC3=C[CH-]C(=C1)[C+]23 1298431
C/C=C\1/C(=O)OC(=O)C1=C(C)C 1298843
C/C=C\1/C(=O)Nc2c1cccc2 1299251
C/C=C/1\C(=O)OC(=O)C1=C(C)C 1299663
Brc1ccc2c(c1)cccc2Br 1300068
Brc1ccc2c(c1)ccc(c2)Br 1300477
Brc1ccc2c(c1)ccc(=O)o2 1300886
Brc1ccc2c(c1)cc(cc2)Br 1301294
Brc1ccc2c(c1)c(=O)cco2 1301703
Brc1ccc2c(c1)NC(=O)C2=C 1302112
Brc1ccc2c(c1)CC(=O)N2C 1302520
Brc1ccc2c(c1)C(=O)NC2=O 1302929
Brc1ccc2c(c1)C(=O)C(=O)N2 1303340
Brc1ccc2c(c1)C(=N)C(=O)N2 1303751
Brc1cc2CNCNc2c(c1)Br 1304157
Brc1cc(C)c2c(c1)cc(o2)C 1304567
Brc1cc(Br)c2c(c1)nccc2 1304975
Brc1c(Br)cc2n1CCNC2=O 1305383
Br/C=C/1\CCCc2c1cccc2 1305791
*c1ncc(c2c1cccc2)O 1306195
*c1cccc2c1c(=O)[nH]cn2 1306602
*c1ccc2c(c1)nc[nH]c2=O 1307009
*c1ccc2c(c1)ccc(n2)C 1307414
*c1ccc2c(c1)ccc(=O)[nH]2 1307823
*c1ccc2c(c1)c(=O)[nH]cc2 1308232
*c1ccc2c(c1)[nH]c(=O)n2C 1308641
*c1ccc2c(c1)CNC(=N2)C 1309047
*c1ccc2c(c1)C(=C)C(=O)N2 1309456
*c1cc2cncnc2c(c1)F 1309859
*c1cc2CCCNc2c(c1)* 1310262
*c1[nH]c2c(n1)c(=O)[nH]c(n2)N 1310676
c1sc2c(n1)[nH]c1c2scn1 1311083
c1nc(nc2c1nc[nH]2)C#N 1311459
c1ccc2c(c1)[C@H]1C[C@H]1C=C2 1311840
c1cc2c[nH+]p3[n+]2c(c1)c[nH+]3 1312223
c1cc2c(s1)sc1c2ccs1 1312596
c1cc2c(s1)c1c(s2)ccs1 1312973
c1cc2c(s1)c1c([nH]2)ccs1 1313353
c1cc2c(s1)[C@@H]1CC[C@H]2CC1 1313736
c1cc2c(-c3c([SiH2]2)ccs3)s1 1314117
c1cc2C=[NH+][Se+]3[n+]2c(c1)C=[NH+]3 1314509
[SiH2]1O[Si@@H]2O[SiH2]O[Si@H](O1)O[SiH2]O2 1314906
[OH2+]c1ccc2c(c1)cccc2 1315286
[O-]c1cccc2c1nccc2 1315657
[O-]c1ccc2c(c1)cccc2 1316030
[O-]c1ccc2c([nH+]1)cccc2 1316407
[O-]c1cc(C)c(c(=O)[nH]1)C#N 1316787
[O-]c1cc(=O)n(c(=O)n1C)C 1317164
[O-][n+]1cn(c2c1cccc2)[O-] 1317543
[O-][n+]1ccnc2c1cccc2 1317917
[O-][n+]1cccc2c1cccc2 1318291
[O-][n+]1ccc2c(c1)cccc2 1318667
[O-][N+]1=C[N+](=O)C(C1(C)C)(C)C 1319052
[O-][N+]1=C[C@H]2[C@@H](C1)OC(O2)(C)C 1319442
[O-]N1C=[N+](C(C1(C)C)(C)C)[O-] 1319826
[O-]N1C(C)(C)CCCC1(C)C 1320201
[O-]C1=CC(=O)/C/1=C/1\[CH-]C=CN1 1320586
[NH3+]c1cccc2c1cccc2 1320959
[NH2+]=[P@@H]1[N-]P(=NP(=N1)(Cl)Cl)(Cl)Cl 1321353
[N-]=C=C1S[N-]C2=C1SC=CS2 1321738
[C@@H]12C3=C4*5678923(C1=C45)[C@@H]1C8=C7C6=C91 1322141
[2H]c1cc([2H])c(c(c1[2H])[2H])[2H] 1322528
[2H]c1c([2H])[nH+]c(c(c1[2H])[2H])[2H] 1322919
S=c1occc2c1cccc2 1323288
S=c1[nH]c2c(s1)c(=O)[nH]cn2 1323669
Oc1cnc2c(c1)cccc2 1324041
Oc1ccnc2c1cccc2 1324409
Oc1cccc2c1nccc2 1324777
Oc1cccc2c1cccc2 1325145
Oc1cccc2c1[nH+]ccc2 1325517
Oc1cccc2c1CC=CC2 1325886
Oc1ccc2c(c1)ncnc2 1326256
Oc1ccc2c(c1)nccc2 1326626
Oc1ccc2c(c1)cccc2 1326996
Oc1ccc2c(c1)SCCO2 1327366
Oc1ccc2c(c1)CCNC2 1327737
Oc1ccc2c(c1)CCCC2 1328107
Oc1ccc2c(c1)C(=O)CC2 1328480
Oc1cc[o+]c2c1cccc2 1328851
O[C@]12C[C@H]3C[C@@H](C2)C[C@@H](C1)C3 1329242
O[C@H]1c2ccccc2C1(C)C 1329616
O[C@H]1OC[C@H]2[C@@H]1OC(O2)(C)C 1330001
O[C@H]1C[C@H](O)[C@H]([C@@H]([C@H]1O)O)O 1330394
O[C@H]1CO[C@H]2[C@@H]1OC(O2)(C)C 1330779
O[C@H]1CNS(=O)(=O)NC[C@@H]1O 1331160
O[C@H]1CC[C@H]2[C@]1(C)CCCC2 1331542
O[C@H]1CC=Cc2c1cccc2 1331915
O[C@H]1CC(C)(C)[C@H]2[C@](C1)(C)O2 1332302
O[C@H]1CC(C)(C)C=C(C1=O)C 1332680
O[C@@H]1c2ccccc2C1(C)C 1333055
O[C@@H]1[C@@H]2C[C@@H]3C[C@H]1O[C@H](O2)O3 1333450
O[C@@H]1[C@@H]2C[C@@H]3C[C@H]1C[C@H](C2)C3 1333845
O[C@@H]1Cn2cc[nH+]c2C[C@H]1O 1334226
O[C@@H]1C[n+]2cc[nH]c2C[C@H]1O 1334609
O[C@@H]1C[C@H]2C([C@]1(C)cc2)(C)C 1334995
O[C@@H]1C[C@H](O)[C@H]([C@@H]([C@@H]1O)O)O 1335390
O[C@@H]1C[C@@H]2C([C@@]1(C)CC2)(C)C 1335778
O[C@@H]1C[C@@H](O)[C@H]([C@@H]([C@H]1O)O)O 1336173
O[C@@H]1C[C@@H](O)[C@@H]([C@@H]([C@H]1O)O)O 1336569
O[C@@H]1CO[C@H]2[C@@H]1OC(O2)(C)C 1336955
O[C@@H]1CO[C@H]2[C@@H]([C@H]1O)N=CS2 1337344
O[C@@H]1CO[C@@H]2[C@H]1OC(O2)(C)C 1337731
O[C@@H]1CNC=Nc2c1nc[nH]2 1338108
O[C@@H]1CN2[C@H]([C@@H]1O)[C@H](CC2)O 1338498
O[C@@H]1CCc2c(N1)cccc2 1338873
O[C@@H]1CCOc2c1cccc2 1339246
O[C@@H]1CCO[C@H]2[C@H]1OCOC2 1339627
O[C@@H]1CCN2[C@@H]1C(=O)NC2=O 1340009
O[C@@H]1CC=Cc2c1cccc2 1340383
O[C@@H]1CC(C)(C)C=C(C1=O)C 1340762
O[C@@H]1CC(=C)C(=C)[C@H]([C@H]1C)O 1341149
ON1C(C)(C)CCCC1(C)C 1341521
OC1CCC(CC1)(C#N)C#N 1341893
O=c1ocnc2c1cccc2 1342262
O=c1occc2c1cccc2 1342631
O=c1ncsc2c1cccc2 1343000
O=c1nc[nH]c2c1cccc2 1343373
O=c1nc[n-]c2c1ccnc2 1343745
O=c1cnc2c(o1)cccc2 1344116
O=c1cnc2c([nH]1)cccn2 1344490
O=c1cnc2c([nH]1)cccc2 1344864
O=c1ccsc2c1cccc2 1345233
O=c1ccoc2c1cccc2 1345603
O=c1ccnc2n1cccc2 1345972
O=c1ccnc2n1CCCN2 1346341
O=c1cccc2n1cccc2 1346710
O=c1ccc2c(o1)cccc2 1347081
O=c1ccc2c(n1C)[nH]nc2 1347455
O=c1ccc2c([nH]1)ncnc2 1347829
O=c1ccc2c([nH]1)nccc2 1348203
O=c1ccc2c([nH]1)cccc2 1348577
O=c1ccc2c([nH]1)CCCC2 1348951
O=c1cc[nH]c2c1cncn2 1349323
O=c1cc[nH]c2c1cccn2 1349695
O=c1cc[nH]c2c1cccc2 1350067
O=c1[nH]ncc2c1cccc2 1350439
O=c1[nH]cnc2c1nccn2 1350811
O=c1[nH]cnc2c1cncc2 1351183
O=c1[nH]cnc2c1ccnc2 1351555
O=c1[nH]cnc2c1cccc2 1351927
O=c1[nH]cnc2c1CCCC2 1352299
O=c1[nH]ccc2c1ccn2C 1352671
O=c1[nH]ccc2c1cccn2 1353043
O=c1[nH]ccc2c1cccc2 1353415
O=c1[nH]c2c([nH]1)ncnc2N 1353792
O=c1[nH]c(N)c2c(n1)[nH]cn2 1354171
O=c1[nH]c(=O)n2n1CC=CC2 1354547
O=c1[nH]c(=O)c2c([nH]1)nc[nH]2 1354930
O=c1[nH]c(=O)c2c([nH]1)csc2 1355310
O=c1[nH]c(=O)c2c([nH]1)[nH]cn2 1355694
O=[S@H]1=Nc2c(CC1)cccc2 1356070
O=[P@]12CN3CN(C2)CN(C1)C3 1356449
O=[N+]1C(C)(C)CCCC1(C)C 1356826
O=S1(=O)Nc2c(N1)cccc2 1357200
O=S1(=O)NCc2c1cccc2 1357573
O=S1(=O)NCCc2c1scc2 1357946
O=S1(=O)NC=Cc2c1scc2 1358321
O=S1(=O)N=Cc2c1cccc2 1358696
O=S1(=O)Cc2c(C1)cccc2 1359071
O=S1(=O)C=Cc2c1cccc2 1359445
O=C1[C@@H]2CN3C[C@H]1CN(C2)C3 1359828
O=C1[C@@H](N)CCN2N1CCC2 1360204
O=C1[C@@H](C)Nc2c1cccc2 1360580
O=C1Oc2c(C1)cc(cc2)Cl 1360954
O=C1O[C@H]2C([C@]1(C)CC2)(C)C 1361337
O=C1O[C@@H]2C([C@@]1(C)CC2)(C)C 1361721
O=C1O[C@@H]([C@]2(N1CCO2)C)C 1362102
O=C1O[BH-]2[N+](C1)(C)CC(=O)O2 1362485
O=C1OC[C@H]2[C@@H]1OC(O2)(C)C 1362867
O=C1OC[C@@H]2[C@H]1[C@@H]1C=C[C@H]2C1 1363257
O=C1OC[C@@H]2[C@H]1OC(O2)(C)C 1363639
O=C1OCCc2c1cccc2 1364008
O=C1OC(C)(C)OC(=O)C1C 1364382
O=C1OC(C)(C)OC(=O)C1=C 1364757
O=C1OC(=O)c2c1cccc2 1365129
O=C1OC(=O)[C@@H]2[C@H]1CC=CC2 1365511
O=C1OC(=C)c2c1cccc2 1365883
O=C1Nc2c([C@H]1O)cccc2 1366258
O=C1Nc2c([C@H]1C)cccc2 1366633
O=C1Nc2c([C@@H]1O)cccc2 1367009
O=C1Nc2c([C@@H]1C)cccc2 1367385
O=C1Nc2c(C1)cc(cc2)F 1367758
O=C1Nc2c(C1)cc(cc2)Cl 1368132
O=C1Nc2c(C1)cc(cc2)C 1368506
O=C1Nc2c(C1)cc(cc2)Br 1368880
O=C1Nc2c(C1)cc(cc2)* 1369254
O=C1N[C@H]2CNC[C@@H]2NC1=O 1369633
O=C1N[C@H](c2c1cccc2)O 1370008
O=C1N[C@@]2(C)CC[C@@H]1C(=O)N2 1370391
O=C1N[C@@H](c2c1cccc2)O 1370767
O=C1N[C@@H](c2c1cccc2)C 1371143
O=C1NNC(=O)C21CCCC2 1371515
O=C1NN=C[C@@H]2[C@H]1CC=CC2 1371895
O=C1NCc2c1cccc2N 1372264
O=C1NCc2c(O1)cccc2 1372635
O=C1NCc2c(N1)ncnc2 1373006
O=C1NCc2c(N1)cccc2 1373377
O=C1NCc2c(C1)cccc2 1373748
O=C1NCSc2c1cccc2 1374117
O=C1NCNc2c1cccn2 1374487
O=C1NCNc2c1cccc2 1374856
O=C1NCCn2c1ccc2Br 1375226
O=C1NCCc2c1cccc2 1375596
O=C1NCC[C@@H]2N[C@H]1CCC2 1375974
O=C1NCCCn2c1ccc2 1376343
O=C1NCCC21CCNCC2 1376712
O=C1NCC2(C1)CCCCC2 1377083
O=C1NC(=O)c2c1nccc2 1377455
O=C1NC(=O)c2c1cccc2 1377827
O=C1NC(=O)[C@@H]2[C@H]1CCCC2 1378208
O=C1NC(=O)[C@@H]2[C@H]1CC=CC2 1378590
O=C1NC(=O)[C@@H]2C[C@H]1CCC2 1378971
O=C1NC(=O)N[C@@]21CC=CC2 1379348
O=C1NC(=O)NC21CCCC2 1379720
O=C1NC(=O)CC21CCCC2 1380092
O=C1NC(=O)C2=C1CCCC2 1380465
O=C1NC(=N)c2c1cccc2 1380837
O=C1NC(=C)c2c1cccc2 1381209
O=C1N=CC2(N1)CCNCC2 1381581
O=C1N(C)Cc2c1cccc2 1381952
O=C1Cc2c(N1C)cccc2 1382323
O=C1Cc2c(N1)cc(cc2)Br 1382697
O=C1Cc2c(N1)cc(cc2)* 1383071
O=C1Cc2c(N1)c(Cl)ccc2 1383445
O=C1Cc2c(N1)c(Br)ccc2 1383820
O=C1C[C@@H]2N1CC([S@@]2=O)(C)C 1384204
O=C1C[C@@H]2C([C@@]1(C)CC2)(C)C 1384589
O=C1C[C@@H](c2c1cccc2)O 1384965
O=C1C[C@@H](c2c1cccc2)C 1385341
O=C1CSc2c(N1)cccc2 1385712
O=C1CSC2(N1)CCCCC2 1386084
O=C1COc2c(N1)cccc2 1386456
O=C1CO[B-]2(O1)OCC(=O)O2 1386833
O=C1CNc2c(N1)cccc2 1387204
O=C1CNP2(O1)NCC(=O)O2 1387578
O=C1CNC(=O)[C@H]2N1CCC2 1387955
O=C1CN=Cc2c(N1)scc2 1388327
O=C1CCc2c1cccc2Br 1388698
O=C1CCc2c(O1)cccc2 1389070
O=C1CCc2c(N1)nccc2 1389441
O=C1CCc2c(N1)cccc2 1389812
O=C1CC[C@]2([C@H](C1)CCC2)C 1390192
O=C1CC[C@@H]2[C@@H](C1)CCCC2 1390573
O=C1CC[C@@H]2C(=C1)CCCC2 1390950
O=C1CCOc2c1cccc2 1391319
O=C1CCNc2c1cccc2 1391688
O=C1CCCc2c1cccc2 1392057
O=C1CCCC[C@@H]2N1CCC2 1392431
O=C1CCC2(CC1)OCCO2 1392802
O=C1CC=Cc2c1cccc2 1393172
O=C1CC(C)(C)CC(=O)C1=N 1393547
O=C1CC(C)(C)CC(=O)C1=C 1393922
O=C1CC(=O)c2c1cccc2 1394294
O=C1C=C[C@]2(C=C1)CC=CC2 1394671
O=C1C=C[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1 1395061
O=C1C=C[C@@H]2[C@H]1[C@H]1CC[C@@H]2C1 1395451
O=C1C=CC2(O1)CCCCC2 1395823
O=C1C=C(c2c1cccc2)[O-] 1396198
O=C1C=C(Cl)C(=O)C(=C1Cl)Cl 1396577
O=C1C=C(C)C(=O)C(=C1C)C 1396956
O=C1C(=O)Nc2c1cccc2 1397328
O=C1C(=C)Sc2c1cccc2 1397700
O=C1C(=C)Oc2c1cccc2 1398073
O=C1C(=C)Nc2c1cccc2 1398445
O=C1C(=C)Cc2c1cccc2 1398817
O1COCC2(C1)COCOC2 1399187
O1CC[N+]23[SiH-]1(OCC3)OCC2 1399567
O1BOCC2(C1)COBOC2 1399938
O1BOBO[B-]21OBOBO2 1400309
O/N=C/1\CCc2c1cccc2 1400681
Nc1ncnc2c1nccc2 1401049
Nc1ncnc2c1cccc2 1401417
Nc1nccc2c1cccc2 1401785
Nc1ncc2c(n1)cccc2 1402155
Nc1nc2occc2c([nH+]1)N 1402529
Nc1nc2nc[nH]c2c(=O)[nH]1 1402906
Nc1nc2cc[nH]c2c(=O)[nH]1 1403283
Nc1nc2[nH]ccc2c([nH+]1)N 1403660
Nc1nc2NCNc2c(=O)[nH]1 1404034
Nc1nc(O)c2c(n1)n[nH]n2 1404409
Nc1nc(N)c2c(n1)occ2 1404781
Nc1nc(N)c2c(n1)[nH]cn2 1405156
Nc1nc(N)c2c(n1)[nH]cc2 1405531
Nc1nc(Cl)c2c(n1)[nH]cn2 1405907
Nc1nc(=O)c2c([nH]1)[nH]cn2 1406287
Nc1nc(=O)c2c([nH]1)[nH]cc2 1406666
Nc1nc(*)c2c(n1)[nH]cn2 1407041
Nc1cnnc2c1cccc2 1407409
Nc1cnc2c(n1)cccc2 1407779
Nc1ccnc2c1cccc2 1408147
Nc1cccc2c1nccc2 1408515
Nc1cccc2c1cccc2 1408883
Nc1cccc2c1CNCC2 1409251
Nc1cccc2c1CCNC2 1409619
Nc1ccc2c(n1)ncnc2 1409989
Nc1ccc2c(n1)cccc2 1410359
Nc1ccc2c(c1)ncnc2 1410729
Nc1ccc2c(c1)cncn2 1411099
Nc1ccc2c(c1)cccn2 1411469
Nc1ccc2c(c1)cccc2 1411839
Nc1ccc2c([nH+]1)cccc2 1412213
Nc1cc(=O)n(c(=O)n1C)C 1412587
Nc1[nH]c2c(n1)c(N)ncn2 1412962
Nc1[nH]c(=S)c2c(n1)[nH]cn2 1413341
Nc1[nH]c(=O)c2c(n1)[nH]cn2 1413721
Nc1[nH]c(=O)c2c(n1)[nH]cc2 1414100
Nc1[nH]c(=O)c2c(n1)[nH]c[nH+]2 1414483
Nc1[nH+]ccc2c1cccc2 1414855
NC1=N[C@H]2[C@@H](CS1)CCCC2 1415235
NC1=N[C@@H]2[C@H](CS1)CCOC2 1415616
NC1=NCc2c1c(F)ccc2 1415988
N=c1occc2c1cccc2 1416357
N=c1ccc2c(o1)cccc2 1416728
N=c1[nH]ncc2c1cccc2 1417100
N=c1[nH]cnc2c1cccc2 1417472
N=C1OCCc2c1cccc2 1417841
N=C1OC(=C)c2c1cccc2 1418213
N=C1NC(=N)c2c1cccc2 1418585
N=C1N=C(c2c1cccc2)N 1418957
N=C1C[C@@H]2C([C@@]1(C)CC2)(C)C 1419341
N=C1CCCc2c1cccc2 1419710
N=C1C(=O)Nc2c1cccc2 1420082
N1C[C@H]2[C@@H](C1)N1[C@@H](C2)CSC1 1420470
N1C[C@@H]2[C@H](C1)N1[C@H](C2)CSC1 1420858
N1CCc2c(CC1)cccc2 1421229
N#Cc1csc2c1CCNC2 1421598
N#Cc1csc2c1CCCC2 1421968
N#Cc1cnn2c1ncnc2 1422338
N#Cc1cnn2c1nccc2 1422707
N#Cc1cnc(c(c1)C#N)N 1423079
N#Cc1cccc(c1N)C#N 1423449
N#Cc1ccc2c(c1)cc[nH]2 1423823
N#Cc1ccc2c(c1)[nH]cn2 1424197
N#Cc1ccc2c(c1)[nH]cc2 1424571
N#Cc1ccc2c(c1)COC2 1424942
N#Cc1cc2c([nH]1)cccc2 1425316
N#Cc1cc(Cl)ccc1C#N 1425687
N#Cc1c[nH]c2c1cccn2 1426060
N#Cc1c[nH]c2c1cccc2 1426432
N#C[C@H]1CNc2c1cccc2 1426805
N#C[C@H]1CCC[C@]([C@@H]1C)(C)O 1427188
N#C[C@@H]1CCC[C@@]([C@H]1C)(C)O 1427572
N#CC(=C1C=COC=C1)C#N 1427945
N#C/C=C\1/OC(=O)C(=C1Cl)Cl 1428324
N#C/C=C\1/C=CCC(C1)(C)C 1428702
N#C/C=C/1\C=CCC(C1)(C)C 1429078
Ic1cnc2c(c1)cccc2 1429448
Ic1cccc2c1cccc2 1429817
Ic1ccc2c(c1)cccn2 1430188
Ic1ccc2c(c1)cccc2 1430559
Ic1ccc2c(c1)cc(o2)C 1430932
Ic1cc(C)c2c(c1)cco2 1431305
Ic1c[nH]c2c1c(N)ncn2 1431679
Fc1nc(N)c2c(n1)[nH]cn2 1432055
Fc1cncc2c1cccc2 1432423
Fc1cccc2c1nccc2 1432791
Fc1cccc2c1cccc2 1433159
Fc1ccc2c(c1)scc2* 1433529
Fc1ccc2c(c1)ccn2C 1433900
Fc1ccc2c(c1)cccc2 1434270
Fc1ccc2c(c1)cc(o2)C 1434642
Fc1ccc2c(c1)COCO2 1435012
Fc1ccc2c(c1)CNC2=O 1435383
Fc1ccc2c(c1)CCCO2 1435753
Fc1cc2[nH]cnc2cc1F 1436124
Fc1cc2[nH]ccc2cc1C 1436495
Fc1cc(F)c(c(c1I)F)I 1436867
Fc1cc(F)c(c(c1F)[NH3+])F 1437246
Fc1cc(F)c(c(c1F)N)F 1437618
Fc1cc(F)c(c(c1F)I)F 1437990
Fc1cc(F)c(c(c1F)F)F 1438363
Fc1cc(F)c(c(c1F)Br)F 1438736
Fc1cc(C)c2c(c1)cco2 1439109
Fc1c[nH]c2c1c(N)ncn2 1439482
Fc1c(F)cc(c(c1F)F)I 1439854
F[C@@H]1C[C@H](F)[C@@H]([C@H]([C@@H]1F)C)F 1440250
F[C@@H]1C[C@H](F)[C@@H]([C@@H]([C@@H]1F)C)F 1440646
F[B-]1(F)OC=Nc2[n+]1ccs2 1441023
FP1=NP(=NP(=N1)(F)F)(F)F 1441401
FC1(F)C(F)(F)C=CC1(F)F 1441779
Cn1nnc2n(c1=O)cnc2 1442150
Cn1ncc2c1c(=O)[nH]cn2 1442524
Cn1nc(c2c1cccc2)Cl 1442895
Cn1cnc2c(c1=O)cn[nH]2 1443270
Cn1cnc2c(c1=O)cc[nH]2 1443644
Cn1ccc2c1ncnc2N 1444012
Cn1ccc2c(c1=O)ccs2 1444383
Cn1ccc2c(c1=O)[nH]cc2 1444758
Cn1cc(c2c1cccc2)C 1445128
Cn1c(C)cc2c1cccc2 1445498
Cn1c(Br)cc2c1cccc2 1445869
Cn1c(=S)[nH]c2c1cccc2 1446244
Cn1c(=O)[nH]c2c1cccn2 1446619
Cn1c(=O)[nH]c2c1cccc2 1446993
Cn1c(=N)sc2c1cccc2 1447364
Cn1c(=N)[nH]c2c1cccc2 1447739
Clc1nc[n+]2c(c1)C=CO[BH2-]2 1448119
Clc1nc(Cl)c2c(n1)[nH]cn2 1448497
Clc1cnc2c(n1)cccc2 1448870
Clc1ccnc2c1cccc2 1449240
Clc1cccc2c1nccc2 1449610
Clc1cccc2c1cccc2 1449980
Clc1ccc2c(n1)nccc2 1450352
Clc1ccc2c(n1)cccc2 1450724
Clc1ccc2c(n1)[nH]nc2C 1451099
Clc1ccc2c(c1)nccn2 1451471
Clc1ccc2c(c1)nccc2 1451843
Clc1ccc2c(c1)cccn2 1452215
Clc1ccc2c(c1)cccc2 1452587
Clc1ccc2c(c1)cc(o2)C 1452961
Clc1ccc2c(c1)[nH]c(=O)[nH]2 1453342
Clc1ccc2c(c1)[nH+]ccc2 1453718
Clc1ccc2c(c1)CCC2=O 1454091
Clc1cc2O[BH2-]Oc2cc1Cl 1454467
Clc1cc(Cl)c(c(c1Cl)Cl)Cl 1454846
Clc1cc(C)c2c(c1)cco2 1455224
Clc1c(O)cc(c(c1Cl)Cl)Cl 1455601
Cl[PH+]1N=P(Cl)(Cl)[N-]P(=N1)(Cl)Cl 1455993
ClP1=NP(=NP(=N1)(Cl)Cl)(Cl)Cl 1456383
ClC1=CCOc2c1cccc2 1456761
Cl/C=C/[I+]c1ccc(cc1)C 1457137
Cc1ncnc2c1cccc2 1457507
Cc1nccc2c1cccc2 1457875
Cc1nc2c([nH]1)ncnc2N 1458248
Cc1n[nH]c2c1N=CCCN2 1458620
Cc1n[nH]c2c1CCC(=O)N2 1458994
Cc1csc2c1c(=O)[nH]cn2 1459368
Cc1cnc2c(n1)cccc2 1459739
Cc1cnc2c(c1)cccc2 1460109
Cc1cn2c(s1)nccc2=O 1460480
Cc1ccnc2c1cccn2 1460849
Cc1ccnc2c1cccc2 1461217
Cc1cccc2c1nccc2 1461585
Cc1cccc2c1cncc2 1461953
Cc1cccc2c1cccc2 1462321
Cc1ccc2c(n1)scc2N 1462691
Cc1ccc2c(n1)nccc2 1463062
Cc1ccc2c(n1)cccc2 1463432
Cc1ccc2c(n1)C(=O)NC2 1463805
Cc1ccc2c(c1)sc[n+]2C 1464178
Cc1ccc2c(c1)cccn2 1464549
Cc1ccc2c(c1)cccc2 1464919
Cc1ccc2c(c1)cc(o2)C 1465291
Cc1ccc2c(c1)[nH]c(=O)o2 1465667
Cc1ccc2c(c1)CNCO2 1466037
Cc1ccc2c(c1)CCCO2 1466407
Cc1ccc2c(c1)CCCN2 1466777
Cc1ccc2c(c1)CCC=C2 1467148
Cc1ccc2c([nH+]1)nccc2 1467522
Cc1ccc(c2c1CNC2)C 1467892
Cc1ccc(c2c1CCC2)C 1468262
Cc1cc2scnc2cc1C 1468630
Cc1cc2occc2cc1C 1468999
Cc1cc2[nH]cnc2cc1C 1469370
Cc1cc2[nH+]c[nH]c2cc1C 1469745
Cc1cc(C)n2c(n1)ncn2 1470117
Cc1cc(C)c2n(n1)cnc2 1470489
Cc1cc(C)c2c(c1)cco2 1470861
Cc1cc(C)c(c(c1C)C)C 1471233
Cc1cc(C)c(c(c1C)Br)C 1471606
Cc1cc(C)[nH]c(=O)c1C#N 1471982
Cc1cc(C)[n+]2c(n1)nc[n-]2 1472360
Cc1cc(=O)n2c([nH]1)ncn2 1472736
Cc1[nH]c2c(c1C)cccc2 1473109
C[n+]1cn(c2c1cccc2)C 1473482
C[n+]1ccnc2c1cccc2 1473853
C[n+]1cccc2c1cccc2 1474224
C[n+]1ccc2c(c1)cccc2 1474597
C[Si]1(C)C=Cc2c1cccc2 1474971
C[Si](C#Cc1scnc1)(C)C 1475346
C[Si](C#Cc1cccs1)(C)C 1475722
C[N+]1=CC(=C)c2c1cccc2 1476099
C[C@]12O[C@H]3C[C@@H](O2)C[C@@H](O1)C3 1476490
C[C@H]1NC[C@H]2[C@@H]1C(=O)NC2=O 1476875
C[C@H]1COC2(O1)CCNCC2 1477249
C[C@H]1CNc2c(C1)cccc2 1477623
C[C@H]1CCc2c(N1)cccc2 1477997
C[C@H]1C=Cc2c(N1)cccc2 1478372
C[C@H]1C=C[C@@H]2[C@@H](C1)CCCC2 1478757
C[C@@H]1[C@@H]2C[C@@H]3C[C@H]1C[C@H](C2)C3 1479152
C[C@@H]1NCCc2c1cccc2 1479525
C[C@@H]1CNc2c(C1)cccc2 1479900
C[C@@H]1CCNc2c1cccc2 1480273
C[C@@H]1CCCc2c1cccc2 1480646
C[C@@H]1C=Cc2c(N1)cccc2 1481022
CN1C[C@@H]2CNC[C@H](C1)C2=O 1481402
CN1CCc2c(C1)cccc2 1481772
CN1CCOc2c1cccc2 1482140
CN1CCCc2c1cccc2 1482508
CN1CC=Nc2c1cccc2 1482877
CN1CC=Cc2c1cccc2 1483246
CN1CC(=O)N([C@H](C1=O)O)C 1483624
CN1C(C)(C)CCCC1(C)C 1483996
CN1C(=O)[C@@H]2[C@H](C1=O)CNC2 1484379
CN1C(=O)CC(=O)N(C1=O)C 1484754
CC=[P-]1(=O)OCC(CO1)(C)C 1485131
CC1=[NH+]CNc2c1cccc2 1485505
CC1=Nc2n(C(=O)C1)ncn2 1485879
CC1=CCC[C@@]2(O1)CCCO2 1486254
CC1(C)[C@H]2[NH+]=CN[C@]1(C)CC2 1486638
CC1(C)Oc2c(O1)cccc2 1487010
CC1(C)O[C@H]2[C@H](O1)CC=CC2 1487391
CC1(C)O[C@H]2[C@@H](O1)CCC=C2 1487773
CC1(C)O[C@@H]2[C@H](O1)CCCC2 1488154
CC1(C)Cc2c(O1)cccc2 1488526
CC1(C)CNc2c1nccc2 1488896
CC1(C)CNc2c1cccc2 1489266
CC1(C)CCc2c1cccc2 1489636
CC1(C)C=[NH+]c2c1cccc2 1490011
CC1(C)C=Nc2c1cccc2 1490382
CC1(C)C=Cc2c1cccc2 1490753
CC(C#Cc1cccs1)(C)C 1491124
CC(=C1C(=O)OC(=O)C1=C)C 1491501
CC#Cc1cnc(nc1N)N 1491870
CC#Cc1ccc(c(c1)I)[O-] 1492244
CC#Cc1ccc(c(c1)I)O 1492616
CC#Cc1c[nH]c(=O)nc1N 1492990
CC#Cc1c[nH]c(=O)[nH]c1=O 1493367
CC#Cc1c[nH+]c(nc1N)N 1493740
CC#CC#Cc1ccccc1 1494108
C=[N+]1C(C)(C)CCCC1(C)C 1494484
C=CC#Cc1ccc(cc1)C 1494854
C=C1[C@@H]2C[C@@H]3C[C@H]1C[C@H](C2)C3 1495245
C=C1OC=Nc2c1cccc2 1495615
C=C1CNc2c(N1)cccc2 1495986
C=C1CCCc2c1cccc2 1496355
C=C1CCC[C@]2([C@H]1CCC2)C 1496733
C=C1CCC[C@]2([C@H]1CC=C2)C 1497112
C=C1CCC[C@]2([C@@H]1CCC2)C 1497491
C=C1CCCC2(C1CCC2)C 1497862
C=C1C=Cc2c(O1)cccc2 1498234
C=C1C(=O)Oc2c1cccc2 1498606
C=C1C(=O)Nc2c1cccc2 1498978
C=C1C(=O)Nc2[n+]1cccc2 1499353
C=C1C(=O)Cc2c1cccc2 1499725
C1NP23[N+](C1)(CCN3)CCN2 1500102
C1Cn2c(O1)c1[n+](c2)CCO1 1500480
C1C[C@H]2O[C@@H]1c1c2cccc1 1500859
C1C[C@H]2C[C@@H]1c1c2cccc1 1501238
C1C[C@H]2CC[C@@H]1c1c2csc1 1501617
C1CSc2c(NC1)cccc2 1501988
C1COc2c(OC1)cccc2 1502359
C1COc2c(CN1)cccc2 1502729
C1CNc2c(CN1)cccc2 1503099
C1CNc2c(C=C1)cncn2 1503470
C1CNP2(=N[PH2]=N[PH2]=N2)NC1 1503851
C1CN2CCO[Si@@H](O1)OCC2 1504230
C1CCc2c(CC1)cccc2 1504601
C1CCCc2c(CC1)[nH]nn2 1504974
C1CCC2(CC1)CCN=CS2 1505345
C1C=Nc2c(SC1)cccc2 1505717
C1C=Nc2c(NC1)cccc2 1506089
C1C=Nc2c(N=C1)cccc2 1506461
C1C=Nc2c(CS1)cccc2 1506832
C1=C[C@H]2O[C@@H]1c1c2cccc1 1507213
C1=CNc2c(CS1)cccc2 1507584
C/C=C/1\C(=O)OC(=CC1=O)C 1507962
Brc1cnc2c(c1)ncn2C 1508333
Brc1cccc2c1cccn2 1508703
Brc1cccc2c1cccc2 1509073
Brc1ccc2c(c1)ccn2C 1509445
Brc1ccc2c(c1)cccn2 1509817
Brc1ccc2c(c1)cccc2 1510189
Brc1ccc2c(c1)cc(o2)C 1510563
Brc1ccc2c(c1)cc([nH]2)C 1510940
Brc1ccc2c(c1)CNCO2 1511312
Brc1ccc2c(c1)CCCO2 1511684
Brc1ccc2c(c1)CCCC2 1512056
Brc1ccc2c(c1)CCC2=O 1512429
Brc1cc2[nH]c(=O)[nH]c2nc1 1512808
Brc1cc(C)c2c(c1)cco2 1513182
Brc1cc(Br)c(c(c1Br)Br)Br 1513560
*c1nc2c([nH]1)ncnc2N 1513938
*c1nc(N)c2c(n1)[nH]cn2 1514313
*c1ccnc2c1cccc2 1514681
*c1cccc2c1nccc2 1515049
*c1cccc2c1cccn2 1515417
*c1cccc2c1cccc2 1515785
*c1ccc2n(n1)cc(n2)C 1516157
*c1ccc2c(c1)nccc2 1516527
*c1ccc2c(c1)nc([nH]2)N 1516902
*c1ccc2c(c1)cncn2 1517272
*c1ccc2c(c1)cncc2 1517642
*c1ccc2c(c1)cccn2 1518012
*c1ccc2c(c1)cccc2 1518382
*c1ccc2c(c1)[nH]c(=O)o2 1518758
*c1cc2[nH]cnc2cc1* 1519129
*c1cc(*)c2c(c1)[nH]cc2 1519504
*c1c[nH]c2c1c(N)ncn2 1519877
*12345678([C@@H]9[C@H]1[C@H]3[C@H]4[C@H]29)[C@@H]1[C@H]5[C@H]7[C@H]8[C@H]61 1520305
n1cnc2c(c1)ncnc2 1520674
n1cnc2c(c1)ccnc2 1521011
c1cnc2c(c1)ncnc2 1521348
c1cnc2c(c1)nccc2 1521685
c1cnc2c(c1)cncn2 1522022
c1cnc2c(c1)cncc2 1522359
c1cnc2c(c1)ccnc2 1522696
c1cnc2c(c1)cccn2 1523033
c1cnc2c(c1)c[nH+]cc2 1523374
c1ccc2c(n1)nccn2 1523711
c1ccc2c(c1)nncc2 1524048
c1ccc2c(c1)ncnc2 1524385
c1ccc2c(c1)nccn2 1524722
c1ccc2c(c1)nccc2 1525059
c1ccc2c(c1)cnnc2 1525396
c1ccc2c(c1)cncc2 1525733
c1ccc2c(c1)cccc2 1526070
c1ccc2c(c1)c[nH+]nc2 1526411
c1ccc2c(c1)c[nH+]cc2 1526752
c1ccc2c(c1)[nH+]ncn2 1527093
c1ccc2c(c1)[nH+]cnc2 1527434
c1ccc2c(c1)[nH+]ccn2 1527775
c1ccc2c(c1)[nH+]ccc2 1528116
c1ccc2c(c1)SN=CN2 1528454
c1ccc2c(c1)C=[NH+][BH2-]O2 1528802
c1ccc2c(c1)C=[NH+]CN2 1529144
c1ccc2c(c1)C=[NH+]CC2 1529486
c1ccc2c(c1)C=NNC2 1529824
c1ccc2c(c1)C=NCC2 1530162
c1ccc2[n+](c1)cccc2 1530502
c1ccc2-c(cc1)ccc2 1530840
c1cc[cH+]c2c(c1)cc[cH-]2 1531185
c1cc[cH+]c2c(c1)[cH-]cc2 1531530
c1c[c-]c2c(c1)cccc2 1531870
c1[c-][c-]c2c(n1)nc[c-]c2 1532216
[n-]1cnc2c1[nH+]cc(c2)Br 1532561
[n-]1cnc2[n+]1ccc(n2)C 1532905
[c-]1[c-]cc2c([c-]1)c[c-]cn2 1533254
[Se]=c1[nH]c2c([nH]1)cccc2 1533601
[O-]n1n[nH+]c2c1cccc2 1533944
[O-]c1[nH]c2c([nH+]1)cccc2 1534291
[O-]c1[nH]c2[n+](c1)cccc2 1534637
[O-][n+]1n[nH]c2c1cccc2 1534981
[O-]C1=CC(=O)OC(O1)(C)C 1535325
[O-]C1=CC(=O)CC(C1)(C)C 1535669
[NH3+][C@@H]1C[C@H](O)[C@H]([C@@H](C1)[NH3+])O 1536036
[NH2+]=c1[nH]cnc2c1nc[nH]2 1536383
[NH2+]=[B-]1[C@@H]2CCC[C@H]1CCC2 1536736
[NH2+]=[B-]1OC(C(O1)(C)C)(C)C 1537086
[NH2+]=[B-]1NCc2c1cccc2 1537430
[NH2+]1CCc2c(C1)cccc2 1537772
[BH2-]=C1NC(CC1(C)C)(C)C 1538117
[BH-]1=[NH+]c2c(C=C1)cccc2 1538464
[BH+2]123[BH+3]456[BH+3]781[BH+3]192[BH+3]234[BH+3]345[BH+3]567[BH+3]681[BH+3]923[BH+2]456 1538875
[2H]C([N+]([2H])([2H])[2H])C([2H])([2H])[2H] 1539240
[2H]C(C(=N)C([2H])([2H])[2H])([2H])[2H] 1539600
S[C@@H]1CO[C@H]([C@@H]([C@H]1O)O)O 1539955
S=c1sc2c([nH]1)cccc2 1540297
S=c1[nH]cc2n1cccc2 1540638
S=c1[nH]c2c([nH]1)cccc2 1540983
S=[P@@H]1C=C2C(=C1)CCCC2 1541329
S=C1NC(=O)C(=C)C(=O)N1 1541674
S1[C@@H]2S[C@@H]3S[C@H]1S[C@H](S2)S3 1542032
S1SSc2c(SS1)csc2 1542375
Oc1ncnc2c1nc[nH]2 1542719
Oc1csc2c1cccc2 1543054
Oc1ccnc2n1ccc2 1543390
Oc1cccc2c1cc[nH]2 1543728
Oc1cccc2c1[nH]cn2 1544066
Oc1cccc2c1[nH]cc2 1544404
Oc1ccc2c(c1)scn2 1544741
Oc1ccc2c(c1)scc2 1545079
Oc1ccc2c(c1)onc2 1545417
Oc1ccc2c(c1)occ2 1545754
Oc1ccc2c(c1)n[nH]c2 1546094
Oc1ccc2c(c1)cco2 1546431
Oc1ccc2c(c1)cc[nH]2 1546771
Oc1ccc2c(c1)[nH]nc2 1547111
Oc1ccc2c(c1)[nH]cn2 1547451
Oc1ccc2c(c1)OCO2 1547788
Oc1ccc(c(c1*)O)* 1548125
Oc1cc(C)c(c(c1)O)* 1548464
Oc1cc(C)c(c(c1)C)Cl 1548804
Oc1cc(Br)c(cc1Br)O 1549144
O[P@]1(=O)O[C@@H]2[C@H](O1)COC2 1549498
O[C@H]1[C@H](O)CC[C@H]([C@@H]1O)O 1549853
O[C@H]1[C@H](O)CC[C@@H]([C@@H]1O)O 1550208
O[C@H]1OC[C@H]([C@@H]([C@H]1N)O)O 1550562
O[C@H]1C[C@H](O)C(=C)C(=C)C1 1550911
O[C@H]1CO[C@H]2[C@@H]1CCCO2 1551259
O[C@H]1CO[C@H]([C@@H]([C@H]1O)O)O 1551613
O[C@H]1CO[C@H]([C@@H]([C@H]1O)O)C 1551967
O[C@H]1CO[C@@H]([C@H]([C@H]1O)O)O 1552321
O[C@H]1CO[C@@H]([C@H]([C@@H]1O)O)C 1552676
O[C@H]1CO[C@@H]([C@@H]([C@H]1O)O)O 1553031
O[C@H]1CO[C@@H]([C@@H]([C@@H]1O)O)C 1553387
O[C@H]1CO[C@@H](C(=O)[C@@H]1O)C 1553739
O[C@H]1COC(=O)[C@@H]([C@H]1O)O 1554090
O[C@H]1CNC(=O)NC[C@@H]1O 1554435
O[C@H]1CCc2c1cccc2 1554774
O[C@H]1CC(=CC(C1)(C)C)C 1555118
O[C@@H]1OC[C@H]([C@@H]([C@H]1N)O)O 1555473
O[C@@H]1C[NH2+][C@H]([C@H]([C@H]1O)O)C 1555832
O[C@@H]1C[C@H]2[C@@H](C1)C[C@H](C2)O 1556189
O[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C 1556546
O[C@@H]1C[C@H]2CC[C@@H](C1)N2C 1556897
O[C@@H]1C[C@H](O)[C@H](C[C@@H]1O)O 1557252
O[C@@H]1C[C@@H]2C([C@H]1CC2)(C)C 1557605
O[C@@H]1C[C@@H](O)[C@@H]([C@H](C1)O)O 1557963
O[C@@H]1C[C@@H](O)[C@@H]([C@@H](C1)O)O 1558322
O[C@@H]1C[C@@H](O)[C@@H](C(=O)C1)O 1558677
O[C@@H]1CO[C@H]2[C@@H](C1)OCC2 1559028
O[C@@H]1CO[C@H]([C@H]([C@H]1O)O)O 1559382
O[C@@H]1CO[C@H]([C@H]([C@H]1O)O)C 1559736
O[C@@H]1CO[C@H]([C@H]([C@@H]1O)O)O 1560091
O[C@@H]1CO[C@H]([C@@H]([C@H]1O)O)O 1560446
O[C@@H]1CO[C@H]([C@@H]([C@H]1O)F)O 1560801
O[C@@H]1CO[C@H]([C@@H]([C@@H]1O)O)O 1561157
O[C@@H]1CO[C@@H]([C@H]([C@H]1O)O)O 1561512
O[C@@H]1CO[C@@H]([C@H]([C@@H]1O)O)O 1561868
O[C@@H]1CO[C@@H]([C@H]([C@@H]1O)O)C 1562224
O[C@@H]1CO[C@@H]([C@@H]([C@H]1O)[NH3+])O 1562585
O[C@@H]1CO[C@@H]([C@@H]([C@H]1O)O)O 1562941
O[C@@H]1CO[C@@H]([C@@H]([C@H]1O)O)F 1563297
O[C@@H]1CO[C@@H]([C@@H]([C@H]1O)F)O 1563653
O[C@@H]1CN[C@]2([C@@H]1CCC2)C 1564003
O[C@@H]1CN[C@H]([C@H]([C@H]1O)O)C 1564357
O[C@@H]1CCc2c1cccc2 1564697
O[C@@H]1CC[C@H]2C[C@@H]1C2(C)C 1565048
O[C@@H]1CC[C@@H]2[C@H](C1)NCC2 1565399
O[C@@H]1CC(=CC(C1)(C)C)C 1565744
O[C@@H]1C=Nc2c1cccc2 1566085
O[C@@H]1C=C[C@@H]2C[C@H]1OCC2 1566435
ON1C(C)(C)C=CC1(C)C 1566775
OCC#Cc1ccccc1 1567109
OC1Cc2c(C1)cccc2 1567446
OC1CC(=CC(C1)(C)C)C 1567786
OC1C(=O)NC(=O)NC1=O 1568126
OC1=C[C@H]2[C@@H](C1)C=C(C2)O 1568476
OC1=C[C+](O)CC(C1)(C)C 1568819
OC1=CC(=O)CC(C1)(C)C 1569160
OC1=CC(=O)C(=CC1=O)O 1569501
OB1OCc2c1cccc2 1569836
O=c1sc2c(s1)sc(=S)[nH]2 1570180
O=c1sc2c([nH]1)cccc2 1570525
O=c1oc2c([nH]1)cccc2 1570867
O=c1nc[nH]c2c1nc[nH]2 1571209
O=c1nc[nH]c2c1cn[nH]2 1571551
O=c1ccoc2c1scc2 1571887
O=c1ccnc2n1ncs2 1572224
O=c1ccnc2n1ccs2 1572561
O=c1cccc2n1CCS2 1572898
O=c1ccc2c([nH]1)[nH]nc2 1573243
O=c1[nH]sc2c1cccc2 1573582
O=c1[nH]nnc2n1cnc2 1573922
O=c1[nH]cnc2c1scc2 1574261
O=c1[nH]cnc2c1nn[nH]2 1574604
O=c1[nH]cnc2c1nc[nH]2 1574946
O=c1[nH]cnc2c1cn[nH]2 1575288
O=c1[nH]cnc2c1ccs2 1575627
O=c1[nH]cnc2c1cc[nH]2 1575970
O=c1[nH]cnc2c1[nH]cn2 1576312
O=c1[nH]cnc2c1[nH]cc2 1576654
O=c1[nH]cnc2c1CCC2 1576993
O=c1[nH]ccc2c1cco2 1577332
O=c1[nH]cc2c(n1)occ2 1577673
O=c1[nH]c2c([nH]1)ccnc2 1578017
O=c1[nH]c2c([nH]1)cccc2 1578361
O=c1[nH][se]c2c1cccc2 1578703
O=c1[nH][nH]c2c1cncn2 1579046
O=c1[nH][nH]c2c1cccn2 1579388
O=c1[nH][nH]c2c1cccc2 1579730
O=[S@@]1C[C@@H]2[C@H](C1)NC(=O)N2 1580084
O=[P@H]1C=Cc2c1cccc2 1580426
O=[P@@H]1N[C@H]2[C@H](N1)CCCC2 1580778
O=[P@@H]1C=Cc2c1cccc2 1581121
O=S1(=O)OCCC=C2N1C2 1581462
O=S1(=O)NC[C@H]2N1CCC2 1581806
O=S1(=O)N=C[C@@H]2[C@H]1C=NO2 1582157
O=S1(=O)C=Cc2c1ccs2 1582498
O=C[O-][H][n+]1ccccc1 1582842
O=C[O-][H+][N]1=CC=CC=C1 1583187
O=CO[H][N]1=CC=CC=C1 1583528
O=CC#Cc1ccccc1 1583863
O=C1[C@@H]2CNC[C@H]1CNC2 1584208
O=C1[C@@H]2CCS[C@@H]2C1(Cl)Cl 1584558
O=C1[C@@H]2CCC[C@H]1CNC2 1584906
O=C1O[C@@H]2[C@@H]3[C@H]1C[C@H](C2)C3 1585264
O=C1O[BH-]2[NH+](C1)CC(=O)O2 1585613
O=C1OCc2c1cccc2 1585949
O=C1OC[C@H]2[C@H]1CCC=C2 1586294
O=C1OC[C@@H]2[C@@H]1CCC=C2 1586641
O=C1OCC2=C1CCCC2 1586978
O=C1O*OC(=O)CNC1 1587315
O=C1N[C@H]2CC[C@@H]1C(=O)N2 1587663
O=C1N[C@@H]2[C@H](N1)NC(=O)N2 1588013
O=C1N[C@@H]2[C@@](C1)(C)OC2=O 1588363
O=C1NCc2c1cccc2 1588699
O=C1NC[C@@H]2[C@H]1CCCC2 1589044
O=C1NCNC(=O)C1(C)C 1589383
O=C1NCCn2c1ccc2 1589719
O=C1NCCc2c1cc[nH]2 1590058
O=C1NCCc2c1[nH]nc2 1590397
O=C1NCC(=O)N(CN1)C 1590736
O=C1NC=[NH+]C(=O)C1(C)C 1591080
O=C1NC=NC21CCCC2 1591417
O=C1NC=C2C1=CNC2=O 1591756
O=C1NC(=O)c2c1scc2 1592095
O=C1NC(=O)c2c1csc2 1592435
O=C1NC(=O)[C@@H]2[C@H]1CNC2 1592784
O=C1NC(=O)C(=N)C(=O)N1 1593127
O=C1NC(=O)C(=C)C(=O)N1 1593470
O=C1N=Cc2c1cccc2 1593807
O=C1Cc2c(O1)cccc2 1594145
O=C1Cc2c(N1)cccc2 1594483
O=C1C[C@H]2C([C@@H]1CC2)(C)C 1594832
O=C1C[C@@H]2N1CC(S2)(C)C 1595177
O=C1C[C@@H]2CCC[C@H](C1)N2 1595525
O=C1C[C@@H]2C([C@H]1CC2)(C)C 1595874
O=C1COc2c1cccc2 1596210
O=C1CNc2c1cccc2 1596546
O=C1CN=C2N1C=CNC2 1596884
O=C1CN2[PH2](O1)OC(=O)C2 1597229
O=C1CCc2c1cccc2 1597566
O=C1CC[C@@]2(C[C@H]1CC2)O 1597912
O=C1CC[C@@H]2[C@@H](C1)CCN2 1598260
O=C1CCN2N1C=CCC2 1598597
O=C1CCCc2c1cc[nH]2 1598936
O=C1CCC[C@H]2N1CCO2 1599276
O=C1CCC[C@H]2N1CCC2 1599616
O=C1CCC[C@@H]2N1CCO2 1599957
O=C1CCC[C@@H]2N1CCC2 1600298
O=C1CCCCCCCN1 1600632
O=C1CCCCCCC1=C 1600967
O=C1CCCC2=C1CCO2 1601304
O=C1CCC2=C1OCCC2 1601641
O=C1CC2(N1)CCCCC2 1601979
O=C1CC(=O)OC(O1)(C)C 1602320
O=C1CC(=O)N(C(=O)N1)C 1602662
O=C1C=c2c(=N1)cccc2 1603002
O=C1C=Nc2c1cccc2 1603339
O=C1C=Cc2c1cccc2 1603676
O=C1C=CN2[C@@H](C1)CCC2 1604020
O=C1C=CCc2c1cno2 1604357
O=C1C=CC2(O1)CCCC2 1604696
O=C1C2CCN(C1=C)CC2 1605035
O1[SiH-]2(O[SiH-]31NC=[NH+]3)NC=[NH+]2 1605394
O1CCc2c(C1)cccc2 1605733
O1CCc2[n+]([BH2-]1)cccc2 1606078
O/N=C/1\NCC[C@@H]([C@H]1O)O 1606426
Nc1noc2c1cccc2 1606761
Nc1nn2c(c1)nccc2 1607098
Nc1ncnc2n1ncn2 1607433
Nc1ncnc2c1nc[nH]2 1607771
Nc1ncnc2c1cn[nH]2 1608109
Nc1ncnc2c1cc[nH]2 1608447
Nc1ncnc2c1[nH]nc2 1608785
Nc1ncnc2c1[nH]cn2 1609123
Nc1ncnc2c1[nH]cc2 1609461
Nc1ncnc2c1[nH]c[nH+]2 1609803
Nc1ncnc2c1[nH+]c[nH]2 1610145
Nc1nccn2c1cnc2 1610480
Nc1nccc2c1nc[nH]2 1610818
Nc1nccc2c1ccs2 1611153
Nc1ncc2c(n1)scc2 1611491
Nc1ncc2c(n1)nc[nH]2 1611832
Nc1ncc2c(n1)[nH]cc2 1612172
Nc1ncc2c(n1)CNC2 1612509
Nc1nc[nH]c2-c1ncn2 1612848
Nc1nc2c(s1)cccc2 1613185
Nc1nc2c([nH]1)cccc2 1613526
Nc1nc2[nH]ncc2cn1 1613864
Nc1nc2[nH]cnc2cn1 1614202
Nc1n[nH]c2c1cccc2 1614540
Nc1csc2c1cccn2 1614875
Nc1coc2c1cccc2 1615211
Nc1ccc2c(c1)OCO2 1615548
Nc1cc2c(s1)CCCC2 1615885
Nc1cc(=O)n(c(=O)[nH]1)C 1616230
Nc1[nH]nc2c1cccc2 1616568
Nc1[nH+]cnc2c1nc[nH]2 1616910
Nc1[nH+]cc2c(n1)[nH]cc2 1617254
N[C@H]1C[C@@H](N)[C@@H]([C@H](C1)O)O 1617611
N[C@H]1C=C[C@H]([C@@H]([C@H]1O)O)O 1617966
NC1Cc2c(C1)cccc2 1618303
NC1=NC(=NC(N1)(C)C)N 1618644
N=c1sc2c([nH]1)cccc2 1618985
N=c1[nH]cnc2c1nn[nH]2 1619328
N=c1[nH]c2c([nH]1)cccc2 1619672
N=CC#Cc1ccccc1 1620007
N=C1[C@@H]2CCC[C@H]1CNC2 1620352
N=C1NCc2c1cccc2 1620688
N=C1CCc2c1cccc2 1621024
N=C1C=Nc2c1cccc2 1621361
N=C1C=Cc2c1cccc2 1621698
N1C[C@H]2[C@]3(C1)C=C[C@H](C2)O3 1622051
N1CCc2c(C1)cccc2 1622388
N1CCC2(CC1)OCCO2 1622725
N1C=Cc2[n+]([BH2-]1)cccc2 1623071
N#Cc1nccnc1C#N 1623406
N#Cc1ncc(nc1)C#N 1623743
N#Cc1cncc(c1)C#N 1624080
N#Cc1cnc(nc1N)N 1624416
N#Cc1ccccc1C#N 1624751
N#Cc1cccc(c1*)C 1625087
N#Cc1cccc(c1)C#N 1625424
N#Cc1cc(F)cc(c1)F 1625762
N#Cc1cc(C)cc(c1)C 1626100
N#Cc1c[nH]c(=O)[nH]c1=O 1626444
N#CC1=CNC=C(C1)C#N 1626783
N#CC1=C(C)NC(=O)NC1 1627123
N#CC1(C#N)CCC=CC1 1627461
N#CC(=C1NCCN1)C#N 1627799
N#CC(=C1C=C[CH+]S1)C#N 1628142
N#C/C=C/1\C=CC(=O)C=C1 1628486
Ic1scc2c1OCCO2 1628821
Ic1cccc2c1nn[nH]2 1629161
Ic1ccc2c(c1)cco2 1629499
Ic1ccc2c(c1)cc[nH]2 1629840
Ic1ccc2c(c1)OCO2 1630178
Ic1cc2c([nH]1)cccc2 1630519
Ic1cc(I)c(c(c1)I)N 1630859
I[C@H]1CC(=O)N2[C@H]1CCC2 1631208
Fc1nc(F)c(cc1F)F 1631546
Fc1cnc2c(c1)cc[nH]2 1631886
Fc1cccn2c1nnc2 1632221
Fc1cccc2c1cn[nH]2 1632559
Fc1cccc2c1cc[nH]2 1632897
Fc1ccc2c(c1)scn2 1633234
Fc1ccc2c(c1)onc2 1633572
Fc1ccc2c(c1)nc[nH]2 1633912
Fc1ccc2c(c1)cco2 1634249
Fc1ccc2c(c1)cc[nH]2 1634589
Fc1ccc2c(c1)[nH]cn2 1634929
Fc1ccc2c(c1)[nH]cc2 1635269
Fc1cc(F)c(cc1F)F 1635606
Fc1cc(F)c(c(c1)F)F 1635945
Fc1cc(F)c(c(c1)Br)F 1636285
Fc1c(F)ccc(c1F)F 1636623
F[C@@H]1C[C@H](F)[C@@H](C[C@@H]1F)F 1636979
Cn1nnc2c1cccc2 1637314
Cn1ncc2c1ncnc2 1637649
Cn1ncc2c1cccc2 1637984
Cn1cnc2c1ncnc2 1638319
Cn1cnc2c1cccc2 1638654
Cn1ccc2c1nccc2 1638989
Cn1ccc2c1cncn2 1639324
Cn1ccc2c1cccc2 1639659
Cn1ccc(=O)n(c1=O)C 1639998
Cn1cc2c(n1)cccc2 1640335
Cn1c[nH+]c2c1cccc2 1640674
Cn1c(N)cc(=O)[nH]c1=O 1641016
Cn1c(=O)n(C)cnc1=O 1641355
Cn1c(=O)c(C)c[nH]c1=O 1641697
Clc1ncnc2c1nc[nH]2 1642036
Clc1nc2c([nH]1)cccc2 1642378
Clc1nc2[nH]cnc2cn1 1642718
Clc1nc(Cl)c(cc1Cl)Cl 1643060
Clc1n[nH]c2c1cccc2 1643403
Clc1cccc2c1ncs2 1643740
Clc1cccc2c1OCO2 1644078
Clc1ccc2c(c1)scn2 1644417
Clc1ccc2c(c1)nsn2 1644757
Clc1ccc2c(c1)ncs2 1645097
Clc1ccc2c(c1)nc[nH]2 1645440
Clc1ccc2c(c1)cco2 1645779
Clc1ccc2c(c1)cc[nH]2 1646121
Clc1ccc2c(c1)[nH]cn2 1646463
Clc1ccc2c(c1)[nH]cc2 1646805
Clc1ccc2c(c1)OCO2 1647144
Clc1cc(Cl)c(cc1O)Cl 1647485
Clc1cc(Cl)c(cc1Cl)Cl 1647829
Clc1c[nH]c2c1cncn2 1648172
Clc1c(Cl)ccc(c1Cl)Cl 1648514
Cl[SiH]1Nc2c(N1)cccc2 1648860
Cl[BH-]1Oc2c(O1)cccc2 1649204
ClP1(=N[PH2]=NP(=N1)(Cl)Cl)Cl 1649555
ClC1C(C)(C)C(=O)C1(C)C 1649905
ClC1=CC(=C)C(=O)C(=C1)Cl 1650251
Cc1nnc2n1nccc2 1650588
Cc1nn(c2c1csn2)C 1650925
Cc1ncnc2c1nc[nH]2 1651264
Cc1nc2c(s1)cccc2 1651601
Cc1nc2c([nH]1)ccnc2 1651942
Cc1nc2c([nH]1)cccc2 1652282
Cc1n[nH]c2c1cncc2 1652620
Cc1n[nH]c2c1cccn2 1652958
Cc1n[nH]c2c1cccc2 1653296
Cc1csc2c1ncnc2 1653631
Cc1csc2c1cccc2 1653967
Cc1csc2c1c(C)cs2 1654305
Cc1coc2c1cccc2 1654642
Cc1coc(=O)c(c1O)C 1654980
Cc1cncc2c1CCC2 1655315
Cc1cnc2n(c1)ncc2 1655652
Cc1cn(C)c(=O)[nH]c1=O 1655994
Cc1ccnc2c1CCC2 1656329
Cc1ccn2c1cncn2 1656664
Cc1ccn2c(n1)ncn2 1657001
Cc1cccn2c1ncc2 1657336
Cc1cccc2c1ncs2 1657671
Cc1cccc2c1nco2 1658007
Cc1cccc2c1nc[nH]2 1658345
Cc1cccc2c1cc[nH]2 1658683
Cc1cccc2c1[nH]nc2 1659021
Cc1cccc2c1[nH]cn2 1659359
Cc1cccc2c1[nH]cc2 1659697
Cc1cccc2c1COC2 1660032
Cc1ccc[n+]2c1[n-]cc2 1660373
Cc1ccc2n(n1)cnn2 1660710
Cc1ccc2n(n1)cnc2 1661047
Cc1ccc2c(n1)scc2 1661384
Cc1ccc2c(n1)[nH]cn2 1661725
Cc1ccc2c(c1)scn2 1662062
Cc1ccc2c(c1)nc[nH]2 1662403
Cc1ccc2c(c1)cn[nH]2 1662743
Cc1ccc2c(c1)ccs2 1663080
Cc1ccc2c(c1)cco2 1663418
Cc1ccc2c(c1)cc[nH]2 1663758
Cc1ccc2c(c1)[nH]nc2 1664098
Cc1ccc2c(c1)[nH]cn2 1664438
Cc1ccc2c(c1)[nH]cc2 1664778
Cc1ccc2c(c1)CCN2 1665115
Cc1ccc(c(c1*)O)* 1665452
Cc1ccc(c(=O)[nH]1)C#N 1665794
Cc1cc2c(s1)cccc2 1666131
Cc1cc2c(o1)cccc2 1666469
Cc1cc2c([nH]1)nccc2 1666809
Cc1cc2c([nH]1)cccc2 1667149
Cc1cc(N)c(cn1)C#N 1667487
Cc1cc(C)ncc1C#N 1667823
Cc1cc(C)c(cc1C)C 1668160
Cc1cc(C)c(c(c1)O)C 1668499
Cc1c[nH]c2c1cccc2 1668837
Cc1c(C)ccc(c1C)C 1669174
Cc1[nH]nc2c1cccc2 1669512
Cc1[nH]c2c([nH+]1)cccc2 1669856
Cc1[n-]c2[n+](c1)cccc2 1670199
Cc1[n-][n+]2c(c1)nccc2 1670542
C[n+]1csc2c1cccc2 1670880
C[n+]1cc2n(c1)cccc2 1671221
C[n+]1c[nH]c2c1cccc2 1671562
C[Si]1(C)CNC[Si](O1)(C)C 1671907
C[N@@H+]1[C@H]2CCC[C@@H]1[C@@H]1[C@H]2O1 1672270
C[N+]1=Cc2c([BH2-]1)cccc2 1672616
C[N+]1(C)[C@@H]2CCC[C@H]1CC2 1672965
C[C@H]1OCC[C@]([C@@H]1O)(C)O 1673314
C[C@H]1Cc2c(N1)cccc2 1673655
C[C@H]1CC[C@@H]2C[C@H]1C2(C)C 1674005
C[C@H]1CC(=O)N(C(=N1)N)C 1674350
C[C@@]12CC[C@@H](C1)C(C2)(C)C 1674700
C[C@@H]1O[C@H]2[C@@H](O1)CCCO2 1675051
C[C@@H]1OCC[C@@]([C@H]1O)(C)O 1675401
C[C@@H]1N=C(N)OCC1(F)F 1675744
C[C@@H]1Cc2c(N1)cccc2 1676086
C[C@@H]1C[C@H](O)[C@H]([C@H](O1)O)O 1676442
C[C@@H]1COC(=O)[C@@H]([C@@H]1O)C 1676795
C[C@@H]1CC[C@H]2C[C@@H]1C2(C)C 1677146
C[C@@H]1CCCc2c1c[nH]n2 1677489
C[C@@H]1CC(C)(C)C=CC1=O 1677833
C[C@@H]1C=Cc2c1cccc2 1678174
C[C@@H]1C(=C(C(=C1C)C)C)C 1678520
CN1[C@@H]2CCC[C@H]1CCC2 1678864
CN1O[C@H]2CO[C@@H](C1)[C@H]2O 1679214
CN1CCc2c1cccc2 1679549
CN1CCc2c(C1)scn2 1679886
CN1CC(=O)N(CC1=O)C 1680226
CN1CC(=C)C(=O)C(=C)C1 1680568
CC=C1C(=O)CCCC1=O 1680906
CC1Cc2c(C1)cccc2 1681243
CC1CN(C)CCN(C1)C 1681580
CC1=Cc2c(C1)cccc2 1681918
CC1=C[C@@H]2CC[C@](C1)(N2)C 1682266
CC1=CN2[C@H](SC1)CC2=O 1682609
CC1=CCn2c(N1)nnn2 1682948
CC1=CCc2c1cccc2 1683284
CC1=CCC(=C(O1)N)C#N 1683624
CC1=CC([NH+]=C(N1)[S-])(C)C 1683972
CC1=CC(C)(C)CCC1=O 1684312
CC1=C(CCC(=O)N1)C#N 1684652
CC1=C(C)C(=O)C=CC1=O 1684993
CC1(C)[N+](=O)C=NC1(C)C 1685337
CC1(C)[C@@H]2CC[C@@]1(C)CC2 1685685
CC1(C)O[C@H]2[C@@H](O1)CCO2 1686033
CC1(C)O[C@H]2C[C@@H]1CCC2 1686379
CC1(C)O[C@@H]2[C@H](O1)COC2 1686727
CC1(C)O[C@@H]2[C@H](O1)CNC2 1687075
CC1(C)O[C@@H]2[C@H](O1)CCO2 1687423
CC1(C)O[C@@H]2[C@H](O1)CCC2 1687771
CC1(C)OCC(CO1)(C)C 1688110
CC1(C)NCc2c1[nH]nc2 1688450
CC1(C)COP(=O)(OC1)[O-] 1688793
CC1(C)CCCC([NH2+]1)(C)C 1689138
CC1(C)CCCC(N1)(C)C 1689477
CC1(C)CCC([N+]1=O)(C)C 1689820
CC1(C)C=CC([N+]1=O)(C)C 1690164
CC(=C1[C@@H]2[C@H]3[C@@H]2[C@H]2[C@@H]1[C@@H]32)C 1690534
CC(=C1[C@@H]2C=C[C@H]1C=C2)C 1690883
C=c1sc2n(c1=O)ncn2 1691222
C=c1[nH]c(=O)c(=C)[nH]c1=O 1691570
C=[P-]1(=O)OCC(CO1)(C)C 1691914
C=CC#Cc1ccccc1 1692250
C=C1[C@@H]2CCC[C@H]1CCC2 1692595
C=C1OCc2c1cccc2 1692931
C=C1N=Cc2c1cccc2 1693268
C=C1N2CC[C@@H]([C@H]1O)CC2 1693615
C=C1N2CC[C@@H]([C@@H]1O)CC2 1693963
C=C1C[C@@H](O)C(=C)[C@@H](C1)O 1694314
C=C1CNc2c1cccc2 1694650
C=C1CCc2c1cccc2 1694986
C=C1CCN2N1C(=O)CC2 1695325
C=C1CCC[C@H]2[C@H]1CCC2 1695669
C=C1C=Cc2c1cccc2 1696006
C=C1C=C[C@@H]2[C@H]1CC=CN2 1696353
C=C1C=CC(=[N+](C)C)C=C1 1696697
C=C1C=C(Cl)C(=O)C(=C1)Cl 1697042
C=C1C=C(C)C(=O)C(=C1)C 1697387
C1[C@@H]2C[C@@H]3C[C@H]1O[C@H](O2)O3 1697744
C1[C@@H]2C[C@@H]3C[C@H]1C[C@H](C2)C3 1698101
C1[C@@H]2CN3CN1CN(C2)C3 1698445
C1[BH-]2C[C@@H]3C[C@H]1C[C@H](C2)C3 1698801
C1O[C@H]2OC[C@H]3C[C@@H]1C[C@@H]23 1699156
C1OC(=O)O[C@H]2[C@@H]1OCC2 1699503
C1NCc2c(O1)cccc2 1699840
C1NCc2c(N1)cccc2 1700177
C1NCc2c(C1)ncnc2 1700514
C1NCc2c(C1)cncn2 1700851
C1N2CN3CN1C[N@H+](C2)C3 1701195
C1N2CN3CN1CP(C2)C3 1701534
C1C[C@@H]2[O+]3[C@H]1CC[C@@H]3CC2 1701889
C1C[C@@H]2C=C3[C@@H]2C[C@@H]1CN3 1702242
C1COc2c(O1)cccc2 1702579
C1CO[C@H]2[C@H](C1)OCOC2 1702924
C1CON2[C@@H](C1)CCCO2 1703266
C1CNc2c(S1)cccc2 1703603
C1CNc2c(O1)cccc2 1703941
C1CNc2c(N1)cccc2 1704278
C1CNC2=NCCCN2C1 1704614
C1CCc2c(O1)cccc2 1704951
C1CCc2c(N1)cccc2 1705288
C1CCc2c(C1)nccc2 1705625
C1CCc2c(C1)cccc2 1705962
C1CC[N+]2=C(N1)NCCC2 1706303
C1CC[C@H]2[C@H](C1)NCCC2 1706648
C1CC[C@H]2[C@H](C1)CNCC2 1706993
C1CC[C@@H]2[C@H](C1)CNCC2 1707339
C1CC[C@@H]2[C@@H](C1)CNCC2 1707686
C1CC[C@@H]2[C@@H](C1)CCCC2 1708033
C1CCN2C(=[NH+]CCC2)N1 1708375
C1CCC2(NC1)CCCC2 1708712
C1CCC2(CC1)OCCO2 1709049
C1CCC2(CC1)CCCN2 1709386
C1CC(=O)Oc2c1scn2 1709724
C1=Nc2c(NC1)cccc2 1710063
C1=Nc2c(CO1)cccc2 1710401
C1=Nc2c(CN1)cccc2 1710739
C1=Cc2c(SC1)cccc2 1711077
C1=Cc2c(OC1)cccc2 1711416
C1=Cc2c(NC1)cccc2 1711754
C1=Cc2c(CO1)cccc2 1712092
C1=Cc2c(CN1)cccc2 1712430
C1=Cc2c(CC1)cccc2 1712768
C1=CS/C(=C\2/SC=CS2)/S1 1713112
C1=CS/C(=C\2/NC=CN2)/[CH-]1 1713464
C1=CCc2c(O1)cccc2 1713803
C1=CCc2c(C1)cccc2 1714141
C1=CC=[B-]2[N+](=C1)C=CC=C2 1714489
C#Cc1cccc(c1)C#C 1714826
C#Cc1ccc(cc1)C#C 1715163
C#Cc1c[nH]c(=O)[nH]c1=O 1715507
C#CC#Cc1ccccc1 1715842
Brc1scc2c1OCCO2 1716178
Brc1n[nH]c2c1cccc2 1716519
Brc1cncc2c1nsn2 1716856
Brc1cccc2c1ccs2 1717194
Brc1cccc2c1cc[nH]2 1717535
Brc1cccc2c1OCO2 1717872
Brc1ccc2c(c1)scn2 1718211
Brc1ccc2c(c1)cco2 1718551
Brc1ccc2c(c1)cc[nH]2 1718893
Brc1ccc2c(c1)[nH]cc2 1719235
Brc1ccc2c(c1)OCO2 1719574
Brc1ccc2c(c1)CCO2 1719913
Brc1ccc2c(c1)CCN2 1720252
Brc1cc2nc[nH]c2nc1 1720592
Brc1cc(F)c(c(c1)F)F 1720933
Brc1cc(Br)c(cc1Br)Br 1721275
Brc1cc(Br)c(c(c1)Br)O 1721621
Brc1c[nH]c2c1cccc2 1721963
Brc1c(Br)ccc(c1Br)Br 1722305
Br[B-]1=[NH+]c2c(N1)cccc2 1722655
BrC1=CC(=O)C(=CC1=O)Br 1722999
BrC1=CC(=C)C(=O)C(=C1)Br 1723346
*c1csc2c1cccc2 1723683
*c1cnn2c1nccc2 1724019
*c1cnc2c(c1)cc[nH]2 1724359
*c1cccc2c1[nH]cc2 1724697
*c1cccc2c1OCO2 1725032
*c1ccc2n(c1)cnn2 1725369
*c1ccc2c(n1)nc[nH]2 1725709
*c1ccc2c(c1)scn2 1726046
*c1ccc2c(c1)scc2 1726384
*c1ccc2c(c1)ncs2 1726722
*c1ccc2c(c1)nco2 1727060
*c1ccc2c(c1)nc[nH]2 1727400
*c1ccc2c(c1)ccs2 1727737
*c1ccc2c(c1)cco2 1728075
*c1ccc2c(c1)cc[nH]2 1728415
*c1ccc2c(c1)[nH]cn2 1728755
*c1ccc2c(c1)[nH]cc2 1729095
*c1ccc2c(c1)OCO2 1729432
*c1cc2nc[nH]c2nc1 1729770
*c1cc2[nH]cnc2nc1 1730108
*c1cc(O)c(cc1*)* 1730445
*c1c[nH]c2c1cncn2 1730783
*c1c[nH]c2c1cccc2 1731121
n1cnn2c(n1)nnc2 1731457
n1cnn2c(c1)ccc2 1731761
n1ccn2c(c1)ncc2 1732065
n1ccn2c(c1)cnc2 1732369
c1ncn2c(c1)ncc2 1732673
c1ncc2c(n1)scn2 1732977
c1ncc2c(n1)scc2 1733282
c1ncc2c(n1)occ2 1733587
c1ncc2c(n1)nc[nH]2 1733894
c1ncc2c(n1)n[nH]c2 1734201
c1ncc2c(n1)cn[nH]2 1734508
c1ncc2c(n1)ccs2 1734812
c1ncc2c(n1)cc[nH]2 1735120
c1ncc2c(n1)[nH]nc2 1735427
c1ncc2c(n1)[nH]cn2 1735734
c1ncc2c(n1)[nH]cc2 1736041
c1ncc2c(n1)[nH]c[nH+]2 1736352
c1ncc2c(c1)scc2 1736656
c1ncc2c(c1)occ2 1736961
c1ncc2c(c1)nsn2 1737265
c1ncc2c(c1)ncs2 1737570
c1ncc2c(c1)nc[nH]2 1737878
c1ncc2c(c1)cn[nH]2 1738185
c1ncc2c(c1)ccs2 1738489
c1ncc2c(c1)cco2 1738794
c1ncc2c(c1)cc[nH]2 1739101
c1ncc2c(c1)[nH]nc2 1739408
c1ncc2c(c1)[nH]cn2 1739715
c1ncc2c(c1)[nH]cc2 1740022
c1ncc2c(c1)CCC2 1740326
c1nc[n+]2c(n1)cc[n-]2 1740636
c1nc2c([nH]1)[nH+]cnc2 1740947
c1cnn2c(c1)nnc2 1741251
c1cnn2c(c1)ncc2 1741555
c1cnn2c(c1)ccc2 1741859
c1cnc2n(n1)cnn2 1742163
c1cnc2c(n1)csc2 1742467
c1cnc2c(n1)[nH]nn2 1742775
c1cnc2c(n1)[nH]cc2 1743082
c1cnc2c(c1)scn2 1743386
c1cnc2c(c1)scc2 1743691
c1cnc2c(c1)nn[nH]2 1743999
c1cnc2c(c1)ncs2 1744303
c1cnc2c(c1)nc[nH]2 1744611
c1cnc2c(c1)cn[nH]2 1744918
c1cnc2c(c1)ccs2 1745222
c1cnc2c(c1)cco2 1745527
c1cnc2c(c1)cc[nH]2 1745834
c1cnc2c(c1)c[nH]n2 1746141
c1cnc2c(c1)[nH]cn2 1746448
c1cnc2c(c1)[nH]cc2 1746755
c1cnc2c(c1)CCC2 1747059
c1ccn2c(n1)ncn2 1747363
c1ccn2c(n1)ncc2 1747667
c1ccn2c(n1)ccn2 1747971
c1ccc2n(c1)ncn2 1748275
c1ccc2n(c1)ncc2 1748579
c1ccc2n(c1)cnn2 1748883
c1ccc2n(c1)cnc2 1749187
c1ccc2n(c1)ccn2 1749491
c1ccc2n(c1)ccc2 1749795
c1ccc2n(c1)cc[nH+]2 1750103
c1ccc2n(c1)c[nH+]c2 1750411
c1ccc2c(c1)snn2 1750715
c1ccc2c(c1)snc2 1751020
c1ccc2c(c1)scn2 1751325
c1ccc2c(c1)scc2 1751630
c1ccc2c(c1)pco2 1751935
c1ccc2c(c1)onc2 1752240
c1ccc2c(c1)ocn2 1752544
c1ccc2c(c1)occ2 1752848
c1ccc2c(c1)nsn2 1753152
c1ccc2c(c1)non2 1753457
c1ccc2c(c1)noc2 1753761
c1ccc2c(c1)n[se]n2 1754068
c1ccc2c(c1)n[nH]n2 1754376
c1ccc2c(c1)n[nH]c2 1754683
c1ccc2c(c1)coc2 1754987
c1ccc2c(c1)cc[n-]2 1755294
c1ccc2c(c1)cc[cH-]2 1755602
c1ccc2c(c1)c[nH]c2 1755909
c1ccc2c(c1)[nH]nn2 1756216
c1ccc2c(c1)[nH]nc2 1756523
c1ccc2c(c1)[nH]cp2 1756830
c1ccc2c(c1)[nH]cn2 1757138
c1ccc2c(c1)[nH]cc2 1757445
c1ccc2c(c1)[nH+]cs2 1757753
c1ccc2c(c1)[nH+]c[se]2 1758065
c1ccc2c(c1)[nH+]c[nH]2 1758377
c1ccc2c(c1)[nH+][c-][nH]2 1758691
c1ccc2c(c1)[cH+]o[n-]2 1759002
c1ccc2c(c1)[SiH2]OC2 1759311
c1ccc2c(c1)[SiH2]CC2 1759621
c1ccc2c(c1)[PH2+]O[BH2-]2 1759936
c1ccc2c(c1)[NH+]=[BH-]N2 1760250
c1ccc2c(c1)[CH-]O[BH2-]2 1760563
c1ccc2c(c1)SCN2 1760867
c1ccc2c(c1)OCN2 1761172
c1ccc2c(c1)OCC2 1761476
c1ccc2c(c1)NCC2 1761780
c1ccc2c(c1)N=CC2 1762085
c1ccc2c(c1)C[NH+]=[BH-]2 1762398
c1ccc2c(c1)C=[NH+][BH2-]2 1762712
c1ccc2c(c1)C=CC2 1763017
c1ccc2[n+](c1)snc2 1763324
c1ccc2[n+](c1)n[n-]c2 1763635
c1ccc2[n+](c1)cc[nH]2 1763945
c1ccc2[n+](c1)cc[n-]2 1764255
c1ccc2[n+](c1)cc[cH-]2 1764566
c1ccc2[n+](c1)c[n-]c2 1764876
c1ccc2[n+](c1)c[cH-]c2 1765187
c1ccc2[n+](c1)[n-]nc2 1765497
c1ccc2[n+](c1)[n-]cc2 1765807
c1ccc2[n+](c1)[cH-]cc2 1766118
c1ccc2=C[CH-][PH2]=c2c1 1766430
c1cc[n+]2c(n1)nc[n-]2 1766741
c1cc[n+]2c(n1)cc[n-]2 1767051
c1cc[n+]2c(n1)[n-]cc2 1767361
c1cc2c([nH]1)[nH+]ccc2 1767672
c1c[nH+]c2c(c1)O[BH2-]O2 1767985
c1[nH]c2c(n1)[nH+]cnc2 1768296
c1[nH+]cc2c(c1)O[BH2-]O2 1768609
[cH-]1cc2c(c1)cccc2 1768917
[c-]1[c-][c-]c2c([c-]1)[nH][c-][c-]2 1769242
[SiH3]C#Cc1ccccc1 1769548
[SiH2]1Nc2c(N1)cccc2 1769858
[O-]c1ccc[n+](c1C)C 1770167
[O-]c1cc[nH+]c(c1O)C 1770476
[O-]c1cc(C)cc(c1)C 1770783
[O-]c1cc(=O)[nH]c(=S)[nH]1 1771098
[O-]c1cc(=O)[nH]c(=O)[nH]1 1771414
[O-][C@@]12CCCC[C@H]2CC1 1771727
[O-]N=[N+]1CCC(=O)CC1 1772037
[O-]C1=CC(=O)C(=[NH2+])C=C1 1772353
[NH2+]1CCNCCNCC1 1772658
[BH3-][N@+]12CC[C@H](CC1)CC2 1772975
[BH3-]C#Cc1ccccc1 1773281
[BH2-]1Oc2c(O1)cccc2 1773590
S=c1sc2c(s1)c[nH]c2 1773898
S=C1NC(=O)C(N1)(C)C 1774209
P1Sc2c(S1)cccc2 1774514
On1ccc(=O)c(c1)O 1774822
Oc1cccccc1=O 1775123
Oc1ccc(c(c1)O)Cl 1775428
Oc1ccc(c(c1)O)C 1775733
Oc1ccc(c(c1)O)Br 1776038
Oc1ccc(c(c1)O)* 1776343
Oc1ccc(c(c1)C)O 1776647
Oc1ccc(c(c1)C)C 1776951
Oc1ccc(c(c1)C)Br 1777256
Oc1ccc(c(c1)*)O 1777561
Oc1cc[nH+]c(c1O)C 1777867
Oc1cc(O)cc(c1)O 1778171
Oc1cc(C)oc(=O)c1 1778476
Oc1cc(=O)[nH]c(=O)[nH]1 1778788
Oc1c(O)cccc1O 1779090
O[C@]12CCC[C@@H]2CCC1 1779400
O[C@H]1[C@H](O)COC[C@@H]1F 1779715
O[C@H]1[C@H](O)CCO[C@H]1C 1780029
O[C@H]1[C@H](O)CCO[C@@H]1C 1780344
O[C@H]1[C@@H](O)CCO[C@H]1O 1780659
O[C@H]1[C@@H](O)CCO[C@@H]1C 1780975
O[C@H]1OC[C@H]([C@@H](C1)O)O 1781292
O[C@H]1OC[C@@H]([C@H](C1)O)O 1781609
O[C@H]1OC[C@@H]([C@@H](C1)O)O 1781927
O[C@H]1OCC[N+](C1)(C)C 1782238
O[C@H]1C[C@H](O)CC(=C)C1 1782551
O[C@H]1C[C@@H](C)O[C@H](C1)O 1782868
O[C@H]1CO[C@H]2[C@@H]1CCC2 1783183
O[C@H]1CO[C@H]([C@@H](C1)O)O 1783500
O[C@H]1CO[C@H]([C@@H](C1)O)C 1783817
O[C@H]1CO[C@@H]([C@H](C1)O)C 1784134
O[C@H]1CO[C@@H]([C@@H](C1)O)C 1784452
O[C@H]1COC[C@](C1)(C)O 1784763
O[C@H]1CC[C@H]2O[C@@H]1CO2 1785078
O[C@H]1CC[C@H]([C@@H](C1)O)O 1785395
O[C@H]1CC[C@@H]([C@H](C1)O)O 1785712
O[C@H]1CCC(=C)C(=C)C1 1786022
O[C@H]1C=C[C@H]([C@@H](C1)O)O 1786340
O[C@@H]1[C@H](O)C[NH2+]C[C@H]1O 1786660
O[C@@H]1[C@H](O)CSC[C@H]1O 1786975
O[C@@H]1[C@H](O)COC[C@H]1O 1787291
O[C@@H]1[C@H](O)COC[C@@H]1O 1787607
O[C@@H]1[C@H](O)CNC[C@H]1O 1787922
O[C@@H]1[C@H](O)CCO[C@@H]1C 1788238
O[C@@H]1[C@@H]([OH2+])COC[C@H]1[OH2+] 1788564
O[C@@H]1[C@@H](O)C[NH2+]C[C@H]1O 1788885
O[C@@H]1[C@@H](O)COC[C@H]1S 1789201
O[C@@H]1[C@@H](O)COC[C@H]1O 1789518
O[C@@H]1[C@@H](O)COC[C@H]1F 1789834
O[C@@H]1[C@@H](O)COC[C@@H]1O 1790151
O[C@@H]1[C@@H](O)CNC[C@H]1O 1790467
O[C@@H]1[C@@H](O)CNC[C@@H]1O 1790784
O[C@@H]1[C@@H](O)CCO[C@H]1O 1791100
O[C@@H]1[C@@H](O)CCO[C@H]1C 1791416
O[C@@H]1[C@@H](O)CCO[C@@H]1O 1791733
O[C@@H]1[C@@H](O)CCC[C@H]1O 1792049
O[C@@H]1[C@@H](O)CCC[C@@H]1O 1792366
O[C@@H]1[C@@H](O)CC=C[C@H]1O 1792683
O[C@@H]1[C@@H](N)COC[C@H]1O 1792999
O[C@@H]1[C@@H](C)CCO[C@H]1C 1793315
O[C@@H]1[C@@H](C)CCC[C@H]1O 1793631
O[C@@H]1OC[C@H]([C@@H](C1)O)O 1793949
O[C@@H]1OC[C@@H]([C@H](C1)O)O 1794267
O[C@@H]1OC[C@@H]([C@@H](C1)O)O 1794586
O[C@@H]1C[C@H]([NH3+])C[C@@H](C1)[NH3+] 1794914
O[C@@H]1CO[C@H]2[C@@H]1OCC2 1795230
O[C@@H]1CO[C@H]([C@@H](C1)O)O 1795548
O[C@@H]1CO[C@H]([C@@H](C1)O)C 1795866
O[C@@H]1CO[C@@H]([C@H](C1)O)O 1796184
O[C@@H]1CO[C@@H]([C@@H](C1)O)O 1796503
O[C@@H]1COC[C@@H]([C@H]1[NH3+])O 1796824
O[C@@H]1COC[C@@H]([C@H]1O)[NH3+] 1797145
O[C@@H]1COC[C@@H]([C@H]1N)O 1797461
O[C@@H]1COC[C@@H]([C@H]1F)O 1797777
O[C@@H]1COCOC[C@H]1O 1798086
O[C@@H]1CNNC(=O)NC1 1798394
O[C@@H]1CC[C@H]([C@H](C1)O)O 1798711
O[C@@H]1CC[C@@H]([C@H](C1)O)O 1799029
O[C@@H]1CCNCC1(C)C 1799336
O[C@@H]1CCC(OC1)(C)C 1799645
OCC#Cc1cccs1 1799946
OC1CCS(=O)(=O)CC1 1800253
OC1CCCCCCC1 1800554
OC1C(O)COCC1O 1800856
OC1=C[C+](C(=C)C=C1)O 1801166
OC1=CC(=O)C(=C)C=C1 1801474
O=c1occcc1C#N 1801776
O=c1cc[nH]c(c1O)C 1802082
O=c1cc[nH]c(=O)n1C 1802389
O=c1c(cnc[nH]1)C#N 1802696
O=c1c(ccc[nH]1)C#N 1803003
O=c1[nH]c(=O)[nH]c(=O)[nH]1 1803319
O=[P@]12OC[C@H](CO1)CO2 1803631
O=S1(=O)NCCCCO1 1803936
O=C1[C@H](O)CCO[C@@H]1C 1804249
O=C1O[C@H]2[C@@H](C1)OCC2 1804563
O=C1O[C@@H]2[C@H](C1)OCC2 1804877
O=C1O[C@@H]2C[C@H]1CCC2 1805189
O=C1O[C@@H]([C@](N1)(C)O)C 1805504
O=C1OC[C@H]2[C@@H]1COC2 1805816
O=C1OC[C@@H]2[C@H]1OCO2 1806128
O=C1OC[C@@H]2[C@H]1COC2 1806440
O=C1OC(N[C@H]1C)(C)C 1806749
O=C1OC(=O)C(=C)C1=C 1807057
O=C1N[C@@H]2[C@H](O1)C=CC2 1807372
O=C1N[C@@H]2[C@H](N1)CSC2 1807686
O=C1NC[C@]21CCCN2 1807993
O=C1NCN2[C@H]1CCC2 1808300
O=C1NCCC(O1)(C)C 1808605
O=C1NCC(CO1)(C)C 1808910
O=C1NC2C(N1)CSC2 1809215
O=C1NC(NC1=O)(Cl)Cl 1809524
O=C1C[C@H]2[C@@H](O1)OCC2 1809840
O=C1C[C@@H]2CC[C@H](C1)N2 1810154
O=C1CO[C@H]([C@@H](O1)C)C 1810468
O=C1CO[C@@H]([C@H](O1)C)C 1810782
O=C1COC(=O)[C@H](O1)C 1811092
O=C1COC(=O)[C@@H](O1)C 1811403
O=C1CNC(CN1)(C)C 1811708
O=C1CNC(=O)[C@@H](N1)C 1812019
O=C1CNC(=O)C(=O)N1 1812326
O=C1CNC(=O)C(=C)N1 1812633
O=C1CC[C@H]2N1CCO2 1812940
O=C1CC[C@H]2N1CCC2 1813247
O=C1CC[C@@H]2N1COC2 1813555
O=C1CC[C@@H]2N1CCC2 1813863
O=C1CCNC[C@]1(C)Cl 1814170
O=C1CCNCC1(C)C 1814474
O=C1CCC[C@](C1)(C)O 1814782
O=C1CCCC(C1)(C)C 1815087
O=C1CCCC(=O)C1C 1815391
O=C1CCC(C=C1)(C)C 1815697
O=C1CC(C[C@@H]1C)(C)C 1816007
O=C1CC(=O)NC(=S)N1 1816314
O=C1CC(=O)NC(=O)N1 1816622
O=C1C=C[C@](C=C1)(C)O 1816932
O=C1C=COC(O1)(C)C 1817238
O=C1C=COC(C1)(C)C 1817544
O=C1C=CCC(C1)(C)C 1817850
O=C1C=CC(=[NH2+])C(=C1)[O-] 1818166
O=C1C=CC(=O)C(=C1)C 1818474
O=C1C=CC(=N)C(=C1)O 1818782
O=C1C=C2C(=CCC2)C1 1819089
O=C1C(=CC=CC1=C)O 1819395
O1[N-]c2c([N-]1)cccc2 1819705
O1Cc2c(C1)cccc2 1820009
O1CCn2c(C1)n[nH+]c2 1820317
O1CCn2c(C1)cnn2 1820621
O/C=C\1/C(=O)CNC1=O 1820929
O/C=C\1/C(=NNC1=O)C 1821237
Nn1c(=O)cn[nH]c1=S 1821544
Nc1ncn(c(=O)c1)C 1821850
Nc1nc(N)[nH]c(=O)c1 1822158
Nc1nc(=O)[nH]cc1I 1822464
Nc1nc(=O)[nH]cc1F 1822771
Nc1ccc(c(c1)C)C 1823075
Nc1cc(=O)[nH]c(=O)[nH]1 1823387
Nc1c[nH]c(=O)[nH]c1=O 1823697
N[Si@H]1NC(=CC(=C)N1)C 1824008
N[C@H]1CCO[C@H]([C@H]1O)C 1824323
N[C@@H]1[C@@H](O)CCO[C@@H]1O 1824640
N[C@@H]1C[C@H](N)C[C@@H](C1)O 1824958
N[C@@H]1C[C@@H]([C@@H]([C@@H]1O)O)O 1825282
N[C@@H]1CC[C@H]([C@@H](C1)N)O 1825600
NC#Cc1ccccc1 1825901
N=c1cccc[cH-]c1=N 1826207
N=C1SC(=C)C(=O)N1C 1826514
N=C1OC[C@H]([C@@H](C1)O)O 1826829
N=C1NCCC(=O)NC1 1827133
N=C1CC[C@@H]2O[C@H]1OC2 1827445
N=C1C=CC(=O)C(=C1)N 1827753
N1Cc2c(C1)cccc2 1828057
N1C[C@@H]2CNC[C@H](C1)C2 1828370
N1CCn2c(C1)nnc2 1828674
N1CCn2c(C1)ncc2 1828978
N1CCNCCNCC1 1829278
N1CCN2[C@@H](C1)CCC2 1829587
N#Cc1cncnc1N 1829888
N#Cc1cnccc1N 1830189
N#Cc1cnccc1C 1830490
N#Cc1cccnc1N 1830791
N#Cc1ccccc1O 1831092
N#Cc1ccccc1N 1831393
N#Cc1ccccc1F 1831694
N#Cc1ccccc1Cl 1831996
N#Cc1ccccc1C 1832298
N#Cc1ccccc1Br 1832600
N#Cc1ccccc1* 1832902
N#Cc1cccc(c1)F 1833205
N#Cc1cccc(c1)Cl 1833509
N#Cc1cccc(c1)C 1833813
N#Cc1cccc(c1)* 1834116
N#Cc1ccc(nc1)C 1834419
N#Cc1ccc(cc1)O 1834722
N#Cc1ccc(cc1)F 1835025
N#Cc1[nH]cnc1C#N 1835330
N#CC=C1CCNCC1 1835632
N#CC1=C(N)OC=CC1 1835937
N#CC1=C(N)NC=CC1 1836242
N#CC1(OCOC1)C#N 1836546
N#CC1(OCNC1)C#N 1836850
N#CC1(OCC=C1)C#N 1837155
N#CC1(CCCC1)C#N 1837459
N#CC1(CCC=C1)C#N 1837764
N#CC1(C#N)CNCC1 1838068
Ic1cccc(c1O)I 1838370
Ic1ccc(c(c1)I)O 1838676
Ic1cc(I)cc(c1)I 1838982
Ic1c[nH]c(=O)[nH]c1=O 1839295
IC#Cc1ccccc1 1839597
Fc1cccc(c1O)F 1839900
Fc1cccc(c1Br)F 1840203
Fc1ccc(c(c1)F)O 1840508
Fc1ccc(c(c1)F)F 1840812
Fc1ccc(c(c1)*)F 1841116
Fc1cc(F)cc(c1)F 1841420
Fc1cc(F)cc(c1)Br 1841725
Fc1c[nH]c(=O)[nH]c1=O 1842036
Fc1c(O)cccc1F 1842338
Fc1c(F)cccc1F 1842640
Fc1[c-]cc(c(c1)F)F 1842947
F[C@@H]1[C@H](O)CCO[C@@H]1F 1843263
F[C@@H]1[C@@H](O)CCO[C@@H]1O 1843580
F[B-]1(F)OC=CC(=C)O1 1843889
FC1(F)CNCC1(F)F 1844193
FC1(F)C=CC([C-2]1)(F)F 1844504
Cn1cncc(c1=O)O 1844807
Cn1cccc(c1=O)O 1845110
Cn1ccc2c1ccs2 1845412
Cn1ccc(=O)[nH]c1=O 1845720
Cn1c[n+](c(c1C)C)C 1846027
Cn1c(ccc1C)C#N 1846330
Cn1c(N)nccc1=O 1846633
Cn1[nH]c(=O)c(c1C)[NH3+] 1846946
Clc1cccc(c1O)Cl 1847250
Clc1cccc(c1N)Cl 1847556
Clc1ccc(c(c1)[NH3+])Cl 1847869
Clc1ccc(c(c1)N)Cl 1848177
Clc1ccc(c(c1)Cl)O 1848485
Clc1ccc(c(c1)Cl)F 1848793
Clc1ccc(c(c1)Cl)Cl 1849102
Clc1ccc(c(c1)Cl)C 1849411
Clc1ccc(c(c1)Br)O 1849719
Clc1cc(Cl)cc(c1)Cl 1850028
Clc1c[nH]c(=O)[nH]c1=O 1850342
Clc1c(Cl)cccc1Cl 1850648
Cl[Si@H]1NC(=CC(=C)N1)C 1850963
ClC1=CC(=C)[C+](C=C1)O 1851276
ClC1=CC(=C)C(=O)C=C1 1851586
Cc1occ(c(=O)c1)O 1851892
Cc1csc2n1ccn2 1852194
Cc1cnc(c(c1)C)O 1852499
Cc1cn2c(n1)scc2 1852803
Cc1ccn(c(=O)c1)O 1853109
Cc1cccc(c1O)C 1853411
Cc1cccc(c1N)C 1853713
Cc1cccc(c1Cl)C 1854016
Cc1cccc(c1Br)C 1854320
Cc1cccc(c1*)C 1854623
Cc1ccc(c(c1)O)O 1854927
Cc1ccc(c(c1)O)C 1855231
Cc1ccc(c(c1)C)[O-] 1855538
Cc1ccc(c(c1)C)O 1855842
Cc1ccc(c(c1)C)N 1856146
Cc1ccc(c(c1)C)Cl 1856451
Cc1ccc(c(c1)C)C 1856756
Cc1ccc(c(c1)Br)O 1857061
Cc1cc(O)cc(c1)O 1857366
Cc1cc(N)nc(n1)N 1857670
Cc1cc(C)cc(c1)[OH2+] 1857979
Cc1cc(C)cc(c1)O 1858283
Cc1cc(C)cc(c1)N 1858587
Cc1cc(C)cc(c1)I 1858891
Cc1cc(C)cc(c1)Cl 1859197
Cc1cc(C)cc(c1)C 1859502
Cc1cc(C)cc(c1)Br 1859807
Cc1cc(C)c[n+](c1)C 1860115
Cc1cc(C)[nH]c(=O)n1 1860423
Cc1cc(C)[nH]c(=N)n1 1860731
Cc1cc(C)[nH+]c(=O)[nH]1 1861043
Cc1cc(Br)cc(c1)Br 1861349
Cc1cc(=O)[nH]c(=O)[nH]1 1861663
Cc1c[nH]c(=O)nc1N 1861969
Cc1c[nH]c(=O)[nH]c1=O 1862279
Cc1c(N)cccc1Cl 1862582
Cc1[nH]c(c(c1C)C)C 1862890
Cc1[nH]c(C)cc(=O)c1 1863198
Cc1[cH-]c(c(c1C)C)C 1863506
C[c-]1cc(c(c1C)C)C 1863813
C[N@@H+]1[C@H]2CCC[C@@H]1CC2 1864130
C[N+]1=CO[Si-](C1)(C)(C)F 1864444
C[C@]12CO[C@H](OC1)OC2 1864756
C[C@H]1[C@@H](F)COC(=N1)N 1865070
C[C@H]1OC[C@H]([C@H](C1)O)O 1865386
C[C@H]1OC[C@@H]([C@H](C1)O)O 1865703
C[C@H]1COC[C@@H]([C@H]1O)C 1866018
C[C@H]1CNC(=O)NC1=O 1866326
C[C@H]1CCCC(C1)(C)C 1866634
C[C@H]1CC(=O)NC(=S)N1 1866944
C[C@H]1C=CN2[C@H]1CC2=O 1867257
C[C@H]1C=C(C(=C1C)C)C 1867567
C[C@@H]1[C@@H]2[C@H]1CC(C2)(C)C 1867887
C[C@@H]1SC(=O)C(=C1O)C 1868198
C[C@@H]1O[C@@H]([C@@H]([C@H]1O)O)O 1868522
C[C@@H]1OCC[C@@](C1)(C)O 1868835
C[C@@H]1C[C@H](C)C[C@@H](C1)C 1869153
C[C@@H]1COC[C@@H](C1=O)C 1869466
C[C@@H]1CNC[C@@H](C1=O)C 1869779
C[C@@H]1CCCC(C1)(C)C 1870088
C[C@@H]1CCC(N1[O-])(C)C 1870400
CN1[N-]C=NN(C1=O)C 1870707
CN1[C@@H]2CCC[C@H]1CC2 1871018
CN1NCN[N+](=C1[S-])C 1871327
CN1NCNN(C1=O)C 1871631
CN1NC(=O)OC[C@@H]1C 1871939
CN1CN(C)CN(C1)C 1872243
CN1CCCCCC1=O 1872544
CN1CCC(=N)[C@@H](C1)C 1872854
CN1CC(=O)N(C1=O)C 1873160
CN1C(=O)C[NH2+]C1(C)C 1873470
CC1OCC(CO1)(C)C 1873774
CC1COC(OC1)(C)C 1874078
CC1=NC(=C)C(=O)N1C 1874385
CC1=CCCC(C1)(C)C 1874690
CC1=CC(CCC1)(C)C 1874995
CC1=CC(=C)C(=O)C=C1 1875303
CC1=C(O)C(=C)C=CN1 1875610
CC1=C(C)C(=C(C1)C)C 1875918
CC1(C)[NH+]=CC(C1)(C)C 1876229
CC1(C)[C@H]2CC=C[C@@H]1C2 1876543
CC1(C)[C@@H]2CC[C@H]1CC2 1876856
CC1(C)[C@@H]2CCC[C@H]1C2 1877169
CC1(C)O[BH2-]OC1(C)C 1877478
CC1(C)OCC(N1)(C)C 1877784
CC1(C)OBOC1(C)C 1878088
CC1(C)NCNC1(C)C 1878392
CC1(C)NCC(C1)(C)C 1878698
CC1(C)CO[C@@H]2[C@H]1OO2 1879011
CC1(C)COP(=[Se])OC1 1879319
CC1(C)COP(=S)OC1 1879626
CC1(C)COP(=O)OC1 1879933
CC1(C)CN[C@@H]2[C@H]1OO2 1880247
CC1(C)CNP(=O)NC1 1880552
CC#Cc1cccnc1 1880854
CC#Cc1ccccc1 1881155
CC#C[C@H]1CNCCN1 1881460
CC#CN1CCOC1=O 1881762
C=C1[C@@H]2CC[C@H](C1=C)C2 1882077
C=C1O[C@H]2N(C1)C(=O)C2 1882389
C=C1C[NH2+]CC(=C)C1=O 1882699
C=C1C[C@H]2N[C@@H]1CCC2 1883011
C=C1C[C@@]2(N[C@H]1CC2)C 1883324
C=C1CNCC(=C)C1=O 1883629
C=C1CCCC(=C)C1=O 1883934
C1[NH2+]Cc2c(C1)scc2 1884243
C1[C@H]2SCC=CN2C1=O 1884552
C1[C@@H]2C[C@@H]3C[C@H]1C[C@@H]3C2 1884876
C1S/C(=C/C#N)/NC1=O 1885184
C1Oc2c(O1)cccc2 1885489
C1OCc2c(N1)[nH]nc2 1885796
C1OC[C@@H]2[C@H](O1)CCO2 1886109
C1Nc2c(N1)cccc2 1886413
C1NCc2c(C1)scc2 1886717
C1NCc2c(C1)ncs2 1887022
C1NCc2c(C1)n[nH]c2 1887330
C1NCc2c(C1)ccs2 1887634
C1NCc2c(C1)[nH]nc2 1887942
C1NCC[NH2+]CC[NH2+]C1 1888252
C1NC(=O)c2c1cn[nH]2 1888560
C1Cc2c(N1)ncnc2 1888864
C1Cc2c(N1)nccc2 1889168
C1Cc2c(C1)cccc2 1889472
C1C[NH2+][C@H]2[C@@H](C1)CNC2 1889790
C1C[C@H]2C[C@@H]1[C@H]1[C@@H]2C=C1 1890113
C1C[C@@H]2[C@@H](C1)CC=CC2 1890428
C1C[C@@H]2CNC[C@H](C1)C2 1890741
C1C[C@@H]2CCC[C@H](C1)[BH2-]2 1891059
C1C[C@@H]2CCC[C@H](C1)P2 1891372
C1C[C@@H]2CCC[C@H](C1)C2 1891686
C1C[C@@H]2CCC[C@H](C1)B2 1891999
C1C[C@@H]2C3([C@H]1C=C2)CC3 1892315
C1CSc2c(S1)csc2 1892619
C1CSc2c(S1)[se+]c[se]2 1892933
C1COc2c(O1)csc2 1893241
C1CO[C@H]2[C@@H](C1)OCC2 1893555
C1CO[C@H]2[C@@H](C1)C=CC2 1893869
C1CO[C@@H]2[C@H](C1)CCO2 1894182
C1COC2(C1)CCCO2 1894486
C1CNc2n1c(=S)sn2 1894791
C1CN2C(=[NH+]CCC2)C1 1895102
C1CCn2c(N1)nnn2 1895406
C1CCn2c(N1)ccn2 1895710
C1CCc2n(C1)cnc2 1896014
C1CCc2c(C1)scc2 1896318
C1CCc2c(C1)occ2 1896623
C1CCc2c(C1)n[nH]c2 1896930
C1CCc2c(C1)coc2 1897234
C1CCc2c(C1)c[pH]c2 1897541
C1CCc2c(C1)[se]nn2 1897849
C1CCc2c(C1)[nH]nc2 1898157
C1CCc2c(C1)[nH]cn2 1898464
C1CCc2c(C1)[nH]cc2 1898771
C1CC[C@H]2[N@H+](C1)CCC2 1899084
C1CC[C@H]2[C@H](C1)[NH+]=CN2 1899401
C1CC[C@H]2[C@H](C1)NCN2 1899713
C1CC[C@H]2[C@H](C1)NCC2 1900025
C1CC[C@H]2N(C1)CCC2 1900333
C1CC[C@@H]2[C@H](C1)NCC2 1900646
C1CC[C@@H]2[C@@H](C1)[NH+]=CN2 1900965
C1CC[C@@H]2[C@@H](C1)NCN2 1901279
C1CC[C@@H]2N(C1)CCC2 1901588
C1CCC2(C1)OCCO2 1901892
C1CCC2(C1)CCCN2 1902196
C1CCC2(C1)CCCC2 1902500
C1CC=C2N(C1)CCN2 1902805
C1C=Nn2c(S1)nnc2 1903110
C1=CSc2c(S1)nsc2 1903416
C1=CCn2c(N1)nnn2 1903724
C1=CCn2c(N1)ncn2 1904029
C1=CC=[B-]2[N+](=C1)C=CN2 1904343
C/C=C/1\C(=NNC1=O)C 1904651
Brc1cccccc1=O 1904953
Brc1cccc(c1[O-])Br 1905261
Brc1cccc(c1O)Br 1905567
Brc1cccc(c1N)Br 1905873
Brc1ccc(c(c1)Br)[O-] 1906184
Brc1ccc(c(c1)Br)O 1906492
Brc1ccc(c(c1)Br)N 1906800
Brc1cc(Br)cc(c1)Br 1907109
Brc1c[nH]c(=O)[nH]c1=O 1907423
BrC1CCCCCCC1 1907725
BrC1=CC(=C)C(=O)C=C1 1908035
*c1ccnn(c1=O)C 1908339
*c1cccc(c1O)* 1908641
*c1cccc(c1N)* 1908943
*c1ccc(c(c1)*)O 1909247
*c1ccc(c(c1)*)F 1909551
*c1ccc(c(c1)*)* 1909855
*c1cc2c(s1)[nH]cc2 1910162
*c1cc(F)cc(c1)F 1910467
*c1cc(*)cc(c1)C 1910771
*c1cc(*)cc(c1)* 1911075
*c1c[nH]c(=O)nc1N 1911381
*c1c[nH]c(=O)[nH]c1=O 1911691
s1[n-]cns[n-]s[n-]1 1911999
n1cc2c([nH]1)cn[nH]2 1912279
c1sc2c(c1)[nH]nc2 1912553
c1nn2c(s1)nnc2 1912825
c1nccnc1C#N 1913094
c1nc2n(c1)ccs2 1913365
c1nc2c(s1)ncs2 1913637
c1cn2c(n1)scn2 1913910
c1cn2c(c1)C=[NH+][BH2-]2 1914192
c1ccc2c(c1)CC2 1914463
c1cc2c(s1)scc2 1914734
c1cc2c(s1)ccs2 1915007
c1cc2c(s1)cc[nH]2 1915283
c1cc2c(o1)ccs2 1915555
c1cc2c([nH]1)cc[nH]2 1915833
c1c[n+]2c([n-]1)scn2 1916110
c1[n-][n+]2c(n1)scc2 1916388
[n-]1c[n+]2c(n1)scn2 1916666
[SiH3]C#C/C=C/C#C[SiH3] 1916947
[SiH2]=C1C=CC(=[SiH2])C=C1 1917232
[SiH2]1O[SiH2]O[SiH2]O[SiH2]O1 1917521
[S@@H]12*3[S@@H]4*2[S@@H]2*1[S@H]3*42 1917819
[S-]C1=[NH+]CC[C@@H](N1)O 1918105
[O-]c1ccccc1[O-] 1918379
[O-]c1ccccc1O 1918649
[O-]c1cccc(c1)O 1918921
[O-]c1ccc(cc1)C 1919193
[O-]c1cc[nH+]cc1O 1919467
[O-]c1[nH]c[nH+]c(=O)c1 1919747
[O-][n+]1cccc(c1)C 1920022
[O-][N+]1=CC(CC1)(C)C 1920300
[O-]P1(=O)OCCCO1 1920573
[O-]/C=C\1/C(=O)ON=[NH+]1 1920856
[N-]1SN=C[N-]SN=C1 1921131
[C@@H]12[C@@H]3[C@@H]4[C@H]2[C@@H]2[C@H]1[C@H]3[C@H]42 1921444
[C-]#[N+]c1ccccc1 1921718
[C-3]c1[c-]c[c-]c(c1)[C-3] 1922001
[C-3]c1[c-][c-][c-]c(c1)[C-3] 1922287
S=c1nc[nH]c(c1)C 1922560
S=c1n(C)ccn1C 1922831
S=c1ccocc1O 1923100
S=c1ccccn1O 1923369
S=C1NCC=C(N1)C 1923641
S=C1NC(=O)[C@H](N1)C 1923919
S=C1NC(=O)C(=C)S1 1924194
S=C1NC(=O)C(=C)N1 1924470
Oc1ncncc1O 1924738
Oc1ncccc1O 1925005
Oc1nc[nH]c(=O)c1 1925278
Oc1cnc[nH]c1=O 1925549
Oc1ccoc(=O)c1 1925819
Oc1cccnc1C 1926086
Oc1ccccc1[NH3+] 1926358
Oc1ccccc1O 1926625
Oc1ccccc1I 1926892
Oc1ccccc1F 1927160
Oc1ccccc1Cl 1927428
Oc1ccccc1Br 1927697
Oc1cccc(c1)O 1927967
Oc1cccc(c1)F 1928236
Oc1cccc(c1)Cl 1928506
Oc1cccc(c1)Br 1928777
Oc1ccc[nH+]c1C 1929049
Oc1ccc(cc1)[NH3+] 1929323
Oc1ccc(cc1)O 1929592
Oc1ccc(cc1)I 1929861
Oc1ccc(cc1)F 1930131
Oc1ccc(cc1)Cl 1930401
Oc1ccc(cc1)Br 1930672
Oc1cc[nH]c(=O)c1 1930946
Oc1cc(=O)[nH]nc1 1931219
O[C@H]1[C@H](O)CO[C@H]1O 1931500
O[C@H]1[C@H](O)CO[C@@H]1O 1931782
O[C@H]1[C@@H](O)CO[C@H]1O 1932064
O[C@H]1[C@@H](O)CO[C@@H]1O 1932347
O[C@H]1OCCC[C@H]1O 1932622
O[C@H]1NC(=O)NC=C1 1932897
O[C@H]1NC(=O)C(=C)N1 1933174
O[C@H]1C[C@H]2C[C@@H]1CC2 1933456
O[C@H]1CO[C@@H]([C@H]1O)C 1933738
O[C@H]1COC[C@@H](C1)O 1934016
O[C@H]1COCC[C@H]1O 1934291
O[C@H]1COCC[C@@H]1O 1934567
O[C@H]1CN[C@H]([C@H]1O)C 1934848
O[C@H]1CC[C@H](CO1)O 1935125
O[C@H]1CC[C@@H](CO1)O 1935403
O[C@H]1CCO[C@H](C1)O 1935680
O[C@H]1CCO[C@H](C1)C 1935957
O[C@H]1CCO[C@@H](C1)O 1936235
O[C@H]1CCO[C@@H](C1)C 1936513
O[C@H]1CCNC(=O)N1 1936787
O[C@H]1CCCO[C@H]1C 1937062
O[C@H]1CCCO[C@@H]1C 1937338
O[C@H]1CCCC[C@@H]1O 1937614
O[C@H]1CCCC[C@@H]1F 1937890
O[C@H]1CCCC(=O)C1 1938164
O[C@H]1CC=CC[C@@H]1O 1938441
O[C@H]1C=COC[C@@H]1O 1938718
O[C@H]1C(=O)NC1(C)C 1938994
O[C@@H]1[C@H](O)CO[C@H]1O 1939276
O[C@@H]1[C@H](O)CO[C@@H]1O 1939559
O[C@@H]1[C@H](O)COC1=O 1939838
O[C@@H]1[C@@H]2CO[C@H]1CO2 1940121
O[C@@H]1[C@@H](O)CO[C@H]1O 1940404
O[C@@H]1[C@@H](O)CO[C@@H]1O 1940688
O[C@@H]1[C@@H](O)CC[C@H]1O 1940971
O[C@@H]1C[NH2+]CC[C@H]1O 1941252
O[C@@H]1C[NH2+]CC[C@@H]1O 1941534
O[C@@H]1COC[C@]1(C)F 1941811
O[C@@H]1COC[C@H](C1)O 1942089
O[C@@H]1COC[C@@H](C1)O 1942368
O[C@@H]1COCC[C@H]1O 1942644
O[C@@H]1COCC[C@H]1F 1942920
O[C@@H]1COCC[C@@H]1O 1943197
O[C@@H]1COCC[C@@H]1F 1943474
O[C@@H]1COCC1(F)F 1943748
O[C@@H]1CNCC[C@H]1O 1944024
O[C@@H]1CNCC[C@@H]1O 1944301
O[C@@H]1CC[S@](=O)CC1 1944579
O[C@@H]1CC[O+]=C[C@@H]1F 1944861
O[C@@H]1CC[N+](C1)(C)C 1945140
O[C@@H]1CC[C@H](CC1)O 1945418
O[C@@H]1CC[C@@H](CO1)O 1945697
O[C@@H]1CC[C@@H](CC1)O 1945976
O[C@@H]1CC[C@@H](C=C1)O 1946256
O[C@@H]1CCO[C@H](C1)O 1946534
O[C@@H]1CCO[C@@H](C1)O 1946813
O[C@@H]1CCO[C@@H](C1)C 1947092
O[C@@H]1CCOC[C@@H]1F 1947369
O[C@@H]1CCOC(=O)C1 1947644
O[C@@H]1CCNC(=O)N1 1947919
O[C@@H]1CCNC(=O)C1 1948194
O[C@@H]1CCC[C@H](C1)O 1948472
O[C@@H]1CCC[C@@H](C1)O 1948751
O[C@@H]1CCCO[C@H]1C 1949027
O[C@@H]1CCCO[C@@H]1C 1949304
O[C@@H]1CCCC[C@H]1O 1949580
O[C@@H]1CCCC[C@H]1F 1949856
O[C@@H]1CCCC[C@@H]1O 1950133
O[C@@H]1CCCCC1=O 1950406
O[C@@H]1CC=CC[C@H]1O 1950683
O[C@@H]1C=CC=C[C@@H]1O 1950962
O[C@@H]1C=CC(=O)C=C1 1951239
ON=C1CCNCC1 1951507
OCC#C[Si](C)(C)C 1951780
OCC#CC#CCO 1952048
OC1CCCCCC1 1952315
OC1=C[CH-]C(=C)C=C1 1952591
OC1=C[C+](CCC1)O 1952864
OC1=CC=CC(=[CH2-]1)O 1953141
OC1=CC(=O)OCC1 1953412
OC1=CC(=O)NCC1 1953683
OC1=CC(=O)CCC1 1953954
OC1=C(O)C(=O)OC1 1954227
O=c1nc[nH]c(c1)C 1954500
O=c1nc[nH]c(=O)[nH]1 1954777
O=c1cnncn1N 1955045
O=c1cn[nH]c(=O)[nH]1 1955322
O=c1ccocc1O 1955590
O=c1ccccn1O 1955858
O=c1ccccn1C 1956126
O=c1cccccc1 1956394
O=c1cc[nH]cc1O 1956665
O=c1cc[nH]c(=[Se])[nH]1 1956945
O=c1cc[nH]c(=[NH2+])[nH]1 1957228
O=c1cc[nH]c(=S)[nH]1 1957505
O=c1cc[nH]c(=O)[nH]1 1957783
O=c1[nH]n(c(c1)C)C 1958058
O=c1[nH]cnc(=[NH2+])[nH]1 1958340
O=c1[nH]cccc1O 1958611
O=c1[nH]cccc1Cl 1958883
O=c1[nH]cccc1C 1959155
O=c1[nH]ccc(=[NH2+])[nH]1 1959437
O=c1[nH]cc[nH]c1=O 1959712
O=c1[nH]c[nH+]c(c1)[O-] 1959992
O=c1[nH][nH]c(=O)n1C 1960269
O=[S@@]1[C@@H]2CC[C@H]1C=C2 1960553
O=S1(=O)NCCCO1 1960825
O=S1(=O)CCNCC1 1961097
O=S1(=O)CCCCN1 1961369
O=S1(=O)CCCCC1 1961641
O=S1(=O)C=CNC=C1 1961915
O=C1[C@@H]2COC[C@H]1C2 1962195
O=C1[C@@H]2CC[C@H]1C=C2 1962475
O=C1[C@@H](O)CCN1C 1962750
O=C1SC(=C)C(=O)N1 1963024
O=C1O[C@H]2[C@@H]1CCC2 1963304
O=C1O[C@@H]2[C@H]1CCC2 1963583
O=C1O[C@@H](C(=O)N1)C 1963861
O=C1ON=C(C1=N)C 1964133
O=C1ON=C(C1=C)C 1964405
O=C1OCCC[C@@H]1C 1964678
O=C1OCC(N1)(C)C 1964950
O=C1OCC(C1)(C)C 1965222
O=C1OCC(=O)OC1 1965493
O=C1N[C@H](C(=O)N1)C 1965770
O=C1N[C@@H](C(=O)N1)C 1966048
O=C1NNC(C1)(C)C 1966320
O=C1NN=C(C1=N)C 1966592
O=C1NN=C(C1=C)C 1966864
O=C1NCNC(=O)N1 1967135
O=C1NCCNCC1 1967403
O=C1NCCNC1=O 1967672
O=C1NCCC[C@H]1C 1967944
O=C1NCCC[C@@H]1N 1968217
O=C1NCCC[C@@H]1F 1968490
O=C1NCCC1(C)C 1968760
O=C1NCC=C(N1)C 1969031
O=C1NCC(O1)(C)C 1969303
O=C1NCC(=O)NC1 1969574
O=C1NC=NC(=O)C1 1969846
O=C1NC(=O)C(=O)N1 1970120
O=C1NC(=O)C(=C)N1 1970394
O=C1NC(=O)C(=C)C1 1970668
O=C1NC(=N)N(C1)C 1970941
O=C1NC(=C)C(=C1)C 1971215
O=C1N=CSC1(C)C 1971486
O=C1N=C(N(C1)C)N 1971760
O=C1C[NH+]=C(N1C)N 1972035
O=C1C[C@H](C(=O)N1)C 1972312
O=C1C[C@@H](C(=O)N1)N 1972590
O=C1C[C@@H](C(=O)N1)C 1972868
O=C1COCCN1C 1973136
O=C1CNS(=O)(=O)N1 1973410
O=C1CNCC(=O)N1 1973682
O=C1CNC(O1)(C)C 1973954
O=C1CN=C(N1C)N 1974225
O=C1CC[NH+]=C(N1)[S-] 1974503
O=C1CCS(=O)(=O)N1 1974778
O=C1CCOC1(C)C 1975049
O=C1CCNC[C@H]1C 1975321
O=C1CCNC[C@@H]1C 1975594
O=C1CCNC(=O)N1 1975865
O=C1CCC[C@H]2[C@@H]1C2 1976144
O=C1CCCCCO1 1976412
O=C1CCCCCN1 1976680
O=C1CCCCCC1 1976948
O=C1CCCC=C1C 1977217
O=C1CCCC(=O)N1 1977488
O=C1CCC=C(O1)C 1977759
O=C1CCC=C(N1)C 1978030
O=C1CCC(O1)(C)C 1978302
O=C1CC=CC(=O)N1 1978574
O=C1C=CS(=O)(=O)N1 1978849
O=C1C=COC1(C)C 1979121
O=C1C=CC=CC1=O 1979392
O=C1C=CC(O1)(C)C 1979665
O=C1C=CC(=O)C=C1 1979938
O=C1C=C([C@@H](S1)C)O 1980216
O=C1C(=O)C=CC1=O 1980490
O=C1C(=C)CCC1=C 1980762
O1NCC=CC=CB1 1981031
O1C[C@@H]2[C@H](C1)OCO2 1981311
O1C[C@@H]2[C@H](C1)COC2 1981591
O1COC[C@@H]2[C@H](C1)N2 1981871
O1CC[NH+]2[BH-]1OCC2 1982148
O/N=C/1\CCCC=C1 1982420
Nc1ocnc1C#N 1982688
Nc1ncnc(n1)N 1982957
Nc1ncnc(c1)N 1983226
Nc1nccc(=O)[nH]1 1983499
Nc1nc[nH]c(=O)c1 1983772
Nc1nc(=O)[nH]cn1 1984045
Nc1cscc1C#N 1984313
Nc1cnnc(n1)N 1984583
Nc1cnc[nH]c1=O 1984854
Nc1cn[nH+]c(n1)N 1985127
Nc1ccncc1Br 1985395
Nc1ccnc(n1)N 1985665
Nc1ccnc(n1)C 1985934
Nc1ccccc1[NH3+] 1986206
Nc1ccccc1O 1986473
Nc1ccccc1N 1986740
Nc1ccccc1I 1987007
Nc1ccccc1F 1987275
Nc1ccccc1Cl 1987543
Nc1ccccc1Br 1987812
Nc1cccc(n1)N 1988082
Nc1cccc(n1)F 1988351
Nc1cccc(c1)O 1988620
Nc1cccc(c1)N 1988889
Nc1cccc(c1)F 1989158
Nc1cccc(c1)Cl 1989428
Nc1cccc(=[NH2+])[nH]1 1989707
Nc1cccc(=N)[nH]1 1989980
Nc1ccc(cc1)O 1990249
Nc1ccc(cc1)I 1990518
Nc1ccc(cc1)Cl 1990789
Nc1ccc(cc1)Br 1991060
Nc1cc[nH]c(=[NH2+])n1 1991339
Nc1cc[nH]c(=O)n1 1991612
Nc1cc[nH+]c(n1)[O-] 1991888
Nc1cc[nH+]c(n1)N 1992161
Nc1cc[nH+]c(n1)C 1992434
Nc1cc(n[nH]1)C#N 1992707
Nc1c(cn[nH]1)C#N 1992980
N[C@H]1COC[C@H](C1)O 1993257
N[C@H]1COCC[C@@H]1O 1993533
N[C@H]1CCC[C@H](C1)O 1993810
N[C@@H]1CC[C@H](CC1)O 1994088
NC1=NC(=O)C(=C)S1 1994362
NC1=C(CCS1)C#N 1994634
N=c1cccccc1 1994903
N=c1[cH-]cc(cc1)N 1995177
N=C1NCCCCN1 1995445
N=C1NCC(=O)N1C 1995716
N=C1NC(=O)[C@@H](N1)C 1995994
N=C1NC(=O)C(=O)N1 1996268
N=C1NC(=O)C(=C)S1 1996542
N=C1C=CC(O1)(C)C 1996816
N=C1C=CC(=O)C=C1 1997089
N=C1C=CC(=N)C=C1 1997362
N1[BH-]=[NH+]C2=C1[NH+]=[BH-]N2 1997650
N1Cc2c(C1)c[nH]n2 1997924
N1C[C@H]2[C@@H](C1)CCN2 1998204
N1C[C@@H]2[C@H](C1)CON2 1998484
N1C[C@@H]2[C@H](C1)CCN2 1998764
N1CNCNCNC1 1999031
N1CC=C2[C@H](C1)CC2 1999307
N#[N+]c1ccccc1 1999578
N#Cc1ncccn1 1999846
N#Cc1csc(c1)C 2000116
N#Cc1cncnc1 2000385
N#Cc1ccncc1 2000653
N#Cc1cccnc1 2000921
N#Cc1cccn1C 2001189
N#Cc1ccccn1 2001457
N#Cc1ccccc1 2001725
N#Cc1cccc[nH+]1 2001997
N#Cc1cc[nH+]cc1 2002269
N#C[C@@H]1CNC(=O)C1 2002545
N#C[C@@H]1CCCC1=O 2002819
N#CC=C1NCCN1 2003088
N#CC=C(C#N)C#N 2003359
N#CC1CCNCC1 2003627
N#CC1CCCCC1 2003895
N#CC1=CO[H][O]=C1 2004169
N#C/N=C\1/NCCS1 2004441
Ic1cccc(c1)I 2004711
Ic1ccc(cc1)I 2004982
Ic1ccc(=N)[nH]c1 2005257
I[I-][n+]1ccccc1 2005531
Fc1cncnc1C 2005800
Fc1cncc(c1)F 2006069
Fc1ccccc1F 2006336
Fc1ccccc1Cl 2006604
Fc1ccccc1Br 2006873
Fc1cccc(c1)I 2007143
Fc1cccc(c1)F 2007413
Fc1cccc(c1)Cl 2007683
Fc1cccc(c1)Br 2007954
Fc1ccc(cc1)F 2008224
Fc1ccc(cc1)Cl 2008494
Fc1ccc(cc1)Br 2008765
F[C@H]1[C@H](O)CO[C@@H]1O 2009048
F[B-]1(F)OC=C[CH+]O1 2009325
F[B-]1(F)OC=CC=[NH+]1 2009603
F[B-]1(F)NN=CN=[NH+]1 2009881
F[B-]1(F)NC=CC=[NH+]1 2010159
FC1(F)CCNCC1 2010428
FC1(F)CCCNC1 2010697
FC1(F)CCCCC1 2010966
FC1(F)C=CC1(F)F 2011238
Cn1ncccc1=O 2011506
Cn1cncnc1=S 2011774
Cn1cnccc1=O 2012043
Cn1ccncc1=O 2012311
Cn1cccnc1=O 2012579
Cn1ccc(=O)cc1 2012849
Cn1c(C)n[nH]c1=S 2013122
Clc1ncnc(n1)Cl 2013394
Clc1ncnc(c1)Cl 2013667
Clc1ncccc1Cl 2013938
Clc1cncnc1C 2014208
Clc1cncc(c1)Cl 2014480
Clc1ccnc(n1)N 2014752
Clc1ccnc(n1)Cl 2015024
Clc1ccn[nH]c1=O 2015298
Clc1ccccc1[NH3+] 2015572
Clc1ccccc1I 2015841
Clc1ccccc1Cl 2016112
Clc1cccc(c1)I 2016384
Clc1cccc(c1)Cl 2016657
Clc1cccc(c1)Br 2016930
Clc1ccc(cn1)Cl 2017203
Clc1ccc(cn1)C 2017475
Clc1ccc(cn1)Br 2017747
Clc1ccc(cc1)Cl 2018020
Clc1ccc(cc1)Br 2018293
Cl[Si]1(Cl)N[Si](N1)(Cl)Cl 2018578
Cc1nncnc1C 2018851
Cc1ncnc(n1)N 2019120
Cc1ncnc(c1)C 2019389
Cc1nccnc1C 2019656
Cc1ncccc1C 2019923
Cc1nccc(=O)[nH]1 2020196
Cc1ncc(nc1)C 2020465
Cc1ncc([nH]1)C#N 2020738
Cc1nc[nH]c(=O)c1 2021011
Cc1nc[nH+]c(c1)C 2021284
Cc1cncnc1N 2021551
Cc1cncnc1Cl 2021819
Cc1cncnc1* 2022087
Cc1cnccc1C 2022354
Cc1cncc(c1)N 2022623
Cc1cncc(c1)C 2022892
Cc1cncc(c1)Br 2023162
Cc1cncc(=O)[nH]1 2023436
Cc1cnc(nc1)* 2023705
Cc1cnc(=O)[nH]c1 2023978
Cc1ccnc(n1)N 2024247
Cc1ccnc(c1)N 2024516
Cc1ccnc(c1)C 2024785
Cc1ccnc([nH+]1)N 2025058
Cc1ccccc1[NH3+] 2025330
Cc1ccccc1O 2025597
Cc1ccccc1N 2025864
Cc1ccccc1I 2026131
Cc1ccccc1F 2026399
Cc1ccccc1Cl 2026667
Cc1ccccc1C 2026935
Cc1ccccc1Br 2027203
Cc1cccc[n+]1[O-] 2027477
Cc1cccc(n1)N 2027746
Cc1cccc(n1)C 2028015
Cc1cccc(c1)[NH3+] 2028289
Cc1cccc(c1)O 2028558
Cc1cccc(c1)N 2028827
Cc1cccc(c1)I 2029096
Cc1cccc(c1)F 2029366
Cc1cccc(c1)Cl 2029636
Cc1cccc(c1)C 2029906
Cc1cccc(c1)Br 2030176
Cc1cccc([o+]1)C 2030449
Cc1cccc([nH+]1)C 2030722
Cc1cccc(=O)o1 2030992
Cc1cccc(=O)[nH]1 2031265
Cc1ccc(cn1)O 2031534
Cc1ccc(cn1)C 2031803
Cc1ccc(cc1)[NH3+] 2032077
Cc1ccc(cc1)O 2032346
Cc1ccc(cc1)N 2032615
Cc1ccc(cc1)F 2032884
Cc1ccc(cc1)Cl 2033154
Cc1ccc(cc1)C 2033424
Cc1ccc(cc1)Br 2033694
Cc1ccc(c[nH+]1)O 2033968
Cc1ccc(=O)[nH]n1 2034241
Cc1cc[nH]c(=O)c1 2034514
Cc1cc[nH]c(=N)c1 2034787
Cc1cc[nH+]c(c1)N 2035060
Cc1cc(n(n1)C)C 2035331
Cc1cc(C)c[nH+]c1 2035604
Cc1c[nH+]ccc1C 2035875
Cc1[nH]nc(c1C)C 2036147
Cc1[nH]nc(c1Br)C 2036420
Cc1[nH]c(c(n1)C)C 2036695
Cc1[nH][nH]c(=O)c1C 2036971
C[Si]1(C)N[Si](N1)(C)C 2037250
C[NH+]1CCCCCC1 2037523
C[N+]1=COCC1(C)C 2037796
C[N+]1(C)CCNCC1 2038068
C[N+]1(C)CCCCC1 2038340
C[C@]1(O)CC(=O)NC1 2038615
C[C@H]1[C@H](O)COC1=O 2038893
C[C@H]1[C@@H](O)CNC1=O 2039172
C[C@H]1[C@@H](C)COC1=O 2039451
C[C@H]1OCCO[C@@H]1C 2039727
C[C@H]1COC(O1)(C)C 2040002
C[C@H]1COC(=O)NN1 2040276
C[C@H]1CC[C@@H](CO1)O 2040554
C[C@H]1CC[C@@H](C1=O)C 2040833
C[C@H]1CCSC(=N1)N 2041107
C[C@H]1CCO[C@H](O1)C 2041385
C[C@H]1CCO[C@H](C1)C 2041662
C[C@H]1CCOC(=N1)N 2041936
C[C@H]1CCCC[C@H]1O 2042211
C[C@H]1CCCC1(C)C 2042484
C[C@H]1CCCC(=O)O1 2042758
C[C@H]1CCCC(=O)C1 2043032
C[C@H]1CCC(=O)C=C1 2043307
C[C@H]1CC(=O)C=CC1 2043582
C[C@@H]1[C@H](O)COC1=O 2043861
C[C@@H]1[C@H](O)CNC1=O 2044140
C[C@@H]1[C@@H](C)COC1=O 2044420
C[C@@H]1NC[C@H](NC1)C 2044698
C[C@@H]1N=CCOC1=O 2044972
C[C@@H]1C[C@@H]2C[C@H]1C=C2 2045256
C[C@@H]1COC(=O)C=C1 2045532
C[C@@H]1CNS(=O)(=O)O1 2045810
C[C@@H]1CNC[C@@H]([NH2+]1)C 2046095
C[C@@H]1CNC[C@@H](O1)C 2046374
C[C@@H]1CNC[C@@H](N1)C 2046653
C[C@@H]1CNC[C@@H](C1)C 2046932
C[C@@H]1CNC(=O)OC1 2047207
C[C@@H]1CC[C@H](CO1)O 2047485
C[C@@H]1CCO[C@H](C1)C 2047763
C[C@@H]1CCC[C@H](C1)O 2048041
C[C@@H]1CCC[C@@H](N1)C 2048320
C[C@@H]1CCC[C@@H](C1)O 2048599
C[C@@H]1CCCCC1=O 2048872
C[C@@H]1CCCC1(C)C 2049146
C[C@@H]1CCCC(=O)C1 2049421
C[C@@H]1CC=C[C@@H](C1)C 2049701
C[C@@H]1CC(=O)NN=C1 2049977
C[C@@H]1CC(=O)C=CC1 2050253
C[C-]1OBOC1(C)C 2050525
CN1[C@H](C)CNC1=O 2050799
CN1[C@@H](C)CO[P@H]1=O 2051078
CN1[C@@H](C)CNC1=O 2051354
CN1CCOC1(C)C 2051623
CN1CCNCCC1 2051890
CN1CCN(CC1)C 2052159
CN1CCN(C1=O)C 2052429
CN1CCN(C1=N)C 2052699
CN1CCC[N+](=C1)C 2052972
CN1CCCCC1=O 2053240
CN1CCC(=N)CC1 2053510
CN1CCC(=CC1)O 2053780
CN1C=NC(=C)C1=O 2054052
CN1C=CC(=C)C=C1 2054324
CN1C(=O)CSC1=O 2054595
CN1C(=O)CCC1=O 2054867
CN1C(=O)C=CC1=O 2055139
CCC#C[Si](C)(C)C 2055412
CC=C1CCCCC1 2055681
CC1CCC(=O)CC1 2055951
CC1C(=O)CCC1=O 2056222
CC1=[NH+][BH-]=[NH+]C(=C1)C 2056506
CC1=[NH+]C(=C)C(=C1)C 2056784
CC1=NNC(C1)(C)C 2057056
CC1=NNC(=NN1)C 2057327
CC1=NC(=C)C(=O)O1 2057601
CC1=NC(=C)C(=O)N1 2057875
CC1=CS/C(=C/O)/N1 2058149
CC1=CS(=O)(=O)C=C1 2058425
CC1=CC[NH+]=C(N1)[S-] 2058704
CC1=CCCC[C@H]1O 2058977
CC1=CCCC[C@@H]1O 2059250
CC1=CCC=C(N1)C 2059521
CC1=CC(=[O][H]O1)C 2059796
CC1=CC(=O)[C@@H](N1)C 2060074
CC1=CC(=O)CCC1 2060345
CC1=CC(=C)N[SiH2]N1 2060621
CC1=C(C)C[P@H](=[NH2+])C1 2060904
CC1=C(C)CC=CC1 2061176
CC1(O)COCOC1 2061445
CC1(O)CCNCC1 2061714
CC1(O)CCCCC1 2061983
CC1(C)[C@@H]2[C@H]1CNC2 2062263
CC1(C)OCCCO1 2062532
CC1(C)N=C[C@H]2N1C2 2062808
CC1(C)COCOC1 2063077
CC1(C)COBOC1 2063346
CC1(C)CNCNC1 2063615
CC1(C)CNCCS1 2063884
CC1(C)CCNCC1 2064154
CC1(C)CCNC=[NH+]1 2064428
CC1(C)CCCNO1 2064697
CC1(C)CCCNC1 2064966
CC1(C)CCCCO1 2065235
CC1(C)CCCCC1 2065504
CC1(C)CCC=CC1 2065774
C=c1oc(=N)c(=C)o1 2066048
C=c1cccc[n+]1=[BH2-] 2066325
C=c1ccc(=C)cc1 2066596
C=CC#C[Si](C)(C)C 2066870
C=C1SC(=C(S1)C)C 2067144
C=C1OCC(N1)(C)C 2067418
C=C1OC(=O)C(=C1)C 2067692
C=C1NC(=O)[C@@H](C1)C 2067970
C=C1NC(=O)C(=C1)C 2068244
C=C1CCCCC1=O 2068513
C=C1CCCCC1=C 2068782
C=C1CCCC=C1Cl 2069052
C=C1CCCC(=O)N1 2069324
C=C1CCC=C(C1)C 2069595
C=C1C=CC=C[C+]1O 2069868
C=C1C=CC=CC1=O 2070139
C=C1C=CC(=O)C=C1 2070412
C=C1C(=O)NNC1=O 2070684
C1[C@H]2SC=CN2C1=O 2070959
C1[C@@H]2[C@H]3[C@@H]2[C@H]2[C@@H]1[C@H]2C3 2071260
C1[C@@H]2[C@@H]3C[C@@H]4[C@H]1[C@H]2[C@H]34 2071560
C1OCCC=CCC1 2071828
C1N[C@@H]2[C@H](N1)NCN2 2072108
C1Cn2c(C1)n[nH+]c2 2072383
C1Cn2c(C1)ccc2 2072654
C1Cc2c(C1)csc2 2072925
C1Cc2c(C1)c[se]c2 2073200
C1C[n+]2n(C1)cnc2 2073475
C1C[n+]2c(C1)n[nH]c2 2073752
C1C[N@@H+]2CC[N@H+]1CC2 2074032
C1C[N@@H+]2CC[C@H]1CC2 2074311
C1C[N@@H+]2CCN1CC2 2074586
C1C[C@H]2[C@@H](C1)CCN2 2074866
C1C[C@H]2OO[C@@H]1C=C2 2075145
C1C[C@H]2OC[C@@H](O1)C2 2075425
C1C[C@H]2OC[C@@H](C1)O2 2075705
C1C[C@H]2OC[C@@H](C1)C2 2075985
C1C[C@H]2CC[C@@H]1[NH+]=[NH+]2 2076272
C1C[C@H]2CC[C@@H]1NN2 2076550
C1C[C@H]2CC[C@@H]1C=C2 2076829
C1C[C@@H]2[C@H](O1)OCC2 2077109
C1C[C@@H]2[C@H](O1)CCO2 2077389
C1C[C@@H]2[C@H](C1)CON2 2077669
C1C[C@@H]2[C@H](C1)CNC2 2077949
C1C[C@@H]2[C@H](C1)CCO2 2078229
C1C[C@@H]2[C@H](C1)CCC2 2078509
C1C[C@@H]2OC[C@H](C1)O2 2078789
C1C[C@@H]2CC[C@H]1CC2 2079067
C1C[C@@H]2CC[C@H](C1)[NH2+]2 2079352
C1C[C@@H]2CC[C@H](C1)O2 2079632
C1C[C@@H]2CC[C@H](C1)N2 2079912
C1CSc2n1ccn2 2080181
C1CN2[C@H](C1)CCC2 2080457
C1CN2CC[C@H]1CC2 2080730
C1CN2C(=NCC2)N1 2081002
C1CCCCCCC1 2081269
C1CCCC=CCC1 2081537
C1CC(=O)N[C@H]1C#N 2081812
C1C=COC=C1C#N 2082082
C1C=CNC=C1C#N 2082352
C1=C[C@H]2[C@@H](C1)C=CC2 2082634
C1=C[C@H]2C[C@@H]1[C@@H]1[C@H]2C1 2082924
C1=C[C@H]2C[C@@H](C1)C=C2 2083206
C1=CC=CC=CC=C1 2083477
C/C=C/1\CNC[C@@H]1C 2083753
C*[C@H]1COC[C@H]1O 2084028
C#Cc1ccccc1 2084296
C#Cc1cccc[nH+]1 2084568
Brc1cncc(c1)Br 2084839
Brc1ccccc1Br 2085110
Brc1cccc(n1)Br 2085383
Brc1cccc(c1)Br 2085656
Brc1ccc(cn1)O 2085928
Brc1ccc(cc1)I 2086199
Brc1ccc(cc1)Br 2086472
Brc1c[nH]nc1C#N 2086746
Brc1c[nH]c(c1Cl)Cl 2087022
Brc1[nH]nc(c1Br)Br 2087300
Brc1[nH]cc(c1Br)Br 2087578
Brc1[nH+]c(c([nH]1)Br)Br 2087862
Br[C@@H]1CNC(=O)OC1 2088141
B1O[SiH2]OBO[SiH2]O1 2088419
*c1cncnc1N 2088688
*c1cncnc1C 2088955
*c1cncc(c1)* 2089224
*c1cnc[nH]c1=O 2089495
*c1cnc(nc1)N 2089764
*c1ccnc(n1)N 2090033
*c1cccnc1N 2090300
*c1ccccc1O 2090567
*c1ccccc1F 2090834
*c1ccccc1C 2091101
*c1ccccc1* 2091368
*c1cccc(c1)O 2091637
*c1cccc(c1)N 2091906
*c1cccc(c1)F 2092175
*c1cccc(c1)C 2092444
*c1cccc(c1)* 2092713
*c1ccc(cc1)O 2092982
*c1ccc(cc1)N 2093251
*c1ccc(cc1)F 2093520
*c1ccc(cc1)C 2093789
*c1ccc(cc1)* 2094058
*c1cc[n+](cc1)C 2094330
*c1c[nH]c(c1*)C 2094602
*c1[nH]cc(c1*)* 2094874
c1nonc1C#N 2095141
c1nc[nH]c1C#N 2095379
c1cccc[cH+]c1 2095617
c1c[nH]nc1C#N 2095855
c1c(nn[nH]1)C#N 2096095
[SiH2]=c1[cH-]cccc1 2096339
[Se-]C=[N+]1CCCC1 2096582
[S-]c1n(N)cn[nH+]1 2096826
[S-]c1ccccc1 2097064
[S-]c1c[n+](cs1)C 2097307
[S-]C1=[NH+]CNCN1 2097551
[OH2+]c1ccccc1 2097791
[O-]c1cccnc1 2098028
[O-]c1ccccc1 2098265
[O-]c1cccc[nH+]1 2098506
[O-]c1cc[nH+]cc1 2098747
[O-][n+]1ccncc1 2098987
[O-][n+]1ccccc1 2099227
[O-]C1=CC(=O)C1=O 2099469
[O-]C1=CC(=O)C1=C 2099711
[NH4][*+3]([NH4])([NH4])([NH4])([NH4])[NH4] 2099979
[NH3+]c1ccccc1 2100218
[NH3+][C@H]1CCCNC1 2100461
[NH3+][C@@H]1CCC=CC1 2100706
[NH3+]C1CCNCC1 2100945
[NH3+]C1CCCCC1 2101184
[NH2+]=c1nccc[nH]1 2101427
[NH2+]=c1cccc[nH]1 2101670
[N-]1O[N+](=O)C(=C1)C 2101916
[N-2]c1ccccc1 2102154
[CH-2]c1ccccc1 2102393
[C-3]c1ccccc1 2102631
[C-3]c1[c-][c-]c[c-][c-]1 2102881
[BrH+]c1ccccc1 2103120
[BH3-]c1ccccc1 2103360
[BH3-][N+]#C[N-]C#[N+][BH3-] 2103613
[BH3-]C#[N+]C(C)(C)C 2103858
[2H]C([N+]([2H])([2H])[2H])[2H] 2104114
Sc1ccccc1 2104348
S=c1cccc[nH]1 2104587
S=C1CCCCN1 2104823
P=c1[cH-]cccc1 2105063
Oc1ccncn1 2105298
Oc1ccncc1 2105532
Oc1cccnc1 2105766
Oc1ccccn1 2106000
Oc1ccccc1 2106234
Oc1cccc[nH+]1 2106472
Oc1ccc[nH+]c1 2106710
Oc1cc[nH+]cc1 2106948
O[n+]1ccccc1 2107185
O[C@H]1OC[C@H](C1)O 2107429
O[C@H]1COC[C@H]1N 2107671
O[C@H]1COC[C@@H]1O 2107914
O[C@H]1COCC=C1 2108153
O[C@H]1CNC[C@H]1C 2108395
O[C@H]1CNC[C@@H]1O 2108638
O[C@H]1CNC=[NH+]C1 2108881
O[C@H]1CC[C@@H]2[C@H]1C2 2109130
O[C@H]1CCO[C@H]1C 2109372
O[C@H]1CCCOC1 2109610
O[C@H]1CCCNC1 2109848
O[C@H]1CCCCO1 2110086
O[C@H]1CCCC=C1 2110325
O[C@H]1CCC=CN1 2110564
O[C@H]1CCC=CC1 2110803
O[C@H]1CCC(=O)C1 2111044
O[C@H]1CC=CC=C1 2111284
O[C@H]1CC(=O)OC1 2111525
O[C@H]1CC(=O)NC1 2111766
O[C@H]1C=CC[C@H]1O 2112009
O[C@H]1C=CC(=O)O1 2112251
O[C@@H]1OC[C@H](C1)O 2112496
O[C@@H]1C[SH+]C[C@H]1O 2112743
O[C@@H]1C[NH2+]C[C@H]1O 2112992
O[C@@H]1C[NH2+]C[C@@H]1O 2113241
O[C@@H]1C[C@H]2[C@@H](C1)C2 2113493
O[C@@H]1COC[C@H]1O 2113736
O[C@@H]1COC[C@@H]1O 2113980
O[C@@H]1COC[C@@H]1N 2114224
O[C@@H]1COCC=C1 2114464
O[C@@H]1CNC[C@H]1O 2114707
O[C@@H]1CNC[C@@H]1O 2114951
O[C@@H]1CNC=[NH+]C1 2115195
O[C@@H]1CC[C@@H](C1)O 2115441
O[C@@H]1CCOC=C1 2115681
O[C@@H]1CCC[C@@H]1O 2115925
O[C@@H]1CCC[C@@H]1C 2116169
O[C@@H]1CCCOC1 2116408
O[C@@H]1CCCNC1 2116647
O[C@@H]1CCCCO1 2116886
O[C@@H]1CCCC=C1 2117126
O[C@@H]1CCC=CC1 2117366
O[C@@H]1CC(=O)OC1 2117608
O[C@@H]1CC(=O)NC1 2117850
O[C@@H]1C=CC(=O)O1 2118093
OC1COCOC1 2118327
OC1COCC1O 2118561
OC1CC[NH2+]CC1 2118800
OC1CCOCC1 2119034
OC1CCNCC1 2119268
OC1CCCCC1 2119502
OC1=CCNCC1 2119737
OC1=CCCCC1 2119972
OC1=CC(=O)OC1 2120210
OC1=CC(=O)NC1 2120448
OC1=CC(=O)CC1 2120686
OC1=CC(=O)C1=O 2120925
O=c1ncnc[nH]1 2121163
O=c1nccc[nH]1 2121401
O=c1cncc[nH]1 2121639
O=c1ccocc1 2121874
O=c1ccnco1 2122109
O=c1ccnc[nH]1 2122347
O=c1cccn[nH]1 2122585
O=c1cccco1 2122820
O=c1cccc[nH]1 2123058
O=c1cc[nH]nc1 2123296
O=c1cc[nH]cn1 2123534
O=c1cc[nH]cc1 2123772
O=c1[nH]ncn[nH+]1 2124014
O=c1[nH][nH]c(=O)[nH]1 2124261
O=c1[n-]cncn1 2124499
O=[P@@H]1CNCCO1 2124739
O=S1(=O)NCCO1 2124978
O=S1(=O)NCCN1 2125217
O=S1(=O)CCCC1 2125456
O=S1(=O)CCC=C1 2125696
O=S1(=O)C=CC=C1 2125937
O=P1OCCCO1 2126173
O=C[O-][H]OC=O 2126413
O=C[O-][H+][O]=CN 2126655
O=C[O-][H+][O-]C=O 2126898
O=C1ccC(=O)N1 2127136
O=C1[N-][N-]=CN=N1 2127379
O=C1SCC(=O)N1 2127617
O=C1ON=CC1=C 2127855
O=C1OC[C@H]2[C@@H]1C2 2128101
O=C1OC[C@@H]2[C@H]1C2 2128347
O=C1OCOC=C1 2128583
O=C1OCC[C@H]1O 2128822
O=C1OCC[C@H]1C 2129061
O=C1OCC[C@@H]1C 2129301
O=C1OCCN1C 2129536
O=C1OCCCO1 2129771
O=C1OCCC=C1 2130007
O=C1OCC=C1O 2130243
O=C1OCC=C1Cl 2130480
O=C1OCC=C1C 2130717
O=C1OCC=C1Br 2130954
O=C1OCC(=O)N1 2131193
O=C1OC=NC1=C 2131430
O=C1N[N-]C=NN1 2131669
O=C1NNC=NN1 2131905
O=C1NNC(=O)C1 2132143
O=C1NN=C(C1)C 2132381
O=C1NCNC1=O 2132617
O=C1NCC[C@H]1C 2132856
O=C1NCCCO1 2133091
O=C1NCCCN1 2133326
O=C1NCCC=C1 2133562
O=C1NCC=CN1 2133798
O=C1NCC=C1O 2134034
O=C1NCC=C1C 2134270
O=C1NCC1(Cl)Cl 2134509
O=C1NCC1(C)C 2134748
O=C1NCC(=O)O1 2134986
O=C1NCC(=O)N1 2135224
O=C1NC=NC1=C 2135461
O=C1CSC(=S)N1 2135699
O=C1CSC(=N)N1 2135939
O=C1COCCN1 2136175
O=C1COC(=S)N1 2136413
O=C1CNCCO1 2136649
O=C1CNCCN1 2136884
O=C1CNC=CN1 2137120
O=C1CNC(=S)N1 2137358
O=C1CC[C@H]2[C@@H]1C2 2137605
O=C1CCSCC1 2137840
O=C1CCO[C@H]1C 2138080
O=C1CCOCC1 2138315
O=C1CCOC=C1 2138551
O=C1CCNCC1 2138786
O=C1CCNC=C1 2139022
O=C1CCC[C@H]1C 2139261
O=C1CCC[C@@H]1C 2139501
O=C1CCCNC1 2139736
O=C1CCCN1C 2139971
O=C1CCCCO1 2140206
O=C1CCCCN1 2140441
O=C1CCCCC1 2140676
O=C1CCCC=C1 2140912
O=C1CCCC1=C 2141148
O=C1CCC=NN1 2141384
O=C1CCC=CO1 2141620
O=C1CCC=CN1 2141856
O=C1CCC=C1C 2142092
O=C1CCC(=O)O1 2142330
O=C1CCC(=O)N1 2142568
O=C1CC=CC=C1 2142805
O=C1CC=C(N1)C 2143043
O=C1C=CC[C@H]1C 2143283
O=C1C=CC[C@@H]1C 2143524
O=C1C=CCC=C1 2143761
O=C1C=CC(=O)O1 2144000
O=C1C=CC(=O)N1 2144239
O1CCC=COC1 2144474
O/N=C/1\OCC=C1 2144713
Nn1cn[nH]c1=[NH2+] 2144956
Nn1cn[nH]c1=S 2145194
Nn1cn[nH]c1=O 2145433
Nn1cn[nH+]c1N 2145671
Nc1ncncn1 2145905
Nc1ncccn1 2146139
Nc1nccc[nH+]1 2146377
Nc1cnccn1 2146611
Nc1cncc[nH+]1 2146849
Nc1ccncn1 2147083
Nc1ccncc1 2147317
Nc1cccnc1 2147551
Nc1ccccn1 2147785
Nc1ccccc1 2148019
Nc1cccc[nH+]1 2148257
Nc1ccc[nH+]c1 2148495
Nc1cc[nH+]cc1 2148733
Nc1[nH]nc(n1)N 2148972
N[C@H]1COC=CC1 2149211
N[C@H]1CCCNC1 2149449
N[C@@H]1[C@@H]2[C@H]1CNC2 2149699
N[C@@H]1CCOC=C1 2149939
N[C@@H]1CCCOC1 2150178
N[C@@H]1CCCNC1 2150417
N[C@@H]1CCC=CC1 2150657
NC1CCOCC1 2150891
NC1CCNCC1 2151125
NC1CCCCC1 2151359
NC1=NCCCO1 2151594
NC1=CCC=CN1 2151830
NC1=CC(=O)C1=O 2152069
NC1=CC(=N)N=N1 2152308
N=c1ssnc1Cl 2152544
N=c1nccc[nH]1 2152785
N=c1cccc[nH]1 2153023
N=c1cc[nH]cc1 2153261
N=c1[n-]cccn1 2153499
N=c1[cH-]cccc1 2153738
N=C1NCC(=O)N1 2153976
N=C1CCNCC1 2154211
N=C1CCCCC1 2154446
N=C1CC=CC=C1 2154683
N=C1C=CCC=C1 2154920
N=C1C=CC=C[CH+]1 2155161
N#Cc1cscc1 2155396
N#Cc1cocc1 2155632
N#Cc1cccs1 2155867
N#Cc1ccco1 2156103
N#Cc1ccc[nH]1 2156341
N#Cc1c[nH]nc1 2156579
N#Cc1c[nH]cc1 2156817
N#C[C@H]1CNCC1 2157056
N#C[C@@H]1CNCC1 2157296
N#C[C@@H]1CCCN1 2157536
N#C[BH-](C#N)C#N 2157777
N#CC=S(=O)(C)C 2158016
N#CC1CCCC1 2158252
N#CC1(CC1)C#N 2158490
N#C/C=C(\C#N)/N 2158730
Ic1cncnc1 2158964
Ic1ccncc1 2159199
Ic1cccnc1 2159434
Ic1ccccn1 2159669
Ic1ccccc1 2159904
Ic1ccc[nH+]c1 2160143
IC1CCCCC1 2160378
Fc1cscc1F 2160613
Fc1cncnc1 2160848
Fc1cccnc1 2161082
Fc1ccccn1 2161316
Fc1ccccc1 2161550
Fc1ccc[nH+]c1 2161788
Fc1c[nH]cc1F 2162025
Fc1c[c-]ccc1 2162262
F[C@H]1COC[C@H]1O 2162504
F[C@H]1COC[C@@H]1O 2162747
F[C@H]1CCCNC1 2162985
F[C@@H]1COC[C@H]1O 2163228
F[C@@H]1CCCOC1 2163467
F[C@@H]1CCCNC1 2163706
F[BH-]1NC=CC=[NH+]1 2163950
FC=C1CCCC1 2164185
FC1CCCCC1 2164419
FC1(F)CSCC1 2164655
FC1(F)CNCC1 2164892
Cn1nccc1N 2165126
Cn1nccc1C 2165360
Cn1nc[nH]c1=S 2165598
Cn1cncc1C 2165833
Cn1cn[nH]c1=S 2166071
Cn1cn[nH]c1=O 2166310
Cn1ccsc1=S 2166545
Cn1ccnc1C 2166781
Cn1ccc(=O)[nH]1 2167021
Cn1cc[nH]c1=[Se] 2167262
Cn1cc[nH]c1=S 2167501
Cn1cc[nH+]c1C 2167740
Cn1cc[n+](c1)C 2167979
Cn1cc(cn1)Cl 2168216
Cn1cc([nH+]n1)I 2168457
Clc1nscc1Cl 2168694
Clc1ncncn1 2168932
Clc1ncccn1 2169168
Clc1cncnc1 2169404
Clc1cnccn1 2169640
Clc1ccncn1 2169876
Clc1ccncc1 2170112
Clc1cccnn1 2170348
Clc1cccnc1 2170584
Clc1ccccn1 2170820
Clc1ccccc1 2171056
Clc1cccc[nH+]1 2171296
Clc1ccc(s1)Cl 2171535
Clc1cc[nH+]cc1 2171777
Clc1c[nH]nc1C 2172016
Clc1c[nH]cc1Cl 2172256
Clc1c[n-]cc1Cl 2172497
Clc1[nH]ccc1Cl 2172738
Clc1[nH+]cc([nH]1)Cl 2172985
Clc1[nH+]c[nH]c1Cl 2173230
Clc1[c-][c-]c[c-][c-]1 2173479
Cl[Si@H]1NCC=CN1 2173721
Cl[Si-]1(Cl)(Cl)NC=[NH+]1 2173973
Cl[C@H]1CCCOC1 2174216
Cl[C@@H]1CCCOC1 2174457
Cl[B-]1(Cl)NC(=[NH2+])N1 2174707
ClC1CCNCC1 2174944
Cc1scnc1C 2175179
Cc1sccc1C 2175414
Cc1scc(n1)C 2175651
Cc1scc(c1)C 2175888
Cc1onc(c1)C 2176125
Cc1nocc1C 2176359
Cc1noc(c1)N 2176595
Cc1nncnn1 2176829
Cc1nnc([nH]1)C 2177068
Cc1ncncn1 2177302
Cc1ncccn1 2177536
Cc1ncc(s1)C 2177772
Cc1ncc(o1)C 2178009
Cc1n[nH]c(c1)[O-] 2178251
Cc1n[nH]c(c1)O 2178490
Cc1n[nH]c(c1)N 2178729
Cc1n[nH]c(c1)Cl 2178969
Cc1n[nH]c(=S)s1 2179210
Cc1n[nH]c(=S)[nH]1 2179455
Cc1n[nH]c(=O)[nH]1 2179699
Cc1n[nH]c(=N)s1 2179939
Cc1n[nH+]c(s1)[S-] 2180183
Cc1cscc1C 2180419
Cc1csc(n1)N 2180656
Cc1csc(c1)Br 2180894
Cc1csc([nH+]1)[S-] 2181139
Cc1csc(=S)[nH]1 2181381
Cc1csc(=N)[nH]1 2181623
Cc1cnn(c1)C 2181860
Cc1cncnc1 2182094
Cc1cnccn1 2182328
Cc1ccncn1 2182562
Cc1ccncc1 2182796
Cc1ccn(n1)C 2183032
Cc1ccn(c1)C 2183268
Cc1cccnn1 2183502
Cc1cccnc1 2183736
Cc1ccccn1 2183970
Cc1ccccc1 2184204
Cc1cccc[nH+]1 2184442
Cc1ccc[nH+]c1 2184680
Cc1ccc(s1)Cl 2184917
Cc1ccc(s1)C 2185155
Cc1ccc(o1)C 2185392
Cc1ccc([nH]1)C 2185631
Cc1cc[nH+]cc1 2185869
Cc1c[pH]cc1C 2186106
Cc1c[nH]cc1C 2186344
Cc1c[nH]c(=[NH2+])s1 2186589
Cc1c[nH+]ccn1 2186828
Cc1c[nH+]c(s1)N 2187068
Cc1c[c-]ccc1 2187306
Cc1[nH]nc(c1)C 2187545
Cc1[nH]cnc1C 2187782
Cc1[nH]ccc1C 2188019
Cc1[nH]cc(c1)C 2188258
Cc1[nH][nH]c(=O)c1 2188501
Cc1[nH+]csc1C 2188739
Cc1[nH+]c[nH]c1C 2188981
Cc1[nH+][nH]c(c1)C 2189224
C[n+]1ccccc1 2189461
C[n+]1cc[nH]c1[S-] 2189704
C[n+]1cc[nH]c1C 2189945
C[n+]1cc([nH]n1)I 2190187
C[Si]1(C)C=CC=C1 2190429
C[NH+]1CC[NH2+]CC1 2190673
C[NH+]1CCOCC1 2190911
C[NH+]1CCNCC1 2191149
C[NH+]1CCCCC1 2191387
C[N+]1=CNCOC1 2191625
C[N+]1=CNCCC1 2191863
C[C@H]1SC=NC1=O 2192103
C[C@H]1NN=CN=N1 2192344
C[C@H]1N=COC1=O 2192584
C[C@H]1N=CNC1=O 2192824
C[C@H]1COCCN1 2193062
C[C@H]1COC(=O)O1 2193303
C[C@H]1COC(=O)N1 2193544
C[C@H]1CNCCN1 2193782
C[C@H]1CNC(=O)O1 2194023
C[C@H]1CNC(=O)N1 2194264
C[C@H]1CCC[NH2+]C1 2194507
C[C@H]1CCCOC1 2194745
C[C@H]1CCCNC1 2194983
C[C@H]1CCCC[NH2+]1 2195226
C[C@H]1CCCCO1 2195464
C[C@H]1CCCCN1 2195702
C[C@H]1CCCC=C1 2195941
C[C@H]1CCC(=O)O1 2196182
C[C@H]1CCC(=O)N1 2196423
C[C@H]1CC(=O)OC1 2196664
C[C@H]1CC(=O)NC1 2196905
C[C@H]1C=CC(=O)O1 2197147
C[C@@]12CNC[C@H]2C1 2197391
C[C@@]1(O)CNCC1 2197631
C[C@@H]1NCOC1=O 2197871
C[C@@H]1N=CNC1=O 2198112
C[C@@H]1COC[C@@H]1C 2198356
C[C@@H]1COCCN1 2198595
C[C@@H]1COC(=O)N1 2198837
C[C@@H]1CNCC[NH2+]1 2199081
C[C@@H]1CNCCO1 2199320
C[C@@H]1CNCCN1 2199559
C[C@@H]1CNC(=O)O1 2199801
C[C@@H]1CC[C@H](N1)C 2200046
C[C@@H]1CCCNC1 2200285
C[C@@H]1CCCC[NH2+]1 2200529
C[C@@H]1CCCCO1 2200768
C[C@@H]1CCCCN1 2201007
C[C@@H]1CCC=CC1 2201247
C[C@@H]1CCC(=O)O1 2201489
C[C@@H]1CC(=O)OC1 2201731
C[C@@H]1C=CCC=C1 2201972
C[C@@H]1C=CC(=O)O1 2202215
C[C+]1[NH+]=C[NH+]=C1C 2202462
CN1[PH2]=N[PH2+]N=[PH2]1 2202711
CN1COC[C@@H]1C 2202953
CN1CC[N+](=C1)C 2203193
CN1CCNCC1 2203427
CN1CCC[NH+]=C1 2203666
CN1CCCCC1 2203900
CN1C=CCC=C1 2204136
CC=[O][H+][O]=CC 2204377
CC=C1CCCC1 2204612
CC=C(C#N)C#N 2204849
CC1OCCCO1 2205083
CC1NCCCN1 2205317
CC1C[PH2+][BH2-][PH2+]C1 2205566
CC1COCOC1 2205802
CC1CCNCC1 2206036
CC1CCCCC1 2206270
CC1=NN[C@H](C1)O 2206511
CC1=NN[C@@H](C1)O 2206753
CC1=CNCSC1 2206988
CC1=CC[BH2-][PH2+]C1 2207234
CC1=CCCCC1 2207470
CC1=CCC=CO1 2207706
CC1=CCC=CN1 2207942
CC1=CC(=O)OC1 2208180
CC1=CC(=O)NC1 2208418
CC1=CC(=O)N=C1 2208657
CC1=CC(=O)CC1 2208895
CC1=CC(=C)N=C1 2209134
CC1(O)CCCC1 2209370
CC1(C)SCNC1 2209606
CC1(C)SC=NC1 2209844
CC1(C)OCCO1 2210081
CC1(C)NCCO1 2210317
CC1(C)CON=C1 2210554
CC1(C)COCC1 2210790
CC1(C)COC=N1 2211027
CC1(C)CNN=C1 2211264
CC1(C)CNCC1 2211500
CC1(C)CCCO1 2211736
CC1(C)CCCC1 2211972
CC1(C)CCC=[NH+]1 2212213
CC1(C)C=CC=C1 2212451
CC#C[Si](C)(C)C 2212691
CC#CC(C)(C)C 2212929
C=c1ccc(=C)[nH]1 2213170
C=[N+]1CCCCC1 2213408
C=C1[CH-]C=CC=C1 2213649
C=C1SC=NC1=O 2213886
C=C1CSCN=C1 2214123
C=C1COCN=C1 2214360
C=C1COC(=O)O1 2214598
C=C1CNCC=C1 2214834
C=C1CNC(=O)O1 2215072
C=C1CCOC1=O 2215308
C=C1CCNC1=O 2215544
C=C1CCCOC1 2215779
C=C1CCCNC1 2216014
C=C1CCCN=C1 2216250
C=C1CCCCC1 2216485
C=C1CCCC=C1 2216721
C=C1CCCC1=C 2216957
C=C1CCC(=O)N1 2217195
C=C1CCC(=C)O1 2217433
C=C1CC=CC1=O 2217670
C=C1C=COC=C1 2217907
C=C1C=CCC=C1 2218144
C=C1C=CC(=[NH2+])S1 2218388
C=C1C=CC(=O)O1 2218628
C=C1C=CC(=O)N1 2218867
C1SCCSCN1 2219101
C1SC(=N)NN=C1 2219341
C1NC(=[NH2+])OC=C1 2219585
C1C[C@@H]2O[C@H]1CC2 2219830
C1C[C@@H]2O[C@H]1C=C2 2220076
C1C[C@@H]2N[C@H]1CC2 2220321
C1C[C@@H]2C[C@H]1OC2 2220566
C1C[C@@H]2C[C@H]1CC2 2220811
C1C[C@@H]2C[C@H]1C=C2 2221057
C1CO[C@H]2[C@@H](C1)C2 2221304
C1COC=C1C#N 2221540
C1CNCCNC1 2221774
C1CC[Si]2(C1)CN2 2222015
C1CC[C@H]2[C@@H](C1)N2 2222263
C1CCNC=[NH+]C1 2222502
C1CCCNOC1 2222736
C1CCCCOC1 2222970
C1CCCCNC1 2223204
C1CCCCCC1 2223438
C1CCC=CCC1 2223673
C1CC=CC[NH2+]C1 2223913
C1=[NH+][P@@]23=[P@@](N1)(N2)N3 2224169
C1=C[C@@H]2[BH+2]34[C@H]1[C@@H]3[C@H]24 2224435
C1=C[C@@H]2O[C@H]1C=C2 2224682
C1=C[C@@H]2C[C@H]1C=C2 2224929
C1=CC=CC=CC1 2225166
Brc1scc(c1)Br 2225404
Brc1cncnc1 2225642
Brc1cnc([nH]1)C 2225883
Brc1ccsc1C 2226119
Brc1ccncc1 2226356
Brc1cccnc1 2226592
Brc1ccccn1 2226828
Brc1ccccc1 2227064
Brc1ccc[nH+]c1 2227304
Brc1ccc(s1)Br 2227543
Brc1[nH]ccc1Br 2227785
Brc1[nH]c[c-]c1Br 2228029
Brc1[c-]cccc1 2228269
Brc1[c-][c-]c[c-][c-]1 2228517
BrC1CCCCC1 2228753
BrC1=[NH+]CCCN1 2228994
BrC1=CCCCC1 2229231
B=C1C=CC=C[CH+]1 2229473
*c1ncncn1 2229707
*c1cncnc1 2229941
*c1cnccn1 2230175
*c1cn[nH]c1C 2230412
*c1ccncn1 2230646
*c1ccncc1 2230880
*c1cccnn1 2231114
*c1cccnc1 2231348
*c1ccccn1 2231582
*c1ccccc1 2231816
*c1ccc(s1)* 2232052
*c1[nH]ccc1* 2232290
n1ncnnc1 2232523
n1cncnc1 2232724
n1cn[s+]nc1 2232928
n1ccnnc1 2233130
n1ccncc1 2233331
c1n[nH]c(=[NH2+])s1 2233543
c1cncc[nH+]1 2233749
c1ccnnc1 2233950
c1ccncn1 2234151
c1ccn[nH+]c1 2234356
c1cccnc1 2234557
c1ccccc1 2234758
c1ccc[o+]c1 2234962
c1ccc[nH+]c1 2235167
c1cc[nH+]cn1 2235372
c1[c-]cccc1 2235576
c1[c-]c[o+]c[c-]1 2235786
c1[c-][c-]c[c-][c-]1 2235999
[nH+]1cc[nH+]cc1 2236208
[n-]1oncc1=N 2236413
[n-]1oc(=O)c[nH+]1 2236624
[cH-]1c(=N)[nH]c[nH+]1 2236839
[c-]1ccncc1 2237043
[c-]1c[c-]ccc1 2237250
[c-]1[c-]cnc[c-]1 2237460
[c-]1[c-]ccc[c-]1 2237670
[c-]1[c-]c[c-][c-]n1 2237883
[c-]1[c-][c-]cc[c-]1 2238096
[c-]1[c-][c-][c-]c[c-]1 2238312
[SiH2]=[Si]1CCCC1 2238522
[SiH2]1O[SiH2]O[SiH2]O1 2238740
[SiH2]1C[C@@H]2[C@H](C1)N2 2238962
[SiH-]1(F)(Cl)NC=[NH+]1 2239179
[Se]=c1[nH]cc[nH]1 2239392
[Se]=[P@@H]1N[P@H](=[Se])N1 2239613
[Se]=C1NCCN1 2239822
[S-]c1scn[nH+]1 2240031
[S-]c1scc[nH+]1 2240241
[S-]c1[nH]nc[nH+]1 2240454
[S-]c1[nH]cn[nH+]1 2240666
[S-]c1[nH]cc[nH+]1 2240878
[PH3]=[N+]1CCCC1 2241088
[PH2]1=N[PH2]=[NH+][PH2]=[NH+]1 2241313
[PH2]1=N[PH2]=N[PH2]=N1 2241532
[PH2]1=N[PH2+]N=[PH2][N-]1 2241754
[PH2+]1C[BH2-][PH2+]C[BH2-]1 2241978
[OH2][*+2]([OH2])([OH2])([OH2])[OH2] 2242209
[O-]n1cnnn1 2242413
[O-]n1cncn1 2242617
[O-]n1cccn1 2242821
[O-]c1nnc[nH]1 2243028
[O-]c1cnc[nH]1 2243235
[O-]c1cc[nH][nH+]1 2243446
[O-]c1c[nH+]c[nH]1 2243657
[O-]c1[nH]cn[nH+]1 2243868
[O-][NH+]1CCCC1 2244076
[O-][N+]1=CCCC1 2244284
[O-]1[H+][O]=CC=C1 2244495
[NH3+][C@H]1CNCC1 2244705
[NH3+]C1CCCC1 2244911
[NH2+]=c1scc[nH]1 2245121
[NH2+]=c1[nH]nc[nH]1 2245335
[NH2+]=C1NCCS1 2245542
[NH2+]=C1NCCN1 2245750
[NH2+]1CC[NH2+]CC1 2245961
[NH2+]1CCC=CC1 2246168
[NH+]1=[BH-][NH+]=[BH-][NH+]=[BH-]1 2246396
[N-]1ON=CC1=C 2246602
[CH-]1[CH-][CH-][CH-][CH-][CH-]1 2246827
[C-]1=C[C-]=C=C=N1 2247038
[C-2]=C=C=C=C=[CH-] 2247250
[BH3-]c1[nH]cc[nH+]1 2247463
[BH3-][PH+]1CCCC1 2247673
[BH3-][NH+]1CCCC1 2247884
[BH2-]1OBOBO1 2248090
[BH2-]1NC=NC=[NH+]1 2248302
[BH2-]1C[C@@H]([PH2]=[NH+]1)C 2248524
[BH2-]1CC[PH2+]CC1 2248736
[BH2-]1C=C[SH+]C=C1 2248949
[BH2-]1C=CCC=C1 2249158
[BH2-]1C(=N)NC=[NH+]1 2249372
[2H]C[N+]([2H])([2H])[2H] 2249590
Sc1nncs1 2249791
Sc1nnco1 2249994
Sc1nnc[nH]1 2250199
S[C@@H]1COCC1 2250406
S=c1scn[nH]1 2250612
S=c1sccs1 2250816
S=c1scc[nH]1 2251024
S=c1ocn[nH]1 2251231
S=c1ccss1 2251434
S=c1[nH]nc[nH]1 2251645
S=c1[nH]cc[nH]1 2251854
S=[P@@H]1SC=CS1 2252063
S=[P@@H]1N[P@H](=S)N1 2252281
S=[P@@H]1N[P@@H](=S)N1 2252500
S=P1SCCS1 2252706
S=C1OCCO1 2252912
S=C1NCCS1 2253115
S=C1NCCO1 2253319
S=C1NCCN1 2253522
S=C1N=[NH+][NH+]=N1 2253735
S=C1C=CC1=S 2253940
P=c1[nH]cc[nH]1 2254150
On1cnnn1 2254352
Oc1cscn1 2254553
Oc1cnsn1 2254755
Oc1cnc[nH]1 2254960
Oc1ccon1 2255161
Oc1ccn[nH]1 2255365
Oc1cc[nH]n1 2255569
Oc1c[nH]nc1 2255773
O[C@H]1C[NH2+]CC1 2255983
O[C@H]1COCC1 2256188
O[C@H]1CNCC1 2256393
O[C@H]1CC[C@H]1C 2256602
O[C@H]1CCCO1 2256807
O[C@H]1CCCN1 2257012
O[C@H]1CCC=C1 2257218
O[C@H]1CC=NN1 2257424
O[C@@H]1CSCC1 2257630
O[C@@H]1COCC1 2257837
O[C@@H]1CNCC1 2258043
O[C@@H]1CC[C@@H]1C 2258254
O[C@@H]1CCCO1 2258460
O[C@@H]1CCCN1 2258666
O[C@@H]1CCC=C1 2258873
O[C@@H]1CC=NN1 2259080
OC1COCC1 2259281
OC1CCCC1 2259482
O=s1cccc1 2259684
O=c1scn[nH]1 2259890
O=c1sccs1 2260093
O=c1scc[nH]1 2260300
O=c1ocn[nH]1 2260506
O=c1occ[nH]1 2260711
O=c1cnss1 2260913
O=c1cco[nH]1 2261120
O=c1cc[nH]o1 2261325
O=c1cc[nH][nH]1 2261533
O=c1[nH]nn[nH]1 2261741
O=c1[nH]nc[nH]1 2261949
O=c1[nH]cc[nH]1 2262157
O=[S@]1CSCC1 2262362
O=[P@H]1NCCO1 2262570
O=[P@@H]1N[P@H](=O)N1 2262785
O=[P@@H]1NCCO1 2262994
O=[P@@H]1C=CC=C1 2263204
O=[N+]1ON=C[CH+]1 2263415
O=S1OCCO1 2263617
O=S1CCCC1 2263820
O=P1NCCN1 2264023
O=C1OCCO1 2264226
O=C1NCCS1 2264428
O=C1NCCO1 2264631
O=C1NCCN1 2264833
O=C1COCC1 2265035
O=C1CNCC1 2265237
O=C1CCCS1 2265439
O=C1CCCO1 2265642
O=C1CCCN1 2265844
O=C1CCCC1 2266046
O=C1CC=CN1 2266249
O=C1C=CC=C1 2266453
O=C1C=CC1=O 2266657
O=C1C=CC1=C 2266861
O1[BH2-]O[CH+]C=C1 2267072
O1NCC=CC1 2267274
O1C[C@@H]2[C@H](C1)O2 2267488
O1COCOC1 2267689
O1CCOCC1 2267890
O1CCC=CC1 2268092
O1C=CC=[O][H]1 2268299
Nn1cnnn1 2268500
Nn1cnnc1 2268701
Nn1c[nH+]nc1 2268906
Nc1scc[nH+]1 2269111
Nc1nnn[nH]1 2269316
Nc1nncs1 2269517
Nc1nnco1 2269719
Nc1nnc[nH]1 2269923
Nc1ncns1 2270124
Nc1ncno1 2270326
Nc1ncn[nH]1 2270530
Nc1nccs1 2270731
Nc1ncco1 2270933
Nc1ncc[nH]1 2271137
Nc1n[nH]cn1 2271341
Nc1cscn1 2271542
Nc1cscc1 2271744
Nc1cnon1 2271946
Nc1cnc[nH]1 2272150
Nc1ccno1 2272351
Nc1ccn[nH]1 2272555
Nc1cccs1 2272756
Nc1cc[nH]n1 2272961
Nc1c[nH]nc1 2273165
Nc1c[nH+]c[nH]1 2273373
N[C@H]1CNCC1 2273578
N[C@@H]1COCC1 2273784
N[C@@H]1CNCC1 2273990
NC1CCCC1 2274191
NC1=NCCO1 2274393
NC1=NCCC1 2274595
NC1=CNON1 2274797
NC1=CCCC1 2274999
N=c1sccs1 2275201
N=c1scc[nH]1 2275408
N=c1ccss1 2275611
N=c1cc[nH][nH]1 2275821
N=c1[nH]nn[nH]1 2276029
N=c1[nH]cc[nH]1 2276237
N=[Si]1CCCC1 2276442
N=C1SCCS1 2276645
N=C1NCCS1 2276849
N=C1NCCO1 2277052
N=C1NCCN1 2277254
N=C1CCCN1 2277456
N=C1CCCC1 2277658
N=C1C=CC=[NH+]1 2277866
N=C1C=CC=N1 2278070
N1[CH-]C=CC=C1 2278277
N1[C-]=[C-]N[C-]=[C-]1 2278492
N1NC=NN=C1 2278695
N1C[C@@H]2[C@H](C1)O2 2278909
N1C[C@@H]2[C@H](C1)C2 2279123
N1CNCNC1 2279324
N1CN2[C@@H](C1)C2 2279534
N1CCNCC1 2279735
N1CCC=CC1 2279937
N1CC=CC=C1 2280140
N1=CON=CO1 2280343
N1=CNN=CN1 2280546
N1=CN=[PH2]N=C1 2280754
N1=CN=SN=C1 2280959
N1=CCN=CC1 2281163
N1=CC=NCC1 2281366
N#CC(=[CH-])C#N 2281574
N#CC(=C)C#N 2281778
N#C/C=C\C#N 2281982
N#C/C=C/C#N 2282186
Ic1cocc1 2282387
Ic1cnn[nH]1 2282592
Ic1cn[nH]n1 2282797
Ic1ccn[nH]1 2283002
Ic1cccs1 2283204
Ic1ccc[nH]1 2283410
Ic1c[nH]nc1 2283615
Ic1c[nH]cc1 2283820
Ic1[nH]cc[nH+]1 2284029
F[PH-](F)(F)(F)F 2284239
F[C@H]1COCC1 2284445
F[C@H]1CNCC1 2284650
F[C@@H]1COCC1 2284856
F[C@@H]1CNCC1 2285062
FS(F)(F)(F)F 2285267
Cn1nncn1 2285469
Cn1nccn1 2285670
Cn1cnnn1 2285871
Cn1cnnc1 2286072
Cn1cncn1 2286273
Cn1cncc1 2286474
Cn1ccnn1 2286675
Cn1cccn1 2286876
Cn1cccc1 2287077
Cn1cc[nH+]n1 2287282
Cn1c[nH+]nc1 2287487
Cn1c[nH+]cc1 2287692
Clc1nccs1 2287894
Clc1cscc1 2288098
Clc1cs[s+]n1 2288305
Clc1cccs1 2288510
Clc1ccco1 2288714
Clc1c[s+]sn1 2288920
Clc1c[nH]nc1 2289128
Clc1c[nH]cn1 2289334
Clc1c[nH]cc1 2289540
Clc1[nH]cc[nH+]1 2289750
Cl[SiH]1NCCN1 2289957
Cl[SiH-]1(Cl)NC=[NH+]1 2290174
Cl[Si@@H]1NC=CN1 2290386
Cl[P@@H+]1P2P3P1P23 2290600
Cl[P-]1=[NH+][P-](=[NH+]1)Cl 2290827
Cl[B-]1(Cl)NC=[NH+]1 2291044
ClP1NP(N1)Cl 2291251
ClP1NCCN1 2291457
Cc1nscn1 2291660
Cc1nocn1 2291862
Cc1nnn[nH]1 2292066
Cc1nncs1 2292267
Cc1nnco1 2292469
Cc1nnc[nH]1 2292673
Cc1nn[nH]p1 2292877
Cc1ncno1 2293079
Cc1ncn[nH]1 2293283
Cc1nccs1 2293484
Cc1ncco1 2293686
Cc1ncc[nH]1 2293890
Cc1nc[nH+][nH]1 2294098
Cc1n[nH]nn1 2294302
Cc1n[nH]cn1 2294506
Cc1csnn1 2294707
Cc1cscn1 2294909
Cc1cscc1 2295111
Cc1csc[nH+]1 2295317
Cc1cocn1 2295519
Cc1cocc1 2295720
Cc1cnon1 2295921
Cc1cnn[nH]1 2296125
Cc1cncs1 2296326
Cc1cnco1 2296528
Cc1cnc[nH]1 2296732
Cc1ccsn1 2296933
Cc1ccon1 2297135
Cc1ccno1 2297336
Cc1ccn[nH]1 2297540
Cc1cccs1 2297741
Cc1ccco1 2297943
Cc1ccc[nH]1 2298147
Cc1cc[nH]n1 2298351
Cc1cc[nH+][nH]1 2298559
Cc1c[s+]cs1 2298763
Cc1c[nH]nn1 2298969
Cc1c[nH]nc1 2299173
Cc1c[nH]cn1 2299377
Cc1c[nH]cc1 2299581
Cc1c[nH]c[nH+]1 2299789
Cc1c[nH+]cs1 2299994
Cc1c[nH+]c[nH]1 2300203
Cc1[nH]cc[nH+]1 2300411
C[n+]1cscc1 2300615
C[n+]1cc[nH]n1 2300823
C[n+]1c[nH]cc1 2301030
C[Si]1(C)NPN1 2301236
C[SiH]1NCCN1 2301443
C[Si@@H]1C=CC=C1 2301653
C[NH+]1CCCC1 2301859
C[N+]1=CSCC1 2302064
C[C@H]1CSCN1 2302270
C[C@H]1COCO1 2302476
C[C@H]1COCN1 2302681
C[C@H]1COCC1 2302886
C[C@H]1COC=N1 2303092
C[C@H]1CNN=C1 2303298
C[C@H]1CNCC1 2303503
C[C@H]1CNC1=O 2303709
C[C@H]1CCOO1 2303914
C[C@H]1CCCO1 2304119
C[C@H]1CCCN1 2304324
C[C@@]1(CN1)C#C 2304532
C[C@@H]1COCO1 2304738
C[C@@H]1COCN1 2304944
C[C@@H]1COCC1 2305150
C[C@@H]1COC=N1 2305357
C[C@@H]1COC1=O 2305564
C[C@@H]1CNCN1 2305770
C[C@@H]1CNCC1 2305976
C[C@@H]1CNC=C1 2306183
C[C@@H]1CN=CS1 2306390
C[C@@H]1CN=CO1 2306598
C[C@@H]1CN=CC1 2306805
C[C@@H]1CCNO1 2307011
C[C@@H]1CCC[NH2+]1 2307222
C[C@@H]1CCCO1 2307428
C[C@@H]1CCCN1 2307634
C[C@@H]1CCC=C1 2307841
C[C@@H]1CC1(Cl)Cl 2308051
C[C@@H]1CC1(*)* 2308261
CN1CNN=C1 2308463
CN1CN=CO1 2308665
CN1CCCO1 2308866
CN1CCCC1 2309067
CC1SCCS1 2309268
CC1OCCO1 2309471
CC1CCCC1 2309672
CC1=NNCC1 2309874
CC1=CC[PH2+]C1 2310081
CC1=CCCO1 2310284
CC1=CCCC1 2310486
CC1(C)CCC1 2310689
CC(C#N)C#N 2310892
CC#CC#CN 2311093
CC#CC#CC 2311294
C=[N+]1CCCC1 2311499
C=C1SCCS1 2311701
C=C1SC=CS1 2311906
C=C1NCCS1 2312110
C=C1NCCO1 2312313
C=C1NCCN1 2312515
C=C1NC=CN1 2312718
C=C1C[C@H]1C#N 2312925
C=C1COCC1 2313127
C=C1CNN=C1 2313330
C=C1CNCC1 2313532
C=C1CC[NH+]=C1 2313739
C=C1CCCN1 2313941
C=C1CCCC1 2314143
C=C1CCC=C1 2314346
C=C1CCC1=C 2314549
C=C1CC(=O)N1 2314754
C=C1C=CC=[NH+]1 2314962
C=C1C=CC=N1 2315166
C=C1C=CC=C1 2315370
C1[CH-]CCCC1 2315575
C1[CH-]C=CC=C1 2315782
C1SCNC1=O 2315984
C1SC=NC1=O 2316188
C1SC=CC1=O 2316392
C1OCOC1=O 2316595
C1OCNC1=O 2316797
C1OC=NC1=O 2317000
C1OC=CC1=O 2317203
C1OC(=O)C=N1 2317408
C1OC(=O)C=C1 2317613
C1N[C@H]2C[C@@H]1C2 2317825
C1NN=CN=[NH+]1 2318032
C1NCOC1=O 2318234
C1NCNC1=O 2318436
C1NCC=CN1 2318638
C1NC=CCS1 2318840
C1NC=CC=N1 2319044
C1NC=CC1=O 2319247
C1NC(=O)C=N1 2319452
C1NC(=O)C=C1 2319657
C1N=COC1=O 2319860
C1N=CNC1=O 2320063
C1C[C@@H]2[C@H](O1)C2 2320277
C1C[C@@H]2[C@H](N1)C2 2320491
C1C[C@@H]2[C@H](C1)O2 2320705
C1C[C@@H]2[C@H](C1)C2 2320919
C1COCC[NH2+]1 2321125
C1COC=CC1 2321327
C1CN[C@H]1C#N 2321533
C1CN[C@@H]1C#N 2321740
C1CNOC1=O 2321942
C1CNNC1=O 2322144
C1CNN=CC1 2322346
C1CNCC[NH2+]1 2322552
C1CNCCS1 2322753
C1CNCCO1 2322955
C1CNC=CC1 2323157
C1CC[PH2+]P=[PH2]1 2323368
C1CC[NH+]=CS1 2323577
C1CC[NH+]=CN1 2323784
C1CCSCS1 2323985
C1CCOCO1 2324188
C1CCOCN1 2324389
C1CCNOC1 2324590
C1CCNNC1 2324791
C1CCNCN1 2324992
C1CCN=CS1 2325194
C1CCN=CO1 2325397
C1CCN=CN1 2325599
C1CCC[NH2+]C1 2325805
C1CCCSC1 2326006
C1CCCO[BH2-]1 2326213
C1CCCOC1 2326414
C1CCCNC1 2326615
C1CCCCC1 2326816
C1CCC=[NH+]C1 2327022
C1CCC=NC1 2327224
C1CCC=CC1 2327426
C1CC=NCS1 2327628
C1CC=CC=C1 2327832
C1CC=CC1=O 2328035
C1C=NNC1=O 2328238
C1C=COC=C1 2328441
C1C=CNC=N1 2328644
C1C=CNC=C1 2328847
C1=[CH2-]C=CC=C1 2329056
C1=[BH-][NH+]=CC=C1 2329268
C1=[BH-]C=CC=C1 2329476
C1=C[P@@]23=[P@@]1(N2)N3 2329693
C1=C[CH-]C=C[CH-]1 2329906
C1=C[C@@H]2[C@H](O1)C2 2330121
C1=CCC=CC1 2330324
C1=CC=C[NH2]=C1 2330532
C1=CC=C[NH+]=[BH-]1 2330744
C1=CC=C[CH+]C1 2330951
C/C(=C\C#N)/O 2331157
Brc1cscn1 2331359
Brc1cscc1 2331563
Brc1cocc1 2331767
Brc1cncs1 2331970
Brc1cccs1 2332174
Brc1ccco1 2332378
Brc1ccc[nH]1 2332584
Brc1cc[nH]n1 2332790
Brc1c[nH]nc1 2332996
Brc1c[nH]cc1 2333202
Br[B-]1=[NH+]CC=[NH+]1 2333418
*c1ncc[nH]1 2333623
*c1cscc1 2333824
*c1cnc[nH]1 2334029
*c1ccn[nH]1 2334233
*c1cccs1 2334434
*c1ccco1 2334636
*c1c[nH]nc1 2334840
*c1c[nH]cn1 2335044
s1cnnc1 2335244
p1[nH]cc[nH+]1 2335420
o1cnnc1 2335589
n1ncp[nH]1 2335760
n1ncn[nH]1 2335932
n1cns[s+]1 2336103
n1cn[se][se+]1 2336280
n1cn[nH][nH+]1 2336457
n1[nH]cc[nH+]1 2336632
c1scc[s+]1 2336803
c1scc[nH+]1 2336977
c1pcn[nH]1 2337149
c1ns[s+][s+]1 2337324
c1nnn[nH]1 2337498
c1ncs[s+]1 2337669
c1ncns1 2337839
c1ncno1 2338008
c1ncn[nH]1 2338179
c1nccs1 2338347
c1ncco1 2338516
c1ncc[se]1 2338687
c1ncc[nH]1 2338859
c1nc[nH][nH+]1 2339034
c1nc[n-]n1 2339205
c1cnsn1 2339373
c1cnon1 2339542
c1cnns1 2339710
c1cnn[se]1 2339882
c1cnn[nH]1 2340054
c1cn[se][nH+]1 2340229
c1cn[nH]n1 2340401
c1ccns1 2340569
c1ccno1 2340738
c1ccn[nH]1 2340909
c1cccs1 2341077
c1ccco1 2341246
c1ccc[se]1 2341417
c1ccc[pH]1 2341589
c1ccc[nH]1 2341761
c1cc[nH][nH+]1 2341936
c1c[n-]cn1 2342107
c1c[n-]c[nH+]1 2342282
c1[nH]nn[nH+]1 2342457
c1[nH]nc[nH+]1 2342632
c1[nH]cn[nH+]1 2342807
c1[nH]cc[nH+]1 2342982
[se]1cnnc1 2343153
[nH]1cnnc1 2343325
[nH+]1cc[nH+][pH]1 2343504
[n-]1nncn1 2343676
[n-]1cnnn1 2343847
[n-]1ccnn1 2344018
[n-]1cccn1 2344189
[n-]1cccc1 2344360
[cH-]1cccc1 2344532
[cH-]1ccc[nH+]1 2344708
[c-]1cccs1 2344879
[c-]1[nH]cn[nH+]1 2345058
[c-]1[nH]cc[nH+]1 2345236
[SiH3]C#CC=C 2345409
[SiH2]1NC=CN1 2345584
[SiH2]1C=CC=C1 2345760
[SiH2-]1(F)NC=[NH+]1 2345942
[SiH2-]1(Cl)NC=[NH+]1 2346125
[PH2+]1PP[PH2+]C1 2346305
[PH2+]1CC[PH2+]P1 2346487
[OH2][*+2]([OH2])([OH2])[OH2] 2346680
[O-]/C=C\C#N 2346853
[O-]/C=C/C#N 2347026
[O-]*(=O)(=O)[O-] 2347204
[N-]=C=CC#N 2347376
[N-]1CCCC1 2347547
[CH-]=C=C=C=[CH-] 2347725
[C-]1=[NH+]CCN1 2347901
[C-3]C(=[NH+][O-])[C-3] 2348085
[C-2]=C=C=C=[CH-] 2348263
[BH3-]P(=C)(C)C 2348439
[BH2-]1OCC[NH2+]1 2348618
[BH2-]1CC[PH2]=[NH+]1 2348800
[BH2-]1CCC[PH2+]1 2348979
[BH2-]1C=CC=C1 2349155
[BH-]1=[NH+]CCN1 2349332
[BH-]1=[NH+]C=CN1 2349510
[BH-]1=[NH+]C=CC1 2349688
[2H]OC([2H])[2H] 2349865
[2H]N(C=O)[2H] 2350040
P1NC=CN1 2350209
O[VH](O)(O)O 2350383
O[*H](O)(O)O 2350557
OC1CNC1 2350725
OC1CCC1 2350893
O=[SH2]=NC#N 2351066
O=P1NPN1 2351236
O=C1CCC1 2351407
O1CCO[BH2-]1 2351580
O1CCOB1 2351748
O1CCC=N1 2351917
O1CC=CC1 2352086
O/N=C\C#N 2352256
O/C=C/C#N 2352426
NC=[N+](C)C 2352598
NC1CCC1 2352766
NC(=[NH+]C)N 2352939
N=C1CCC1 2353108
N1NC=CN1 2353277
N1CCC=N1 2353446
N1CC=CC1 2353615
N1C=[NH+][Si]1=[NH2+] 2353797
N1=CC=NC1 2353968
N/C=N\C#N 2354138
N/C=C/C#N 2354308
N#C[CH+]C#N 2354480
N#C[C@@H]1C=C1 2354655
N#C[BH2-]C#N 2354828
N#CCC#N 2354996
N#CC1CC1 2355165
IC#CC=O 2355333
F[SiH2-2](F)(F)F 2355511
F[PH2-](F)(F)F 2355687
FC=C(F)F 2355857
FC1CCC1 2356025
FC1(F)CC1 2356195
Cl[SiH2-2](Cl)(Cl)Cl 2356376
Cl[SiH-](Cl)(Cl)Cl 2356560
ClP(=N)(Cl)Cl 2356739
ClC=C(Cl)Cl 2356915
ClC1(Cl)CC1 2357090
C[SiH](C#C)C 2357265
C[C@H]1CC=C1 2357439
C[C@@H]1O[C@@H]1C 2357617
C[C@@H]1CN=C1 2357791
C[C@@H]1CC=C1 2357965
CS(=O)(=N)C 2358137
CP(=[PH3])(C)C 2358313
CP(=[NH2+])(C)C 2358491
CCC#CC 2358659
CC=[N+](C)C 2358831
CC=C(C)C 2359000
CC1COC1 2359168
CC1CCC1 2359336
CC1(C)OC1 2359506
CC1(C)NC1 2359676
CC1(C)CC1 2359846
CC(C#N)C 2360015
CC#CCO 2360182
CC#CC=O 2360350
CC#CC=C 2360518
C=C=C(C)C 2360688
C=C1CCC1 2360857
C=C1CC=C1 2361027
C1SCCS1 2361195
C1O[C@H]1C#N 2361370
C1OCCS1 2361538
C1OCCO1 2361707
C1NOC=C1 2361876
C1NNC=N1 2362045
C1NNC=C1 2362214
C1NN=CS1 2362383
C1NN=CO1 2362553
C1NCCS1 2362721
C1NCCO1 2362890
C1NCCN1 2363058
C1NC=CS1 2363227
C1C[PH2]=P[PH2+]1 2363406
C1C[C@H]2[C@@H]1C2 2363588
C1CSSC1 2363756
C1CSC=[NH+]1 2363931
C1CSC=N1 2364101
C1CPPP1 2364270
C1CPC1=O 2364442
C1COPO1 2364611
C1COC=N1 2364781
C1COC1=O 2364950
C1CNPN1 2365118
C1CNNC1 2365287
C1CNC=[NH+]1 2365460
C1CNC=N1 2365629
C1CNC1=O 2365798
C1CCNO1 2365966
C1CCC[SH+]1 2366138
C1CCC[OH+]1 2366311
C1CCC[NH2+]1 2366484
C1CCCS1 2366652
C1CCCO1 2366821
C1CCCN1 2366989
C1CCCC1 2367157
C1CCC=N1 2367326
C1CC=CS1 2367495
C1CC=CO1 2367665
C1CC=CN1 2367834
C1CC=CC1 2368003
C1CC21CC2 2368173
C1C=CS[CH+]1 2368346
C1C=CC=N1 2368517
C1C=CC=C1 2368687
C1=NCC=N1 2368857
C1=CNC=[NH2]1 2369031
C/C=C\C#N 2369201
C/C=C/C#N 2369371
Br[SiH2-2](Br)(Br)Br 2369552
BrC1(Br)CC1 2369729
B1CCC=[NH+]1 2369904
B1CC=CC1 2370073
B1C=CC=C1 2370243
