Created
February 10, 2020 13:57
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Bemis Murcko scaffolds derived from FDA Approved Drugs using RDKit
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| C1=C2CCCCC2C2CCC3C(c4cccnc4)=CCC3C2C1 | |
| C1=C[C@H](N[C@H]2CC[C@@H](O[C@H]3CC[C@@H](O[C@H]4CCCOC4)OC3)OC2)CCC1 | |
| c1ccccc1 | |
| O=c1oc2ccccc2cc1Cc1ccccc1 | |
| c1ccc2c(c1)Nc1ccccc1S2 | |
| c1ccc2c(c1)Nc1ccccc1S2 | |
| c1ccccc1 | |
| c1nncs1 | |
| O=C(NC1CCCCC1)NS(=O)(=O)c1ccccc1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCCN1CCNCC1 | |
| O=C1C=C([C@H]2CCC3C2CC[C@@H]2C4CC[C@H](O[C@H]5CC[C@H](O[C@H]6CC[C@H](O[C@H]7CCCCO7)CO6)CO5)C[C@H]4CC[C@@H]32)CO1 | |
| c1ccccc1 | |
| O=C(OC1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(c1cccs1)c1cccs1 | |
| O=c1nc[nH]c2[nH]cnc12 | |
| c1cc(-c2ccc3ccccc3c2)cc(C23CC4CC(CC(C4)C2)C3)c1 | |
| c1ncc2[nH]cnc2n1 | |
| c1ncc2ncn([C@H]3CCCO3)c2n1 | |
| c1ccc(C2=NCc3nncn3-c3ccccc32)cc1 | |
| c1ccc(Nc2ncnc3cc(O[C@H]4CCOC4)ccc23)cc1 | |
| c1ccc2ccccc2c1 | |
| c1ccc2c(c1)N[C@H]1[C@@H]3C[C@H]4CCN3[C@H]3C[C@@]21CC34 | |
| c1ccc2[nH]cnc2c1 | |
| c1ccc2c(c1)CCn1ccnc1C2=C1CCNCC1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1[C@@H]2CCC2CCC[C@H]21 | |
| C=C1CCCC/C1=C/C=C1\CCCC2CCC[C@@H]12 | |
| O=c1[nH]nnn1CCN1CCC(Nc2ccccc2)CC1 | |
| O=C(NCCCNc1ncc2ccccc2n1)C1CCCO1 | |
| c1ccccc1 | |
| C1=CCCCC1 | |
| O=C(NCC1CCCN1)c1ccc2n[nH]nc2c1 | |
| O=c1ncnc2[nH][nH]cc1-2 | |
| C1=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)[C@H]2CCC1 | |
| c1ccc(C(c2ccccc2)N2CCN(c3ncncn3)CC2)cc1 | |
| O=S(=O)(Cc1ccc2[nH]ccc2c1)N1CCCC1 | |
| O=c1cc(N2CCCCC2)n(Cc2ccccc2)c(=O)[nH]1 | |
| O=C1c2c([nH]c3ccccc23)CCN1Cc1c[nH]cn1 | |
| c1ccc(C2=NCc3nncn3-c3ccccc32)cc1 | |
| c1ccccc1 | |
| O=C1CCCC1 | |
| c1ncncn1 | |
| c1ccc(CCCNCCCc2ccccc2)cc1 | |
| c1ccc(CCCN2CCC(c3ccccc3)CC2)cc1 | |
| C1C2CC3CC1CC(C2)C3 | |
| O=C(NCC[NH2+]Cc1ccccc1)C(=O)NCC[NH2+]Cc1ccccc1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2C3OC4(CCCC4)O[C@@H]3C[C@H]21 | |
| O=C1[C@@H](N=CN2CCCCCC2)[C@H]2SCCN12 | |
| C1CC[C@@H](O[C@H]2CCC[C@@H](O[C@@H]3CCCCO3)C2)OC1 | |
| c1cnccn1 | |
| O=C1CCC(c2ccccc2)C(=O)N1 | |
| c1ccccc1 | |
| O=c1cc[nH]n1-c1ccccc1 | |
| O=c1[nH]c(=O)c2[nH]cnc2[nH]1.O=c1[nH]c(=O)c2[nH]cnc2[nH]1 | |
| O=C(c1ccccc1)c1coc2ccccc12 | |
| O=C(NCC1CCCN1)c1ccccc1 | |
| C=C1c2ccccc2CCc2ccccc21 | |
| O=c1c2ccccc2oc2ncccc12 | |
| C1=CC(c2ccccc2)C=CN1 | |
| O=C1CC(=O)NC(=O)N1 | |
| c1ccc(Nc2ccnc3ccccc23)cc1 | |
| c1ccc2c(c1)N=C(N1CCNCC1)c1ccccc1O2 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2CCS[C@H]12 | |
| c1ccccc1 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2CCS[C@H]12 | |
| O=C(N[C@H](CCNS(=O)(=O)c1ccccc1)Cc1ccccc1)O[C@H]1CCOC1 | |
| O=c1ccc(-c2ccncc2)c[nH]1 | |
| c1ccc(Nc2c3ccccc3nc3ccccc23)cc1 | |
| O=C1CN2Cc3ccccc3N=C2N1 | |
| c1ccc(Cn2cncn2)cc1 | |
| O=C(N[C@H]1CCCNC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](CCc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)CNC1=O)c1ccc(-c2ccc(-c3ccccc3)cc2)cc1 | |
| c1ccc(CCN2CCC(c3ccccc3)CC2)cc1 | |
| O=C1c2ccccc2C(=O)C1c1ccccc1 | |
| c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | |
| O=c1cc[nH]n1-c1ccccc1 | |
| O=C(OCCN1CCN(c2ccccc2)CC1)c1ccccc1Nc1ccnc2ccccc12 | |
| O=C1CCCCN1c1ccc(N2CCc3cnn(-c4ccccc4)c3C2=O)cc1 | |
| c1ccc2c(c1)C[C@H]1NCCc3cccc-2c31 | |
| c1ccc(NC2=NCCN2)cc1 | |
| O=c1[nH]nc(CN2CCO[C@H](OCc3ccccc3)[C@@H]2c2ccccc2)[nH]1 | |
| c1ccc(NC2Cc3ccccc3C2)cc1 | |
| O=C1CC(=O)NC(=O)N1 | |
| C1CC[C@@H](O[C@H]2CCC[C@@H](O[C@@H]3CCCCO3)C2)OC1 | |
| c1ccc(CCCCNCCc2ccccc2)cc1 | |
| C1CCC(OC2CCC(OC3CCC(OC4CCCOC4)OC3)OC2)OC1 | |
| c1ccc(CCNCCc2ccccc2)cc1 | |
| O=C(CNS(=O)(=O)c1cccc2c1NCCC2)N1CCCCC1 | |
| O=C1CCc2ccc(OCCCCN3CCN(c4ccccc4)CC3)cc2N1 | |
| C1C[C@H]2CCO[C@@H]3OC4CC[C@@H](C1)[C@@]23OO4 | |
| c1ccc2c(c1)Oc1ccccc1C1CNCC21 | |
| c1ccccc1 | |
| c1ccc(CCN2CCC(Nc3nc4ccccc4n3Cc3ccccc3)CC2)cc1 | |
| c1ccc(CCCCNCc2ccc(-c3ccccn3)cc2)cc1 | |
| c1ccccc1 | |
| c1ccc(COc2ccccc2)cc1 | |
| O=C(Nc1ccccc1)c1c[nH]c(-c2ccccc2)c1-c1ccccc1 | |
| O=C1C=C([C@H]2CC[C@H](c3ccccc3)CC2)C(=O)c2ccccc21 | |
| O=C(CC[NH+]1CCc2ccccc2C1Cc1ccccc1)OCCCCCOC(=O)CC[NH+]1CCc2ccccc2C1Cc1ccccc1 | |
| O=C(Cc1ccccc1)O[C@@H]1C[C@@H]2CC[C@H](C1)N2 | |
| C1CCOCC1 | |
| O=C(NCc1ncccn1)c1cnc(N2CCCC2)nc1NCc1ccccc1 | |
| O=c1ncncn1[C@H]1CCCO1 | |
| c1ccc2c(c1)CCc1cccnc1C2=C1CCNCC1 | |
| c1nc(Sc2cnc[nH]2)c2[nH]cnc2n1 | |
| O=c1c2ccccc2c(Cc2ccccc2)nn1C1CCCNCC1 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2CCS[C@H]12 | |
| O=C1C[C@@H](O[C@H]2CCCCO2)C[C@@H](O[C@H]2CCCCO2)CCCCNCCCCO1 | |
| O=C(N[C@@H]1C(=O)N2CCS[C@H]12)[C@H](NC(=O)N1CCNC1=O)c1ccccc1 | |
| N=C(C(=O)N[C@H]1CNC1=O)c1cscn1 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2CCS[C@H]12 | |
| O=C1CNC(=O)CNC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H]2CSC=N2)CCCCN1 | |
| c1ccccc1 | |
| c1ccc(/N=N/c2ccccc2)cc1 | |
| c1ccccc1 | |
| c1ccc([C@@H](Cc2cccc3ccccc23)c2cnc3ccccc3c2)cc1 | |
| O=C1Nc2ccccc2CC[C@@H]1NCCCc1ccccc1 | |
| O=S1(=O)NC(Cc2ccccc2)Nc2ccccc21 | |
| O=C(N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccccc1 | |
| c1ccc(C(O[C@@H]2C[C@@H]3CC[C@H](C2)N3)c2ccccc2)cc1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| c1ccc(CCNCc2ccccc2)cc1 | |
| c1ccc2c(c1)CCN1CCCCC21 | |
| O=S1(=O)N=C(CSCc2ccccc2)Nc2ccccc21 | |
| c1ccc(C(OC2CCNCC2)c2ccccn2)cc1 | |
| c1ccc(CN(CCN2CCCC2)c2ccccc2)cc1 | |
| O=c1ccn(C2CC2)c2cc(N3CCCCCC3)ccc12 | |
| c1ccncc1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2CCC[C@H]21 | |
| c1ccc(CCOCC2CC2)cc1 | |
| c1cn[nH]c1 | |
| c1ccccc1 | |
| c1ccc(CCNCCCOc2ccccc2)cc1 | |
| C=C(c1ccccc1)c1ccc2c(c1)CCCC2 | |
| O=C(NCCc1ccccc1)c1ccccc1 | |
| O=C(CCS(=O)(=O)c1ccccc1)Nc1ccccc1 | |
| c1ccc(-c2ccc(C(c3ccccc3)n3ccnc3)cc2)cc1 | |
| C(=C/C1CCCC1)\CCCc1ccccc1 | |
| O=C1N[C@@H]2CSC[C@@H]2N1 | |
| C1=CC2CC1CC2C(CCN1CCCCC1)c1ccccc1 | |
| c1ccccc1 | |
| O=C(CCCNC(=O)[C@@H](NC(=O)c1ccncn1)[C@@H](OC1OCCCC1OC1CCCCO1)c1cnc[nH]1)NCC(=O)NCCc1nc(-c2nccs2)cs1 | |
| O=C(NCCC1CCC1)[C@H]1NC[C@@H]2C[C@H]12 | |
| O=C(OCCOc1cccc2[nH]ccc12)c1ccccc1 | |
| O=C(NCCc1ccccc1)c1cnccn1 | |
| O=S(=O)(Nc1nc(-c2ncccn2)ncc1Oc1ccccc1)c1ccccc1 | |
| c1ccc(Nc2ccnc3cc(OCCCN4CCNCC4)ccc23)cc1 | |
| c1ccccc1 | |
| c1cnc2cc(NC3=NCCN3)ccc2n1 | |
| O=S1(=O)NCCc2ccsc21 | |
| O=C1CN=C(c2ccccn2)c2ccccc2N1 | |
| O=C(c1ccccc1)c1ccccc1 | |
| O=C(NC1OC2[C@@H]3CCCN3C(=O)CN2C1=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2NC1 | |
| c1ccc(Cc2ccccc2)cc1 | |
| c1ccc(Cc2ccccn2)cc1 | |
| c1ccc(CN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1[C@@H]2CCC2C3OCO[C@@H]3C[C@H]21 | |
| c1ccc(Oc2ccccc2)cc1 | |
| O=C(Nc1ccccc1)C1CCCCN1 | |
| c1ccccc1 | |
| c1cc2c3c(c1)O[C@H]1C4CCC5(CC4)[C@@H](C2)N(CC2CC2)CC[C@]315 | |
| c1ccccc1 | |
| O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2ncccn2)CC1 | |
| O=C1CC(=O)NC(=O)N1 | |
| O=C1CC(=O)NC(=O)N1 | |
| c1ccc(CNCc2cccc3ccccc23)cc1 | |
| O=C1CC(=O)NC(=O)N1 | |
| c1ccc(CCC(Cn2ccnc2)Sc2ccccc2)cc1 | |
| c1ccc2c(c1)C[C@@H]1C3CCCC[C@]23CCN1CC1CCC1 | |
| O=C(CCc1ccccc1)O[C@@H]1C=C2CC(=O)C3CC[C@H]4OCC4[C@H]3[C@H](OC(=O)c3ccccc3)C(C2)C1 | |
| c1cc2c3c(c[nH]c3c1)C[C@H]1NCCC[C@H]21 | |
| O=c1[nH]c(=O)c2[nH]cnc2[nH]1 | |
| C=C1CCCC/C1=C/C=C1\CCCC2CCC[C@@H]12 | |
| C=C1CCCC/C1=C/C=C1\CCCC2[C@@H](C/C=C/CC3CC3)CC[C@@H]12 | |
| C=C1CCCC/C1=C/C=C1\CCCC2CCC[C@@H]12 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| c1ccc(-c2ccc(Cc3cccc([C@H]4CCCCO4)c3)s2)cc1 | |
| c1ccc(-c2nn[nH]n2)c(-c2ccc(Cn3cnc4ccccc43)cc2)c1 | |
| O=C1CCCCCCCC2CCCC(CC(OC3CCCCO3)/C=C\C=C/C=C\C=C/C=C\C=C/C=C\CC(CCCCCC(=O)c3ccccc3)OC(=O)CC(=O)CCC1)O2 | |
| O=C(CCC1(C(=O)NC2CCCCC2)CCCC1)Oc1ccc2c(c1)CCC2 | |
| O=c1ncccn1[C@H]1CCCO1 | |
| C=C1NC(=O)CNC(=O)CNC(=O)CCNC(=O)[C@H]([C@H]2CCN=CN2)NC1=O.C=C1NC(=O)CNC(=O)CNC(=O)CCNC(=O)[C@H]([C@H]2CCN=CN2)NC1=O | |
| C1CCNC1 | |
| C1=Cc2ccccc2Nc2ccccc21 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2CCS[C@H]12 | |
| O=C1CNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)CCCSC[C@@H](C(=O)N2CCCC2)NC(=O)CN1 | |
| c1ccccc1 | |
| S=c1[nH]cc[nH]1 | |
| c1ccc(Cc2ccccn2)cc1 | |
| O=C1O[Pt]OC(=O)C12CCC2 | |
| O=C(CN1CCOCC1)N[C@@H](CCc1ccccc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)C1CO1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCN1CCNCC1 | |
| c1ccc2c(c1)[nH]c1ccccc12 | |
| O=C1CCc2ccccc2N1 | |
| c1ccc(OCCNCCCOc2cccc3[nH]c4ccccc4c23)cc1 | |
| O=C1CCCCNC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](CCc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)CN1 | |
| O=C1C[C@H]2SCC=CN12 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C=CCS[C@H]12 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C=CCS[C@H]12 | |
| O=C(Cc1cccs1)N[C@@H]1C(=O)N2C=CCS[C@H]12 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C=C(CSc3nnn[nH]3)CS[C@H]12 | |
| O=C(Cn1cnnn1)N[C@@H]1C(=O)N2C=C(CSc3nncs3)CS[C@H]12 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=CCS[C@H]12)c1cscn1 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=C(/C=C\c3cncs3)CS[C@H]12)c1cscn1 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=C(C[NH+]3CCCC3)CS[C@H]12)c1cscn1 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=CCS[C@H]12)c1cscn1 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=C(CSc3nnn[nH]3)CS[C@H]12)c1cscn1 | |
| O=C1C[C@H]2SCC(CSc3nnn[nH]3)=CN12 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C=C(CSc3nnn[nH]3)CS[C@H]12 | |
| O=C1NCCN(C(=O)NC(C(=O)N[C@@H]2C(=O)N3C=C(CSc4nnn[nH]4)CS[C@H]23)c2ccccc2)C1=O | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C=C(CSc3nnn[nH]3)CS[C@H]12 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=CCS[C@H]12)c1cscn1 | |
| C=C1SC(C(=O)NC2C(=O)N3C=C(CSc4nnn[nH]4)CS[C@H]23)S1 | |
| O=C(Cc1cscn1)N[C@@H]1C(=O)N2C=C(CSc3nnn[nH]3)CS[C@H]12 | |
| O=C(Cc1cccs1)NC1C(=O)N2C=CCS[C@H]12 | |
| O=C(N[C@@H](C(=O)N[C@@H]1C(=O)N2C=C(CSc3nnn[nH]3)CS[C@H]12)c1ccccc1)c1cccnc1 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=CCS[C@H]12)c1cscn1 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C=CCS[C@H]12 | |
| O=C(CC1=CCC=CC1)N[C@@H]1C(=O)N2C=CCS[C@H]12 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=C(C[n+]3ccccc3)CS[C@H]12)c1cscn1 | |
| C=C(C(=O)N[C@@H]1C(=O)N2C=CCS[C@H]12)c1cscn1 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=CCS[C@H]12)c1cscn1 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=C(CSc3nc(=O)c(=O)[nH][nH]3)CS[C@H]12)c1cscn1 | |
| N=C(C(=O)N[C@@H]1C(=O)N2C=CCS[C@H]12)c1ccco1 | |
| c1ccc(-c2ccnn2-c2ccccc2)cc1 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C=CCS[C@H]12 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C=CCS[C@H]12 | |
| O=C(CSc1ccncc1)N[C@@H]1C(=O)N2C=CCS[C@H]12 | |
| C1CO1 | |
| O=C(CNC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCC(=O)N1)NCCc1ccccc1 | |
| c1ccc(C(c2ccccc2)N2CCNCC2)cc1 | |
| O=C(CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)CCc1ccc2ccccc2c1)NCC(=O)N1CCCC1 | |
| C1O[C@@]2(CS1)CN1CCC2CC1 | |
| c1ccc(Cc2ccccc2)cc1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| C1=Nc2ccccc2C(c2ccccc2)=[NH+]C1 | |
| N=C(NCCCCCCNC(=N)NC(=N)Nc1ccccc1)NC(=N)Nc1ccccc1 | |
| O=C1CCS(=O)(=O)C(c2ccccc2)N1 | |
| c1ccccc1 | |
| c1ccc(CNc2ccccn2)cc1 | |
| c1ccc2ncccc2c1 | |
| O=S1(=O)N=CNc2ccccc21 | |
| C(=C(c1ccccc1)c1ccccc1)c1ccccc1 | |
| c1ccc2ncccc2c1 | |
| c1ccccc1 | |
| c1ccc(Cc2ccccn2)cc1 | |
| c1ccc2c(c1)Nc1ccccc1S2 | |
| c1ccccc1 | |
| C=C1c2ccccc2Sc2ccccc21 | |
| O=C1NC(c2ccccc2)c2ccccc21 | |
| O=c1[nH]c2ccccc2o1 | |
| C=C1CCCC/C1=C/C=C1\CCCC2CCC[C@@H]12 | |
| O=C1C=CC2C(=C1)CC[C@@H]1[C@@H]2CCC2C3OC(C4CCCCC4)O[C@@H]3C[C@H]21 | |
| O=c1cccc(C2CCCCC2)[nH]1 | |
| O=c1nccc[nH]1 | |
| C1CC1 | |
| O=C1[C@@H](NCCCc2ccccc2)CCCN2CCCCN12 | |
| O=C1CCc2cc(OCCCCc3nnnn3C3CCCCC3)ccc2N1 | |
| c1c[nH]cn1 | |
| c1ccc(CCCNCc2cccc3ccccc23)cc1 | |
| C(=C/c1nc(C2CCC2)cs1)\c1ccccc1 | |
| O=C(NC1CCN(CC2CC=CCC2)CC1)c1ccccc1 | |
| C(=Cc1ccccc1)CN1CCN(C(c2ccccc2)c2ccccc2)CC1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| O=c1cn[nH]c2cc3c(cc12)OCO3 | |
| O=c1ccn(C2CC2)c2cc(N3CCNCC3)ccc12 | |
| O=C(NC1CCN(CCCOc2ccccc2)CC1)c1ccccc1 | |
| c1ccc(C2OCc3ccccc32)cc1 | |
| c1ncc2ncn([C@H]3CCCO3)c2n1 | |
| O=C1CCCCOC(=O)C[C@@H](O[C@H]2CCCCO2)C[C@@H](O[C@H]2CCCCO2)CCC1 | |
| C=C1CN2C(=O)C[C@H]2O1 | |
| c1ccc(C(OCC[C@H]2CCCN2)c2ccccc2)cc1 | |
| c1ccccc1 | |
| C1=CC(c2ccccc2)C=CN1 | |
| O=C(OC1C[NH+]2CCC1CC2)C(c1ccccc1)c1ccccc1 | |
| O=C(NC[C@@H]1CCCCO1)[C@@H]1CCCN1 | |
| O=C1CC(=O)N(c2ccccc2)c2ccccc2N1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2CCC[C@H]21 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2CCC[C@H]21 | |
| c1ncc2ncn([C@H]3CCCO3)c2n1 | |
| N=c1cc2n(-c3ccccc3)c3ccccc3nc-2cc1Nc1ccccc1 | |
| c1ccccc1 | |
| C(=C(c1ccccc1)c1ccccc1)c1ccccc1 | |
| c1ccc2c(c1)CCc1ccccc1N2 | |
| O=C1C2=CC3C(=O)C=CC[C@@H]3C[C@@H]2Cc2ccccc21 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| c1ccc(NC2=NCCN2)cc1 | |
| c1ccc(CN2CCc3sccc3C2)cc1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| O=C1CN=C(c2ccccc2)c2ccsc2N1 | |
| c1ccc(C(c2ccccc2)(c2ccccc2)n2ccnc2)cc1 | |
| O=C(N[C@@H]1C(=O)N2CCS[C@H]12)c1conc1-c1ccccc1 | |
| O=C1CN2CCOC2(c2ccccc2)c2ccccc2N1 | |
| c1ccc2c(c1)N=C(N1CCNCC1)c1ccccc1N2 | |
| O=C(O[C@H]1C[C@@H]2CC[C@H](C1)N2)c1ccccc1 | |
| C1=C[C@H]2[C@H]3Cc4cccc5c4[C@@]2(CCN3)[C@H](C1)O5 | |
| O=c1cccc2c(c1)CCCc1ccccc1-2 | |
| C1CO1 | |
| O=C1CCCNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CN1 | |
| O=C1CCCNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CN1 | |
| O=C(Nc1ccc(C(=O)N2CCc3[nH]cnc3-c3ccccc32)cc1)c1ccccc1-c1ccccc1 | |
| c1ccccc1 | |
| O=C(CCC1C[C@H]2N/C1=C\C1=N/C(=C\C3=N/C(=C\C4=NC2CC4)CC3)CC1)NCCO[PH](=O)O[C@@H]1CO[C@H](n2cnc3ccccc32)C1 | |
| O=C(N[C@@H]1C(=O)N2CCS[C@H]12)C1CCCCC1 | |
| O=C(Cc1ccccc1)OC1CCCCC1 | |
| c1ccc(C(c2ccccc2)N2CCNCC2)cc1 | |
| C=C1c2ccccc2C=Cc2ccccc21 | |
| c1ccc(CC2CCCC2)cc1 | |
| O=[PH]1NCCCO1 | |
| O=C1CCON1 | |
| O=C1CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CN1 | |
| O=S1(=O)NC(C2CC3C=CC2C3)Nc2ccccc21 | |
| c1ccc(C(CCN2CCCCC2)C2CCCC2)cc1 | |
| C1=Cc2ccccc2C(=C2CCNCC2)c2ccccc21 | |
| O=C1C=C2C=C[C@@H]3[C@H](CCC4CCC[C@H]43)C2[C@H]2C[C@@H]12 | |
| O=c1ncccn1[C@H]1CCCO1 | |
| O=S(=O)(Nc1cccc(-c2ncsc2-c2ccncn2)c1)c1ccccc1 | |
| c1c[nH]cn1 | |
| O=C1CNC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@@H](NC(=O)c2cc(=O)cc3oc4cccc(C(=O)N[C@H]5COC(=O)CNC(=O)CNC(=O)[C@@H]6CCCN6C(=O)CNC5=O)c4nc2-3)COC(=O)CN1 | |
| c1ccncc1 | |
| O=C1CC/C=C\C=C/CNC(=O)/C=C\CCOC(=O)C2CCCN2C(=O)c2coc(n2)C1 | |
| C1=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)C2Cc2cnoc21 | |
| O=C1CN(N=Cc2ccc(-c3ccccc3)o2)C(=O)N1 | |
| c1ccc(N2CCN(CCc3nnc4n3CCCC4)CC2)cc1 | |
| O=S(=O)(c1ccccc1)c1ccccc1 | |
| c1ccc(C(c2ccccc2)[C@@H]2CCN(CCc3ccc4c(c3)CCO4)C2)cc1 | |
| O=C(N[C@H](CCNS(=O)(=O)c1ccccc1)Cc1ccccc1)O[C@H]1CO[C@H]2OCC[C@@H]12 | |
| O=C(Nc1ccccc1)c1cnc(Nc2cc(N3CCNCC3)ncn2)s1 | |
| O=C1c2ccccc2C(=O)c2cc3c(cc21)CCC[C@@H]3O[C@H]1CCCCO1 | |
| c1ccc2c(c1)CCNC2 | |
| O=c1ncncn1[C@H]1CCCO1 | |
| c1ccc(-c2nc(-c3ccccc3)n(-c3ccccc3)n2)cc1 | |
| O=c1cc[nH]cc1 | |
| O=C(CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)CNC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)CCc1ccc2ccccc2c1)NCC(=O)N1CCCC1 | |
| O=C(c1cc2ccccc2[nH]1)N1CCN(c2ccccn2)CC1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| O=C(NCCCCCCCCCCNC(=O)Oc1ccccc1)Oc1ccccc1 | |
| O=C1C2=CC3C(=O)C=CC[C@@H]3C[C@@H]2Cc2ccccc21 | |
| O=C(O[C@H]1CC[C@H]2C[C@@H]3c4[nH]c5ccccc5c4CCN3C[C@H]2C1)c1ccccc1 | |
| c1ccc2c(c1)CCc1ccccc1N2 | |
| O=C1C=C([C@H]2CCC3C2CC[C@@H]2C4CC[C@H](O[C@H]5CC[C@H](O[C@H]6CC[C@H](O[C@H]7CC[C@H](O[C@H]8CCCCO8)CO7)CO6)CO5)C[C@H]4CC[C@@H]32)CO1 | |
| c1ccc2c(c1)CCc1cccnc1C2=C1CCNCC1 | |
| O=C1CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSSC[C@@H](C(=O)N2CCCC2)NC(=O)CN1 | |
| C=C1CC2CCC[C@H]2[C@@H]2CCC3=CCCC[C@@H]3[C@@H]12 | |
| O=C1C=CC2C(=C1)CC[C@@H]1[C@@H]2CCC2C3OCO[C@@H]3C[C@H]21 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2CCC[C@H]21 | |
| c1ccc(CC2CCCCC2)cc1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2CCC[C@H]21 | |
| c1ccc(Cc2ccccn2)cc1 | |
| c1ccccc1 | |
| c1ccc(Cc2c[nH]cn2)cc1 | |
| c1ccc(C[C@H]2CCCCN2)cc1 | |
| O=C1CN(CCN2CC(=O)NC(=O)C2)CC(=O)N1 | |
| c1ccccc1 | |
| c1ccc2c(c1)C[C@H]1NCC[C@@]23CCCC[C@@H]13 | |
| c1ccc(Oc2ccccc2)cc1 | |
| c1ccc2c(c1)C[C@@H]1CCCCCC2C1 | |
| c1ccccc1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| O=S1(=O)N=CNc2ccccc21 | |
| c1ccc2ncccc2c1 | |
| c1ccccc1 | |
| c1ccc(Nc2ccccc2)cc1 | |
| O=C(N[C@@H]1C(=O)N2CCS[C@H]12)c1conc1-c1ccccc1 | |
| O=c1oc2ccccc2cc1Cc1cc2ccccc2oc1=O | |
| C1CCC(C2CCCCC2)CC1 | |
| O=c1nc[nH]c2c1ncn2[C@H]1CCCO1 | |
| C=C(C(=C)c1ccccc1)c1ccccc1 | |
| C1CNCCN1 | |
| c1ccccc1 | |
| C(=Cc1ccccc1)c1ccccc1 | |
| c1ccc(C2CCN(CCC(c3ccccc3)c3ccccc3)CC2)cc1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2CCC[C@H]21 | |
| c1ccc(-c2ccccc2)cc1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2CCC[C@H]21 | |
| O=C1C=C([C@H]2CCC3C2CC[C@@H]2C4CC[C@H](O[C@H]5CC[C@H](O[C@H]6CC[C@H](O[C@H]7CCCCO7)CO6)CO5)C[C@H]4CC[C@@H]32)CO1 | |
| O=C1C=C([C@H]2CCC3C2CC[C@@H]2C4CC[C@H](O[C@H]5CC[C@H](O[C@H]6CC[C@H](O[C@H]7CCCCO7)CO6)CO5)C[C@H]4CC[C@@H]32)CO1 | |
| c1cc2c3c(c1)O[C@H]1CCC[C@H]4[C@@H](C2)NCC[C@]314 | |
| O=C(NC1OC2[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O)[C@H]1CN[C@@H]2Cc3c[nH]c4cccc(c34)[C@H]2C1 | |
| O=C(NC1OC2[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O)[C@H]1CN[C@@H]2Cc3c[nH]c4cccc(c34)C2C1 | |
| C(/C=C1\CCCC2CCC[C@@H]12)=C1CCCCC1 | |
| O=C(Oc1ccccc1)c1ccco1 | |
| O=C1C[C@H](c2ccccc2)Sc2ccccc2N1 | |
| O=c1[nH]c(=O)c2[n-]cnc2[nH]1.c1ccc(Cc2ccccc2)cc1 | |
| C1=C(Cc2ccccn2)c2ccccc2C1 | |
| O=C1CCCC1 | |
| c1ccc(Cc2ccccc2)cc1 | |
| c1ccc(C(CCCN2CCCCC2)c2ccccc2)cc1 | |
| c1ccc(C2CCN(CCC(c3ccccc3)c3ccccc3)CC2)cc1 | |
| c1ccc(C(OC2CCNCC2)c2ccccc2)cc1 | |
| c1ccccc1 | |
| c1nc(N2CCCCC2)c2ncnc(N3CCCCC3)c2n1 | |
| O=C1C[C@H](O[C@H]2CCCCO2)C[C@@H](O[C@H]2CCCCO2)CCC[C@H]2C[C@@H](CCO1)OCN2 | |
| c1ccc(Cc2ccccn2)cc1 | |
| c1ccc(CCCNCCc2ccccc2)cc1 | |
| O=C(CCc1ccccc1)O[C@@H]1C=C2CC(=O)C3CC[C@H]4OCC4[C@H]3[C@H](OC(=O)c3ccccc3)C(C2)C1 | |
| c1ccc(CCNCCOc2ccccc2)cc1 | |
| O=C(OC1CC2CC3C[C@H](C1)N2CC3=O)c1c[nH]c2ccccc12 | |
| O=c1[nH]c2ccccc2n1CCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1 | |
| O=C1c2ccccc2CC1CC1CCN(Cc2ccccc2)CC1 | |
| c1ccccc1 | |
| O=S1(=O)CCCc2ccsc21 | |
| O=C1NCC(CCN2CCOCC2)C1(c1ccccc1)c1ccccc1 | |
| O=C(C1COc2ccccc2O1)N1CCN(c2ncc3ccccc3n2)CC1 | |
| C=C1c2ccccc2COc2ccccc21 | |
| O=C1c2ccccc2C(=O)c2cc3c(cc21)CCC[C@@H]3O[C@H]1CCCCO1 | |
| O=C1C2=CC3C(=O)C=CC[C@@H]3C[C@@H]2Cc2ccccc21 | |
| c1ccc(Cc2ccccn2)cc1 | |
| C1=C[C@H]2c3ccccc3OC[C@@H]2CC1 | |
| O=C(c1ccccc1)c1coc2ccccc12 | |
| O=C(CCCN1CC=C(n2c(=O)[nH]c3ccccc32)CC1)c1ccccc1 | |
| O=C1C=C2C(CC1)[C@H]1CCC3[C@@H]([C@@H]4C[C@@H]4[C@@]34CCC(=O)O4)[C@@H]1[C@H]1C[C@@H]21 | |
| O=C1CCC2[C@@H](CC[C@H]3[C@@H]4CCCC4CC[C@H]23)C1 | |
| C(=C1\NCCc2ccccc21)\c1ccccc1 | |
| c1ccccc1 | |
| c1csc(COc2cccc3ccccc23)c1 | |
| O=C1C=CC2[C@H]3CCC4[C@@H](C(=O)Nc5ccccc5)CC[C@H]4[C@@H]3CC[C@H]2N1 | |
| O=C(CCN1CCCCC1)c1ccccc1 | |
| O=C1C=C2C=C[C@H]3[C@@H]4CCCC4CC[C@H]3C2CC1 | |
| O=c1[nH]c(=O)c2[nH]cnc2[nH]1 | |
| c1ccc2c(c1)CC[C@H]1CCCCC21 | |
| c1ccc(COC(Cn2ccnc2)c2ccccc2)cc1 | |
| c1ccccc1 | |
| O=C1Nc2ccccc2C(C#CC2CC2)O1 | |
| O=S(=O)(CCc1ccc2[nH]cc(C[C@H]3CCCN3)c2c1)c1ccccc1 | |
| O=C1/C(=N\Nc2cccc(-c3ccccc3)c2)C=NN1c1ccccc1 | |
| c1ccc2[nH]c(N3CCCNCC3)nc2c1 | |
| O=c1ncccn1[C@@H]1CSCO1 | |
| O=C(CNCCCc1ccccc1)N1CCCC1 | |
| O=C(Nc1ccccc1CCC1CCCCN1)c1ccccc1 | |
| O=c1cc[nH]c2nc(N3CCNCC3)ccc12 | |
| C1CCC(OC2CCC(OC3CCC(OC4CCCOC4)OC3)OC2)OC1 | |
| O=C(c1ccccc1)c1c[nH]c(=O)[nH]1 | |
| O=c1[nH]c(=O)c2[nH]cnc2[nH]1 | |
| c1ccccc1 | |
| C=C1CCC[C@@H]1n1cnc2c(=O)nc[nH]c21 | |
| O=C1CN(c2ccccc2)C(=S)N1c1ccccc1 | |
| c1ccccc1 | |
| C1=NCC2c3ccccc3Cc3ccccc3N12 | |
| c1ccccc1 | |
| O=C1c2ccccc2C(=O)c2cc3c(cc21)CCC[C@@H]3O[C@H]1CCCCO1 | |
| O=C1C=C2CC[C@H]3[C@@H]4CC[C@@]5(CCC(=O)O5)C4C[C@H]4O[C@@]34C2CC1 | |
| C=C1C[C@@H]2CCC[C@@H]2O1 | |
| C(=C\c1cncn1Cc1ccccc1)\Cc1cccs1 | |
| C=C1CCCC/C1=C/C=C1\CCCC2CCC[C@@H]12 | |
| C1=C2c3cccc4[nH]cc(c34)C[C@H]2NCC1 | |
| O=C(NC1OC2[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2NC1 | |
| C=C1C[C@@H]2CC[C@@]34C[C@H]5O[C@H]6[C@@H](O3)[C@H]3OC(CC[C@@H]3O[C@H]6[C@H]5O4)CC(=O)C[C@@H]3CCO[C@H]3C[C@H]3O[C@H](CCC3=C)CC[C@@H]1O2 | |
| c1ccc(Nc2ncnc3ccccc23)cc1 | |
| O=C(Nc1ccccc1)[C@@H]1C[C@H](SC2=CN3C(=O)C[C@H]3C2)CN1 | |
| O=C1CCCCOC(=O)C[C@@H](O[C@H]2CCCCO2)C[C@@H](O[C@H]2CCCCO2)CCC1 | |
| c1ccc(C2OCc3ccccc32)cc1 | |
| c1ccccc1 | |
| O=[S@](Cc1ccccn1)c1nc2ccccc2[nH]1 | |
| c1ccc(C2=NCc3nncn3-c3ccccc32)cc1 | |
| c1ccc2c(c1)CC[C@@H]1[C@@H]2CCC2CCC[C@H]21 | |
| c1ccc2c(c1)CC[C@@H]1[C@@H]2CCC2CCC[C@H]21 | |
| c1ccc2c(c1)CC[C@@H]1[C@@H]2CCC2CCC[C@H]21 | |
| O=C1CC[C@@H]2C1CC[C@@H]1c3ccccc3CC[C@H]12 | |
| O=C1CC[C@@H]2C1CC[C@@H]1c3ccccc3CC[C@H]12 | |
| O=C(O[C@H]1c2nccnc2C(=O)N1c1ccccn1)N1CCNCC1 | |
| C1CCCCC1 | |
| c1ccncc1 | |
| c1ccc2c(c1)Nc1ccccc1S2 | |
| O=C1CCC(=O)N1 | |
| O=C1NC(=O)C(c2ccccc2)N1 | |
| c1ccc2scnc2c1 | |
| C1=C[C@H]2[C@H]3Cc4cccc5c4[C@@]2(CCN3)[C@H](C1)O5 | |
| c1ccc2c3c([nH]c2c1)COCC3 | |
| c1ccc(Cn2ccnc2)cc1 | |
| C=C1CC2CCC[C@H]2[C@@H]2CCC3=CC(=O)CC[C@@H]3[C@@H]12 | |
| O=C1OC[C@@H]2[C@H](O[C@H]3CC[C@@H]4OCOC[C@H]4O3)c3cc4c(cc3[C@@H](c3ccccc3)[C@@H]12)OCO4 | |
| c1ccc(-c2cccnc2-c2cccnc2)cc1 | |
| O=C1CC/C=C/CC(=O)CC(CCC2CCCCC2)OC(=O)[C@H]2CCCCN2C(=O)C(=O)C2CCC[C@H](CC/C=C/C=C/C=C/CCC1)O2 | |
| C=C1C[C@@H]2[C@H](CCC3C(=O)CC[C@H]32)C2C=CC(=O)C=C12 | |
| O=C1[C@H](CCCc2ccccc2)[C@@H](c2ccccc2)N1c1ccccc1 | |
| c1ccc(CNc2ccccc2)cc1 | |
| c1ncc2nc[nH]c2n1 | |
| c1cscn1 | |
| c1ccccc1 | |
| C1=CC(c2ccccc2)C=CN1 | |
| c1ccc(C2CC3CCC2C3)cc1 | |
| O=C(c1ccccc1)c1ccccc1 | |
| c1ccc(C2CNCCc3ccccc32)cc1 | |
| c1ccc(Oc2ccccc2)cc1 | |
| c1ccc(CCNCCc2ccccc2)cc1 | |
| c1ccc(CCN2CCC(Nc3ccccc3)CC2)cc1 | |
| c1ccc(Cc2ccccc2)cc1 | |
| c1ccc(CCCCN2CCC(C(c3ccccc3)c3ccccc3)CC2)cc1 | |
| O=C1OCC/C=C/C=C/[C@H](O[C@H]2CCCCO2)C/C=C/CC/C=C/C=C/1CO[C@H]1CC[C@H](OC(=O)c2ccccc2)CO1 | |
| O=C1C=CC2[C@H]3CCC4CCC[C@H]4[C@@H]3CC[C@H]2N1 | |
| c1ccccc1 | |
| O=C(OCCN1CCCCC1)c1cccc2c(=O)cc(-c3ccccc3)oc12 | |
| O=C(NCC1CCCCN1)c1ccccc1 | |
| O=c1ccn([C@H]2CCCO2)c(=O)[nH]1 | |
| O=C(N[C@@H]1C(=O)N2CCS[C@H]12)c1conc1-c1ccccc1 | |
| c1ccc(C(Cn2cncn2)Cn2cncn2)cc1 | |
| O=c1nccc[nH]1 | |
| c1ncc2ncn([C@H]3CCCO3)c2n1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| O=C1C=C2CC[C@@H]3C(CCC4CCC[C@H]43)C2CC1 | |
| O=C1NCc2cncn2-c2ccccc21 | |
| C(=C/c1ccccc1)\CN1CCN(C(c2ccccc2)c2ccccc2)CC1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1[C@@H]2CCC2C3OCO[C@@H]3C[C@H]21 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2C3OCO[C@@H]3C[C@H]21 | |
| O=C1OC2(c3ccccc3Oc3ccccc32)c2ccccc21 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2CCC[C@H]21 | |
| O=c1cc[nH]c(=O)[nH]1 | |
| c1ccc(COc2ccccc2)cc1 | |
| O=C1C=C2CC[C@@H]3C(CCC4CCC[C@H]43)C2CC1 | |
| C1=CC2Sc3ccccc3C(=CCCN3CCNCC3)C2C=C1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCCN1CCNCC1 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4C5OCO[C@@H]5C[C@H]43)C2CC1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| c1ccc(-c2ccccc2)cc1 | |
| O=C1NCN(c2ccccc2)C12CCN(CCCC(c1ccccc1)c1ccccc1)CC2 | |
| c1ccccc1 | |
| c1ccc(-c2c[nH]c3ccccc23)cc1 | |
| c1ccccc1 | |
| c1cn[nH]c1 | |
| c1ccc(-c2nn[nH]n2)c(-c2ccc(Cn3cncn3)cn2)c1 | |
| O=C1C=C2CC[C@H]3[C@@H]4CCC(=O)C4CC[C@@H]3C2CC1 | |
| c1ccc(CCNCCc2ccccc2)cc1 | |
| O=C(N[C@H](CCNS(=O)(=O)c1ccccc1)Cc1ccccc1)O[C@H]1CCOC1 | |
| O=c1nc(CN2CCO[C@H](OCc3ccccc3)[C@@H]2c2ccccc2)[nH][nH]1 | |
| C1CO1 | |
| O=C(C[PH](=O)CCCCc1ccccc1)N1CC[C@@H](C2CCCCC2)C1 | |
| O=C1NC(=O)C(c2ccccc2)(c2ccccc2)N1 | |
| c1ccccc1 | |
| C1CC[C@@H](O[C@@H]2CO[C@@H](O[C@@H]3CCCC[C@H]3O[C@@H]3CCCCO3)C2)OC1 | |
| c1ccc2c3c([nH]c2c1)CCCC3 | |
| c1ccc2c(c1)CCC1[C@@H]2CCC2CCC[C@H]21 | |
| O=C1OCCN1N=Cc1ccco1 | |
| c1ccc(NCc2ccco2)cc1 | |
| C1CCCCC1 | |
| C1CNCCNCCNCCN1 | |
| C1CNCCNCCNCCN1 | |
| c1ccccc1 | |
| C1=C[C@@]23CCNCc4cccc(c42)O[C@H]3CC1 | |
| O=c1nc[nH]c2[nH]cnc12 | |
| O=c1ccn(C2CC2)c2cc(N3CCNCC3)ccc12 | |
| c1ccc(Nc2ncnc3ccc(OCCCN4CCOCC4)cc23)cc1 | |
| O=c1ncccn1[C@H]1CCCO1 | |
| c1ccccc1 | |
| N=C1CCN(c2ccc3c(=O)ccn(C4CC4)c3n2)C1 | |
| C1CCC(OC2CCCC(OC3CCCCO3)C2)OC1 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4CC=C[C@H]43)[C@H]2CC1 | |
| O=C(NN1CC2CCCC2C1)NS(=O)(=O)c1ccccc1 | |
| O=C(NC1CCCCC1)NS(=O)(=O)c1ccc(CCNC(=O)N2CC=CC2=O)cc1 | |
| O=C(NC1CCCCC1)NS(=O)(=O)c1ccc(CCNC(=O)c2cnccn2)cc1 | |
| O=C(NC1CCCCC1)NS(=O)(=O)c1ccc(CCN2C(=O)Cc3ccccc3C2=O)cc1 | |
| O=C(NN1CCCCCC1)NS(=O)(=O)c1ccc(CCNC(=O)c2ccon2)cc1 | |
| C1CCOCC1 | |
| O=C1CCC(c2ccccc2)C(=O)N1 | |
| O=C(NC1CCCCC1)NS(=O)(=O)c1ccc(CCNC(=O)c2ccccc2)cc1 | |
| O=S(=O)(Nc1ncccn1)c1ccccc1 | |
| O=C(OC1CC[NH2+]C1)C(c1ccccc1)C1CCCC1 | |
| O=C(CNC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1)NCC(=O)N1CCCC1 | |
| O=C(CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)NCC(=O)N1CCCC1 | |
| O=C(NC1CC2CCCC(C1)N2)c1n[nH]c2ccccc12 | |
| O=c1ccn(C2CC2)c2cc(N3CCNCC3)ccc12 | |
| O=C1C=C[C@]2(CC1)Oc1ccccc1C2=O | |
| c1ccccc1 | |
| c1ccccc1 | |
| C1CCCNCCC1 | |
| c1ccccc1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| c1ccc2c(c1)ccc1ccccc12 | |
| O=C(CCCN1CCC(c2ccccc2)CC1)c1ccccc1 | |
| c1ccccc1 | |
| O=C1NC(=O)C(C2=CCCCCC2)C(=O)N1 | |
| C1=C[C@H]2[C@H]3Cc4cccc5c4[C@@]2(CCN3)[C@H](C1)O5 | |
| O=C1C[C@@H](c2ccccc2)Oc2ccccc21 | |
| O=C1[C@@H](N2CN[C@H](c3ccccc3)C2=O)[C@H]2SCCN12 | |
| c1ccc(Cc2ccccc2)cc1 | |
| c1ccc2c(c1)-c1ccccc1C2[NH2+]CCCCCC[NH2+]C1c2ccccc2-c2ccccc21 | |
| O=C1NC(=O)C(C2=CCCCC2)C(=O)N1 | |
| O=C(OCCNC1CCCCC1)c1ccccc1 | |
| C1=C[C@]23CCCN2CCc2cc4c(cc2[C@H]3C1)OCO4 | |
| c1ccc2cnncc2c1 | |
| O=S1(=O)NCNc2ccccc21 | |
| O=C1CC[C@H]2[C@H]3Cc4cccc5c4[C@@]2(CCN3)[C@H]1O5 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)C2CC1 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)C2CC1 | |
| O=S1(=O)NCNc2ccccc21 | |
| O=C1CC[C@H]2[C@H]3Cc4cccc5c4[C@@]2(CCN3)[C@H]1O5 | |
| O=C(CCC1C[C@H]2N/C1=C\C1=N/C(=C\C3=N/C(=C\C4=NC2CC4)CC3)CC1)NCCO[PH](=O)O[C@@H]1CO[C@H](n2cnc3ccccc32)C1 | |
| c1ccc2ncccc2c1 | |
| C1CCNC1 | |
| c1ccc(C(c2ccccc2)N2CCNCC2)cc1 | |
| O=C(Cc1ccccc1)O[C@@H]1C[C@@H]2CC[C@H](C1)N2 | |
| c1ccn2nccc2c1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| O=C(CNC(=O)C1CCCN1C(=O)C1CCCN1)N[C@@H](Cc1cccs1)C(=O)NCC(=O)N1Cc2ccccc2CC1C(=O)N1CC[C@@H]2CCCC[C@@H]21 | |
| O=C1c2ccccc2C(=O)c2cc3c(cc21)CCC[C@@H]3O[C@H]1CCCCO1 | |
| O=c1ccn([C@H]2CCCO2)c(=O)[nH]1 | |
| O=[PH]1NCCCO1 | |
| c1ccc(OCCCN2CCC(c3noc4ccccc34)CC2)cc1 | |
| O=C(CCCC=C1CC2CCCC2C1)OCC(=O)c1ccccc1 | |
| O=C(Nc1cccc(Nc2nccc(-c3cccnc3)n2)c1)c1ccc(CN2CCNCC2)cc1 | |
| O=C1C[C@H]2CC=CN12 | |
| c1ccc2c(c1)CCc1ccccc1N2 | |
| c1ccc2c(c1)ncc1nc[nH]c12 | |
| O=c1ccc2c(CCNC3Cc4ccccc4C3)cccc2[nH]1 | |
| O=C(NN1CCc2ccccc21)c1ccccc1 | |
| c1ccc2c(c1)Cc1ccccc1-2 | |
| O=C(N[C@@H]1CCc2ccccc21)[C@@H](CCCN1CCN(Cc2cccnc2)CC1)Cc1ccccc1 | |
| O=C(c1ccccc1)n1ccc2ccccc21 | |
| C1CC[C@@H](O[C@@]2(CO[C@@]3(CO[C@@]4(CO[C@@]5(CO[C@@]6(CO[C@@]7(CO[C@@]8(CO[C@@]9(CO[C@@]%10(CO[C@@]%11(CO[C@@]%12(CO[C@@]%13(CO[C@@]%14(CO[C@@]%15(CO[C@@]%16(CO[C@@]%17(CO[C@@]%18(CO[C@@]%19(CO[C@@]%20(CO[C@@]%21(CO[C@@]%22(CO[C@@]%23(CO[C@@]%24(CO[C@@]%25(CO[C@@]%26(CO[C@@]%27(CO[C@@]%28(CO[C@@]%29(CO[C@@]%30(CO[C@@]%31(CO[C@@]%32(CO[C@@]%33(CO[C@@]%34(CO[C@@]%35(CO[C@@]%36(CO[C@@]%37(COC%38CCCO%38)CCCO%37)CCCO%36)CCCO%35)CCCO%34)CCCO%33)CCCO%32)CCCO%31)CCCO%30)CCCO%29)CCCO%28)CCCO%27)CCCO%26)CCCO%25)CCCO%24)CCCO%23)CCCO%22)CCCO%21)CCCO%20)CCCO%19)CCCO%18)CCCO%17)CCCO%16)CCCO%15)CCCO%14)CCCO%13)CCCO%12)CCCO%11)CCCO%10)CCCO9)CCCO8)CCCO7)CCCO6)CCCO5)CCCO4)CCCO3)CCCO2)OC1 | |
| c1ccccc1 | |
| O=C(CCCCC(=O)Nc1ccccc1)Nc1ccccc1 | |
| c1ccc(NCCCNc2ccccc2)cc1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| O=C1N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C=NC12CCCC2 | |
| O=C1Cc2cc3n(c(=O)c2CO1)Cc1cc2cc(OC(=O)N4CCC(N5CCCCC5)CC4)ccc2nc1-3 | |
| O=C(NNCc1ccccc1)c1ccon1 | |
| c1ccccc1 | |
| c1ccncc1 | |
| c1ccc(Cc2ccccc2)cc1 | |
| c1ccccc1 | |
| c1ccc2c(c1)Nc1ncccc1S2 | |
| C1=CCCCC1 | |
| C1=CC(c2cccc3nonc23)C=CN1 | |
| O=c1[nH]ncn1-c1ccc(N2CCN(c3ccc(OC[C@H]4CO[C@](Cn5cncn5)(c5ccccc5)O4)cc3)CC2)cc1 | |
| O=C(Nc1ccccc1)c1c[nH]c2ccccc2c1=O | |
| O=C1O[C@H]2C[C@@H](C/C=C/[C@@H](O[C@H]3CC[C@@H](O[C@H]4CCCCO4)CO3)C/C=C/C=C3\CO[C@@H]4CC=C[C@@H]1C34)O[C@@]1(CCCCO1)C2.O=C1O[C@H]2C[C@@H](CC=C[C@@H](O[C@H]3CC[C@@H](O[C@H]4CCCCO4)CO3)C/C=C/C=C3\CO[C@@H]4CC=C[C@@H]1C34)O[C@@]1(CCCCO1)C2 | |
| O=C1CCCCCCC2O[C@H]2C[C@@H](C=Cc2cscn2)NC(=O)CCC1 | |
| O=C1CCC[C@@H](O[C@H]2CC[C@H](O[C@H]3CCCCO3)CO2)CCCC/C=C/C=C/CCO1 | |
| C1CC[C@@H](O[C@H]2CCC[C@@H](O[C@@H]3CCCCO3)C2)OC1 | |
| O=C1CCCCC1c1ccccc1 | |
| O=C1CN2C(=O)C=COC2(c2ccccc2)c2ccccc2N1 | |
| c1ccc(C2(Cn3ccnc3)OCC(COc3ccc(N4CCNCC4)cc3)O2)cc1 | |
| O=C(c1ccccc1)c1ccccc1 | |
| O=C(c1ccccc1)c1ccc2n1CCC2 | |
| O=C1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | |
| c1c[nH]cn1 | |
| c1ccccc1 | |
| C1CCNC1 | |
| c1ccc2[nH]ccc2c1 | |
| c1ccccc1 | |
| c1ccc(CCCNCCc2ccccc2)cc1 | |
| c1ccccc1 | |
| C1CC[C@H](O[C@H]2CCOC2)OC1 | |
| O=c1ncccn1[C@@H]1CSCO1 | |
| c1ccc(-c2cncnn2)cc1 | |
| O=S(Cc1ccccn1)c1nc2ccccc2[nH]1 | |
| c1ccc(COc2ccc(Nc3ncnc4ccc(-c5ccco5)cc34)cc2)cc1 | |
| O=C(Cc1ccccc1)NC1C(=O)N2C=C(CSc3nnn[nH]3)CO[C@H]12 | |
| c1ccc(CCCCCC2CCCC2)cc1 | |
| O=C(Nc1ccccc1)c1cnoc1 | |
| O=C1CCC(N2Cc3ccccc3C2=O)C(=O)N1 | |
| O=C(OCCNCCC(c1ccccc1)c1ccccc1)C1=CNC=CC1c1ccccc1 | |
| c1ccc(C(c2ccccc2)n2cncn2)cc1 | |
| O=c1nc[nH]c2c1NC(CNc1ccccc1)CN2 | |
| c1ccc2c(c1)C[C@H]1NCC[C@@]23CCCC[C@@H]13 | |
| c1ccc([C@H]2CN3CCSC3=N2)cc1 | |
| O=C1CCCN1 | |
| O=C1CCCc2ccccc21 | |
| O=C(Nc1ccccc1)[C@@H]1CCCCN1 | |
| c1ccc(C2CCC(N3CCC(c4ccccc4)CC3)CC2)cc1 | |
| c1ccccc1 | |
| O=c1ccn2c3c(c(N4CCNCC4)ccc13)OCC2 | |
| c1ccc(C2CC2)cc1 | |
| c1ccccc1 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)[C@H]2CC1 | |
| c1ccc2c(c1)C[C@H]1NCC[C@@]23CCCC[C@@H]13 | |
| O=C1CCC(c2ccccc2)=NN1 | |
| c1ccc(Oc2ccccc2)cc1 | |
| c1ccccc1 | |
| O=C1CNC(=O)[C@@H]2CSSC[C@@H]3NC(=O)CCSSC[C@H](NC(=O)[C@H](CSSC[C@@H](C(=O)NCCc4ccccc4)NC(=O)CN1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC3=O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)NCC(=O)N2 | |
| O=c1[nH]c2nc(N3CCCCC3)[nH]c2c(=O)n1Cc1ncc2ccccc2n1 | |
| O=C(NC[C@@H]1CCCCO1)C1CCCN1 | |
| C1CCCCC1 | |
| O=C1OCCN1c1ccc(N2CCOCC2)cc1 | |
| c1ccc(Oc2ccccc2)cc1 | |
| c1ccc(Oc2ccccc2)cc1.c1ccc(Oc2ccccc2)cc1 | |
| c1ccccc1 | |
| O=C(CNCCCc1ccccc1)N1CCCC1 | |
| C1=C2c3cccc4[nH]cc(c34)C[C@H]2NCC1 | |
| c1ccc(OCC2=NCCN2)cc1 | |
| O=c1cc[nH]c2cc(N3CCNCC3)ccc12 | |
| C1CCCCC1 | |
| c1ccc(C2CCN(CCC(c3ccccc3)c3ccccc3)CC2)cc1 | |
| O=C(COc1ccccc1)N[C@H](CC[C@H](Cc1ccccc1)NC(=O)CN1CCCNC1=O)Cc1ccccc1 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C=CCC[C@H]12 | |
| c1ccc2c(c1)CCc1cccnc1C2=C1CCNCC1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| O=C1C(=CNc2ccccn2)NS(=O)(=O)c2ccsc21 | |
| c1ccc(-c2nn[nH]n2)c(-c2ccc(Cn3ccnc3)cc2)c1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1[C@@H]2CCC2CCC[C@H]21 | |
| O=C1CCC[C@@H](CC[C@H]2CC=CC3=CCCC[C@@H]32)O1 | |
| c1ccc2c(c1)N=C(N1CCNCC1)c1ccccc1O2 | |
| O=C1C[C@H]2CCCO[C@@H]2C1 | |
| O=c1c2ccccc2sc2ccccc12 | |
| C(=C1c2ccccc2-c2ccccc21)c1ccccc1 | |
| c1ccc(Nc2ccccc2)cc1 | |
| O=C1[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2C(=O)N1C[C@@H]1CCCC[C@H]1CN1CCN(c2nsc3ccccc23)CC1 | |
| O=C1C2=CC3C(=O)C=CC[C@@H]3C[C@@H]2Cc2ccccc21 | |
| c1ccc2c(c1)C1CCC2c2ccccc21 | |
| O=C(N[C@@H](CCN1[C@H]2CC[C@@H]1CC(n1cnnc1)C2)c1ccccc1)C1CCCCC1 | |
| c1ccc(CCCCc2ccccc2)cc1 | |
| c1ccc(C2c3ccccc3C3=NCCN32)cc1 | |
| O=C(c1ccccc1)c1ccc2nc[nH]c2c1 | |
| C1CC2CCC1C2 | |
| c1ccc(CN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)C2CC1 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)C2CC1 | |
| c1ccc2c(CC3CCCCN3)ccnc2c1 | |
| O=C1C=C2C=C[C@@H]3[C@H](CCC4CCC[C@H]43)C2CC1 | |
| c1ccc2[nH]ccc2c1 | |
| O=C(Nc1nccs1)C1=Cc2ccccc2S(=O)(=O)N1 | |
| c1ccccc1 | |
| C1C2CC3CC1CC(C2)C3 | |
| O=C1C=CC(=O)c2ccccc21 | |
| C1CCCCC1 | |
| O=C(OC1CCC[NH2+]C1)C(c1ccccc1)c1ccccc1 | |
| c1ccc(C2CCNCC2)cc1 | |
| c1ccccc1 | |
| O=C1NC(=O)C(c2ccccc2)N1 | |
| O=C(Nc1ccccc1)C1CCCCN1 | |
| c1ccc(CNc2ccccn2)cc1 | |
| c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | |
| S=c1nc[nH]c2nc[nH]c12 | |
| O=C1C[C@H]2CC(S[C@H]3CCNC3)=CN12 | |
| c1ccccc1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCC1CCCCN1 | |
| c1ccc2c(c1)CC[C@@H]1[C@@H]2CCC2CCC[C@H]21 | |
| c1ccccc1 | |
| O=C1NCC(COc2ccccc2)O1 | |
| C=C1c2ccccc2C(=O)C2=CC3C(=O)CC(=O)C[C@@H]3C[C@H]12 | |
| c1ccc(Cc2ccccc2)cc1 | |
| c1ccccc1 | |
| c1ccc2c(c1)Cc1ccccc1O2 | |
| O=C1CC(=O)NC(=O)N1 | |
| N=c1[nH]ncs1 | |
| c1ccc2c(c1)Sc1ccccc1N2CC1CCNC1 | |
| S=c1[nH]cc[nH]1 | |
| c1ccccc1 | |
| O=C1CC(=O)NC(=O)N1 | |
| c1ccc(NCc2cnc3ncncc3n2)cc1 | |
| c1ccc2c(c1)Nc1ccccc1S2 | |
| c1ccccc1 | |
| O=c1ccc2cc3ccoc3cc2o1 | |
| O=C1CC(c2ccccc2)C(=O)N1 | |
| O=S1(=O)NCNc2ccccc21 | |
| c1ccccc1 | |
| C1=C2c3cccc4[nH]cc(c34)C[C@H]2NCC1 | |
| O=C1CCC2[C@H]3Cc4cccc5c4[C@@]2(CC[NH+]3CC2CC2)[C@H]1O5 | |
| c1ccc(CC2CCCCN2)cc1 | |
| O=C1NC(=O)C(c2ccccc2)C(=O)N1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1[C@@H]2CCC2CCC[C@H]21 | |
| O=C(Cc1ccccc1)OC1C[C@@H]2[NH2+][C@@H](C1)C1OC12 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)C2CC1 | |
| O=C1CCNC(=O)C1 | |
| C1=C2c3cccc4[nH]cc(c34)C[C@H]2NCC1 | |
| O=C(N[C@@H]1C(=O)N2CCS[C@H]12)c1ccccc1 | |
| c1ccccc1 | |
| c1ccc2c(c1)Sc1ccccc1C2CC1CCCNC1 | |
| c1ccccc1 | |
| c1cc2cc(c1)Oc1ccc3c(c1)[C@H](Cc1ccc(cc1)Oc1cccc4c1[C@@H](C2)[NH2+]CC4)[NH2+]CC3 | |
| O=C1c2ccccc2NCN1c1ccccc1 | |
| c1ccccc1 | |
| O=C(N[C@@H]1CCCOC1)c1ccccc1 | |
| c1c[nH]cn1 | |
| O=C(Cc1cccnc1)c1cccnc1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| O=C(N[C@@H]1C(=O)N2CCS[C@H]12)[C@H](NC(=O)N1CCNC1=O)c1ccccc1 | |
| c1ccc2c(c1)Cc1ccccc1N1CCNCC21 | |
| O=C(N[C@H]1CCCNC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](CCc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)CNC1=O)c1ccc(-c2cc(-c3ccccc3)on2)cc1 | |
| c1ccc(COC(Cn2ccnc2)c2ccccc2)cc1 | |
| c1ccc(C2=NCc3cncn3-c3ccccc32)cc1 | |
| c1ccccc1 | |
| O=C1C=C2CC[C@@H]3C(=C2CC1)[C@@H](c1ccccc1)CC1CCC[C@H]13 | |
| C1CCNCC1 | |
| C1CCNCC1 | |
| c1ccc(C2CC2)cc1 | |
| O=c1ccc(-c2ccncc2)c[nH]1 | |
| O=c1cc[nH]cc1 | |
| c1ccc(-c2ccc(NCCN3CCOCC3)nn2)cc1 | |
| O=C1C2=CC3C(=O)C=CC[C@@H]3C[C@@H]2Cc2ccccc21 | |
| c1cc(N2CCCCC2)nc[nH+]1 | |
| O=C(Cc1cscn1)Nc1ccc(CCNCCc2ccccc2)cc1 | |
| c1ccc2c(c1)Cc1cccnc1N1CCNCC21 | |
| O=C1CCCC1 | |
| O=C(CCCc1ccccc1)N1CC2CCCCC2C1 | |
| O=C1C=CC(=O)C2=C1CC1[C@H]3N[C@H]3CN21 | |
| c1ccc(Cc2ccccc2)cc1 | |
| O=C1c2ccccc2C(=O)c2ccccc21 | |
| O=C(CC/C=C/CCC(=O)OCCC[NH+]1CCc2ccccc2[C@H]1Cc1ccccc1)OCCC[NH+]1CCc2ccccc2[C@H]1Cc1ccccc1 | |
| O=C(NCCN1CCOCC1)c1ccccc1 | |
| c1ccc(Cc2ccccc2)cc1 | |
| O=C(CNCCCc1ccccc1)N1CCc2ccccc2C1 | |
| O=C1c2cc[nH]c2CCC1CN1CCOCC1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2CCC[C@H]21 | |
| c1ccc(COc2ccccc2)cc1 | |
| C(=C/c1ccc2ccccc2n1)\c1cccc([C@@H](CCc2ccccc2)SCC2CC2)c1 | |
| O=C(CCN1CCOCC1)N1c2ccccc2Sc2ccccc21 | |
| C1=C[C@H]2[C@H]3Cc4cccc5c4[C@@]2(CCN3)[C@H](C1)O5 | |
| O=c1ccn(C2CC2)c2cc(N3C[C@@H]4CCCN[C@@H]4C3)ccc12 | |
| C1COC[C@H](C[C@H]2CO2)C1 | |
| O=C1CC[C@H]2COc3ccccc3[C@@H]2C1 | |
| c1ccc2ccccc2c1 | |
| O=[PH](OC[C@@H]1CC[C@H](N2C=CCC=C2)O1)O[PH](=O)OC[C@@H]1CC[C@H](n2cnc3cncnc32)O1 | |
| c1ccc2c(c1)CCCC2 | |
| O=C(CNC(=O)C(Cc1ccc2ccccc2c1)NC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1c[nH]cn1)NC(=O)C1CCC(=O)N1)NCC(=O)N1CCCC1 | |
| O=C(N[C@@H]1C(=O)N2CCS[C@H]12)c1cccc2ccccc12 | |
| C(=Cc1ccccc1)CNCc1cccc2ccccc12 | |
| c1cc2c3c(c1)O[C@H]1CCCC4[C@@H](C2)N(CC2CCC2)CC[C@@]341 | |
| O=C1CCC2[C@H]3Cc4cccc5c4[C@@]2(CCN3)[C@H]1O5 | |
| O=C1CCC2[C@H]3Cc4cccc5c4[C@@]2(CCN3CC2CC2)[C@H]1O5 | |
| c1ccc2c(CC3=NCCN3)cccc2c1 | |
| c1ccc2ccccc2c1 | |
| c1ccc2c(C3CCNCC3)c[nH]c2c1 | |
| O=C1/C=C/[C@H]2O[C@@H]2CCCC2CCC[C@H](C[C@@H](OC3CCCCO3)/C=C/C=C/C=C/C=C/CCO1)O2 | |
| O=C(NCCc1ccccc1)C1CCCCC1 | |
| c1ccc2c(c1)CCC(CCNCCC1CCc3ccccc3O1)O2 | |
| O=c1cc[nH]c2cc3occc(=O)c3cc12 | |
| O=c1n(CCOc2ccccc2)cnn1CCCN1CCN(c2ccccc2)CC1 | |
| c1ncc2ncn([C@H]3CCCO3)c2n1 | |
| O=C(N[C@H](CCN1CC[C@@H]2CCCC[C@@H]2C1)CSc1ccccc1)c1ccccc1 | |
| C1CC[C@@H](O[C@@H]2CO[C@@H](O[C@@H]3CCCC[C@H]3O[C@@H]3CCCCO3)C2)OC1 | |
| c1ccccc1 | |
| O=C(c1ccccc1)c1ccccc1 | |
| C1=CO[C@H](O[C@@H]2CCC[C@H](O[C@@H]3CCCCO3)C2)CC1 | |
| O=C1Nc2cccnc2N(C2CC2)c2ncccc21 | |
| c1ccncc1 | |
| O=C(OCCNCc1ccccc1)C1=CNC=CC1c1ccccc1 | |
| O=C(OC[C@H]1CN[C@@H]2Cc3c[nH]c4cccc(c34)C2C1)c1cccnc1 | |
| O=C(Nc1ccccc1)c1ccccc1 | |
| c1cncc(C2CCCN2)c1 | |
| C1=CC(c2ccccc2)C=CN1 | |
| O=C(Nc1cccc(-n2ccnc2)c1)c1cccc(Nc2nccc(-c3cccnc3)n2)c1 | |
| O=C1CNC(=O)N1c1ccccc1 | |
| C1=CC(c2ccccc2)C=CN1 | |
| C1=CC(c2ccccc2)C=CN1 | |
| C1=CC(c2ccccc2)C=CN1 | |
| O=C(Nc1nccs1)c1ccccc1 | |
| O=C1CCCC(=O)C1C(=O)c1ccccc1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| C1=CC(c2ccccc2)C=CN1 | |
| O=C1CN(/N=C\c2ccco2)C(=O)N1 | |
| c1ccoc1 | |
| c1ccc2ncccc2c1 | |
| c1cscn1 | |
| c1ccccc1 | |
| N=C1C=C2CCC3C4CCCC4CCC3C2CC1 | |
| c1ccccc1 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)[C@H]2CC1 | |
| O=c1cc[nH]c2cc(N3CCNCC3)ccc12 | |
| N=C1C=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)[C@H]2CC1 | |
| C=C1c2ccccc2CCc2ccccc21 | |
| O=C(Nc1cc2ccc(O[C@H]3CCCCO3)cc2oc1=O)c1ccccc1 | |
| O=C1CCCCCCCCCCCC(=O)OCCCC/C=C/C=C/CC/C=C/C=C/C=C/C=C/C(OC2CCCCO2)CCCCC1 | |
| O=C1CNC(=O)CNC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)CCc2ccccc2)CSSCCN1 | |
| O=c1ccn2c3c(c(N4CCNCC4)ccc13)OCC2 | |
| c1ccc2c(c1)N=C(N1CCNCC1)c1ccsc1N2 | |
| c1ccc(-c2nnn[nH]2)c(-c2ccc(Cn3ccnc3)cc2)c1 | |
| C=C1c2ccccc2COc2ccccc21 | |
| c1ccc(/N=N/c2ccccc2)cc1 | |
| O=S(Cc1ccccn1)c1nc2ccccc2[nH]1 | |
| O=C1c2c([nH]c3ccccc23)CCC1Cn1ccnc1 | |
| c1ccccc1 | |
| O=C1CCO1 | |
| c1ccc(Cc2ccccc2)cc1 | |
| C1=CCCCC1 | |
| C(=C(c1ccccc1)c1ccccc1)c1ccccc1 | |
| O=C1C=C([C@H]2CCC3C2CC[C@@H]2C4CC[C@H](O[C@H]5CCCCO5)CC4CC[C@@H]32)CO1 | |
| O=C(N[C@@H]1C(=O)N2CCS[C@H]12)c1conc1-c1ccccc1 | |
| O=C1O[Pt]2(N[C@@H]3CCCC[C@H]3N2)OC1=O | |
| c1ccc2c(c1)CCCN2 | |
| O=C1C[C@@H]2CC[C@@H]3[C@H](CCC4CCC[C@H]43)C2CO1 | |
| c1ccc(-c2ncoc2-c2ccccc2)cc1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| O=C1Cc2ccccc2Nc2ccccc21 | |
| c1ccc(CO/N=C(/Cn2ccnc2)c2ccccc2)cc1 | |
| c1ccc2[nH]ccc2c1 | |
| c1ccccc1 | |
| O=c1[nH]c(=O)c2[n-]cnc2[nH]1 | |
| O=C(c1ccccc1)c1ccccc1 | |
| c1ccccc1 | |
| c1ccc(CC2CCCCC2)cc1 | |
| O=C1CCC2[C@H]3Cc4cccc5c4[C@@]2(CCN3)[C@H]1O5 | |
| c1ccc(CC2=NCCN2)cc1 | |
| O=C1CCC2[C@H]3Cc4cccc5c4[C@@]2(CCN3)[C@H]1O5 | |
| O=C(OCC1=NCCCN1)C(c1ccccc1)C1CCCCC1 | |
| c1ccc(CC2CCCCC2)cc1 | |
| O=C1C2=CC3C(=O)C=CC[C@@H]3C[C@@H]2Cc2ccccc21 | |
| O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)O[C@@H]1C=C2CC(=O)C3CC[C@H]4OCC4[C@H]3[C@H](OC(=O)c3ccccc3)C(C2)C1 | |
| O=c1c(CCN2CCC(c3noc4ccccc34)CC2)cnc2n1CCCC2 | |
| O=C1c2cccc3c2[C@@H](CCC3)CN1[C@@H]1CN2CCC1CC2 | |
| C1CC[NH+]([C@@H]2CC[C@@H]3CC[C@H]4[C@@H]5C[C@H]([NH+]6CCCCC6)CC5CC[C@@H]4C3C2)CC1 | |
| O=S(Cc1ccccn1)c1nc2ccccc2[nH]1 | |
| c1ccc(Cc2nccc3ccccc23)cc1 | |
| O=C1COC(=O)N1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1[C@@H]2CCC2CCC[C@H]21 | |
| c1ccccc1 | |
| C(/C=C1\CCCC2CCC[C@@H]12)=C1CCCCC1 | |
| C1CC[C@@H](O[C@@H]2CO[C@@H](O[C@@H]3CCCC[C@H]3O[C@@H]3CCCCO3)C2)OC1 | |
| c1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | |
| c1ccc(Nc2nccc(Nc3ccc4c[nH]nc4c3)n2)cc1 | |
| O=c1cc[nH]c2cc(N3CCNCC3)ccc12 | |
| O=c1nc[nH]c2[nH]cc(CCc3ccccc3)c12 | |
| O=c1c(-c2nn[nH]n2)cnc2ccccn12 | |
| c1ccc(C2CCCC2)cc1 | |
| O=c1nc[nH]c2[nH]cnc12 | |
| O=C(CCc1c[nH]c2ccccc12)NCC(=O)NCC(=O)NCCc1ccccc1 | |
| c1ccc(OCCCCCOc2ccccc2)cc1 | |
| c1ccc2c(c1)C[C@@H]1CC2CCN1 | |
| O=C1CC(=O)NC(=O)N1 | |
| C(CC[NH+]1CCCC1)CC[NH+]1CCCC1 | |
| C1=Nc2c(ncn2[C@H]2CCCO2)CCN1 | |
| O=c1[nH]c(=O)c2[nH]cnc2[nH]1 | |
| c1cc2c3c(c[nH]c3c1)C[C@H]1NCCC[C@H]21 | |
| C1CCC(C(CC2CCCCN2)C2CCCCC2)CC1 | |
| C1CC[C@@H]2NCC[C@@H]2C1 | |
| O=C(OCc1cccc(Oc2ccccc2)c1)C1CC1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCCN1CCNCC1 | |
| c1ccccc1 | |
| c1ccc(/N=N/c2cccnc2)cc1 | |
| c1ccc(C2CNCCO2)cc1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| c1ccc(C2C3=C(CCNC3)c3ccccc32)cc1 | |
| O=C1c2ccccc2C(=O)C1c1ccccc1 | |
| c1ccc(Cc2ccccn2)cc1 | |
| c1ccc(C2CNCCO2)cc1 | |
| O=C1NC(=O)C(c2ccccc2)C(=O)N1 | |
| c1ccccc1 | |
| c1ccc(CNCCOc2ccccc2)cc1 | |
| O=c1oc2ccccc2cc1Cc1ccccc1 | |
| O=C1CC(c2ccccc2)C(=O)N1 | |
| c1ccccc1 | |
| c1ccc(N(CC2=NCCN2)c2ccccc2)cc1 | |
| O=C1CC(=O)N(c2ccccc2)N1c1ccccc1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| O=C1NC(=O)C(c2ccccc2)(c2ccccc2)N1 | |
| c1ccc2c(c1)N[C@H]1NCCC21 | |
| O=C1C=CC(=O)c2ccccc21 | |
| O=C1OC2CC1C1CC3O[C@]34C(=O)O[C@H]2C14.O=C1OC2CC1C1C[C@H]3O[C@]34C(=O)O[C@H]2C14 | |
| O=C1C[C@@H](Cc2cnc[nH]2)CO1 | |
| O=C1C/C=C\CCCC[C@@H]2CCCC(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@H](C=CC2CCCCC2)CCC1 | |
| O=c1[nH]c2ccccc2n1C1CCN(CCCC(c2ccccc2)c2ccccc2)CC1 | |
| c1ccc2[nH]ccc2c1 | |
| O=C1NC(=O)C(Cc2ccc(OCCc3ccccn3)cc2)S1 | |
| O=C(OCCOCCN1CCCCC1)N1c2ccccc2Sc2cccnc21 | |
| C1CN([C@@H]2CC[C@@H]3CC[C@H]4[C@@H]5C[C@H](N6CC[NH2+]CC6)CC5CC[C@@H]4C3C2)CC[NH2+]1 | |
| O=C1NCCN(C(=O)N[C@@H](C(=O)N[C@@H]2C(=O)N3CCS[C@H]23)c2ccccc2)C1=O | |
| C1CNCCN1 | |
| C1CNCCN1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCCN1CCCCC1 | |
| c1ccncc1 | |
| O=C1Nc2cccnc2N(C(=O)CN2CCNCC2)c2ccccc21 | |
| O=C(Nc1ccccn1)C1=Cc2ccccc2S(=O)(=O)N1 | |
| c1ccc(-c2cc(C3CC3)nc3ccccc23)cc1 | |
| O=C(Cc1ccccc1)N[C@@H]1C(=O)N2CCS[C@H]12 | |
| O=C1[C@@H](N=CN2CCCCCC2)[C@H]2SCCN12 | |
| c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1 | |
| O=C1c2cc3ccc(O[C@H]4C[C@@H](O[C@H]5CCCCO5)CCO4)cc3cc2CC[C@@H]1O[C@H]1C[C@@H](O[C@H]2C[C@@H](O[C@H]3CCCCO3)CCO2)CCO1 | |
| O=C1OC[C@@H]2Cc3cc4c(cc3[C@@H](c3ccccc3)[C@@H]12)OCO4 | |
| O=S1(=O)NCNc2ccccc21 | |
| O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)N1 | |
| O=C(Nc1ccc(CN2CCNCC2)cc1)c1cccc(C#Cc2cnc3cccnn23)c1 | |
| O=c1[nH]ncn1-c1ccc(N2CCN(c3ccc(OCC4CO[C@@](Cn5cncn5)(c5ccccc5)C4)cc3)CC2)cc1 | |
| c1ccccc1 | |
| c1ccc(CCc2cnc3ncncc3n2)cc1 | |
| c1cc[nH+]cc1 | |
| c1nc2c(s1)CCCC2 | |
| O=C(Nc1ccc2c(=O)cc(-c3nn[nH]n3)oc2c1)c1ccc(OCCCCc2ccccc2)cc1 | |
| O=C(C1CC1)C(c1ccccc1)N1CCc2sccc2C1 | |
| C1=CC2=CCCC[C@@H]2CC1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1CC1CC1 | |
| O=C(C1CCCCC1)N1CC(=O)N2CCc3ccccc3C2C1 | |
| O=C(c1ccco1)N1CCN(c2ncc3ccccc3n2)CC1 | |
| O=C1C=CC2C(=C1)CCC1C3CCCC3CCC21 | |
| O=C1C=CC2C(=C1)CC[C@@H]1[C@@H]2CCC2CCC[C@H]21 | |
| O=C1C=CC2C(=C1)CC[C@@H]1[C@@H]2C(=O)CC2CCC[C@H]21 | |
| c1ccccc1 | |
| c1ccc2ncccc2c1 | |
| O=C1NCNC(=O)C1c1ccccc1 | |
| c1ccccc1 | |
| c1ccc(SCSc2ccccc2)cc1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| O=c1ccc2ccccc2[nH]1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCCN1CCNCC1 | |
| c1ccc(C(CCN2CCCC2)C2CCCCC2)cc1 | |
| c1ccc2nc3ccccc3cc2c1 | |
| O=C1C=CC=CC1=Cc1ccccc1 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)C2CC1 | |
| c1ccccc1 | |
| c1ccc2c(c1)Nc1ccccc1S2 | |
| c1ccc2c(c1)Nc1ccccc1S2 | |
| O=C(CCc1ccccc1)c1ccccc1 | |
| c1ccc2c(c1)Cc1ccccc1O2 | |
| c1ccccc1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCCN1CCCCC1 | |
| c1ccc2c(c1)Nc1ccccc1S2 | |
| c1ccccc1 | |
| c1ccc(CCc2ccccc2)cc1 | |
| c1ccc2ccccc2c1 | |
| C1CCCCC1 | |
| O=c1cc[nH]c(=S)[nH]1 | |
| C1=Cc2ccccc2Cc2ccccc21 | |
| c1ccccc1 | |
| c1cnccn1 | |
| c1cc[nH+]cc1 | |
| c1ccncc1 | |
| c1ccncc1 | |
| c1ccc(-c2cncnc2)cc1 | |
| S=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| c1ccc2c(c1)N=C(N1CCNCC1)c1ccccc1S2 | |
| c1ccc2nc3ccccc3cc2c1 | |
| O=C(CNCCCc1ccccc1)N1CCc2ccccc2C1 | |
| c1cc2c(cc1OC1CCCC1)CC[C@@H]1[C@@H]2CCC2CCC[C@H]21 | |
| O=C1NCNc2ccccc21 | |
| c1ccc2c(C[C@H]3CC4CCN3CC4)ccnc2c1 | |
| c1ccc2c(C[C@@H]3CC4CCN3CC4)ccnc2c1 | |
| O=C(N[C@H]1COC(=O)[C@H](c2ccccc2)NC(=O)C2CC(=O)C(CS[C@@H]3CN4CCC3CC4)CN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)CNC1=O)c1ccccn1 | |
| O=S(Cc1ccccn1)c1nc2ccccc2[nH]1 | |
| O=C(c1ccc(OCCN2CCCCC2)cc1)c1c(-c2ccccc2)sc2ccccc12 | |
| O=c1nc[nH]c2ccc(CNc3cccs3)cc12 | |
| c1cc2c(c3c1CCC3)CCO2 | |
| O=C(CNCCCc1ccccc1)N1CC[C@@H]2CCC[C@@H]21 | |
| c1ccoc1 | |
| O=C(CN1CCN(CCCOc2ccccc2)CC1)Nc1ccccc1 | |
| c1ccc2c(c1)CCC2 | |
| c1ccc(O[C@@H](c2ccccc2)[C@@H]2CNCCO2)cc1 | |
| c1cnn(-c2ncc3ncn([C@H]4CCCO4)c3n2)c1 | |
| O=C(Nc1ccccc1)Nc1ccc(Oc2ccncc2)cc1 | |
| c1ccc(NC2CCNCC2)cc1 | |
| O=C(CCc1ccccc1)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCC1CC1)CC1CCCCC1 | |
| O=C(NC[C@@H]1CCCN1)c1ccccc1 | |
| O=C(Cc1ccccc1)NCc1ccccc1N1CCCCC1 | |
| O=C(C=Cc1ccccc1)O[C@H]1CC[C@H]2C[C@@H]3c4[nH]c5ccccc5c4CCN3C[C@H]2C1 | |
| O=C(O[C@H]1CC[C@H]2C[C@@H]3c4[nH]c5ccccc5c4CCN3C[C@H]2C1)c1ccccc1 | |
| O=C(CSC1C[C@@H]2CC[C@H](C1)N2)O[C@@H]1CCCC[C@@]23CCCC1[C@@H]2C(=O)CC3 | |
| c1ncn([C@H]2CCCO2)n1 | |
| O=c1nc2[nH]c3ccccc3nc-2c(=O)[nH]1 | |
| N=C(c1ccccc1)c1cccnc1 | |
| O=C1/C=C\C=C\CCCCCCCC/C=C/OC2Oc3ccc4c(c3C2=O)C2=NC3(CCNCC3)NC2=C(N1)C4=O | |
| O=C1/C=C\C=C\CCCCCCCC/C=C/OC2Oc3ccc4cc(c(/C=N/N5CCNCC5)cc4c3C2=O)N1 | |
| O=C1/C=C\C=C\CCCCCCCC/C=C/OC2Oc3ccc4cc(c(/C=N/N5CCN(C6CCCC6)CC5)cc4c3C2=O)N1 | |
| O=C1/C=C\C=C\CCCCCCCC/C=C/OC2Oc3ccc4cc(c5c(nc6ccccn65)c4c3C2=O)N1 | |
| c1ccc(Nc2ccnc(Nc3ccccc3)n2)cc1 | |
| c1ccc2scnc2c1 | |
| C1C2CC3CC1CC(C2)C3 | |
| O=C1C=CC2C(=C1)CCC1C3CCCC3CCC21 | |
| O=C(NN1CCCCC1)c1cc(-c2ccccc2)n(-c2ccccc2)n1 | |
| c1ccncc1 | |
| O=c1c(CCN2CCC(c3noc4ccccc34)CC2)cnc2n1CCCC2 | |
| c1ccc(CCNCCc2ccccc2)cc1 | |
| O=C(CNC(=O)NCc1cscn1)N[C@H](CC[C@H](Cc1ccccc1)NC(=O)OCc1cncs1)Cc1ccccc1 | |
| O=C(NC[C@H]1CN(c2ccc(N3CCOCC3=O)cc2)C(=O)O1)c1cccs1 | |
| c1ccccc1 | |
| c1ncn(Cc2ccc3[nH]ccc3c2)n1 | |
| C1CC[NH+]([C@@H]2CC3CC[C@@H]4C5C[C@H](N6CCOCC6)CC[C@@H]5CC[C@H]4[C@@H]3C2)C1 | |
| O=C(Nc1ccncc1)c1cccc(OCC2CC2)c1 | |
| O=C(NCN1CCCC1)C1=CC[C@@H]2C[C@@H]3Cc4ccccc4C(=O)C3=CC2C1=O | |
| O=C1Cc2ccccc2N1 | |
| O=C(Nc1ccccc1)[C@@H]1CCCCN1 | |
| O=C1NC(=O)C(Cc2ccc(OCCNc3ccccn3)cc2)S1 | |
| O=c1cc[nH]c2cc(-c3ccncc3)ccc12 | |
| c1ccc(-c2ccncn2)cc1 | |
| c1csc(CCNC2CCc3ccccc3C2)c1 | |
| N=C1CCCCOC(=O)C[C@@H](O[C@H]2CCCCO2)C[C@@H](O[C@H]2CCCCO2)CCC1 | |
| c1ccc(Cn2ccnn2)cc1 | |
| c1nc(-c2cnn(CC3CCCC3)c2)c2cc[nH]c2n1 | |
| c1ncc2ncn([C@H]3CCCO3)c2n1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| c1ccccc1 | |
| c1ccc(CCCCOCCCCCCNCCc2ccccc2)cc1 | |
| O=C(Oc1ccccc1)c1ccccc1 | |
| c1ccc(-c2cc3cc(Cn4cnc(C5CC5)c4)ccc3o2)cc1 | |
| O=C(CNC(=O)c1ccc2ccccc2n1)N[C@H](CCN1CCC2CCCCC2C1)Cc1ccccc1 | |
| O=C(CC12CC3CC(CC(C3)C1)C2)N1CC[C@@H]2C[C@@H]21 | |
| O=C(Cc1ccccc1)O[C@H]1C[C@@H]2N[C@H](C1)[C@H]1O[C@@H]21 | |
| O=C1CC(=O)NC(=O)N1 | |
| c1ccccc1 | |
| c1ccc(C(Cn2ccnc2)OCc2csc3ccccc23)cc1 | |
| O=C1NCCN1CCN1CCC(c2cn(-c3ccccc3)c3ccccc23)CC1 | |
| c1ccc([C@@H]2CCCc3ccccc32)cc1 | |
| C1CO1 | |
| c1ccc(C2CCC2)cc1 | |
| O=c1nc(-c2cccc(S(=O)(=O)N3CCNCC3)c2)[nH]c2cn[nH]c12 | |
| c1ccc(OCCNCCc2ccc3c(c2)CCN3)cc1 | |
| O=C1CCC[C@@H](CC[C@H]2CC=CC3=CCCC[C@@H]32)O1 | |
| O=C1CC/C=C/CC(=O)C[C@@H](CCC2CCCCC2)OC(=O)[C@@H]2CCCCN2C(=O)C(=O)C2CCC[C@@H](CC/C=C/C=C/C=C/CCC1)O2 | |
| O=C(CCCc1ccccc1)N1CCn2cnnc2C1 | |
| O=C(Cc1ccc2c(c1)OCO2)c1sccc1S(=O)(=O)Nc1ccno1 | |
| O=C(O[C@H]1CN2CCC1CC2)N1CCc2ccccc2[C@@H]1c1ccccc1 | |
| O=C(Nc1ccccc1)Nc1ccc(Oc2ccncc2)cc1 | |
| c1ccccc1 | |
| O=c1ccn(C2CC2)c2cc(N3CCNCC3)ccc12 | |
| O=C1CCO[C@H]2O[C@@H]3CCCC[C@H]3OC12 | |
| O=C1C[C@@H]2C(=C[C@@H]3[C@H]2C=C[C@@H]2C[C@@H](OC4CCCCC4)C[C@@H]32)C(=O)C[C@@H](O[C@H]2CCCCO2)CCCCO1 | |
| O=C(CNCCCc1ccccc1)N1CCC2(C1)SCCS2 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4[C@H]3CC[C@@]43CCC(=O)O3)C2CC1 | |
| c1[nH]nc2c1CC1C(CCC3C4CCCC4CCC13)C2 | |
| O=c1ccn([C@H]2C=CCO2)c(=O)[nH]1 | |
| c1ccsc1 | |
| C1CCC(O[C@@H]2OCC[C@H]2O[C@H]2CCCCO2)CC1 | |
| C1CCOCC1 | |
| C1CC[C@H](OC2CCCO2)OC1 | |
| c1ccc(NC2CCN(CCc3cccs3)CC2)cc1 | |
| c1ccccc1 | |
| O=c1nc(NS(=O)(=O)c2ccccc2)cc[nH]1 | |
| O=S(=O)(Nc1ncccn1)c1ccccc1 | |
| O=S(=O)(Nc1ccncn1)c1ccccc1 | |
| O=S(=O)(Nc1ccncn1)c1ccccc1 | |
| O=S(=O)(Nc1ncccn1)c1ccccc1 | |
| O=S(=O)(Nc1ncccn1)c1ccccc1 | |
| O=S(=O)(Nc1nncs1)c1ccccc1 | |
| O=S(=O)(Nc1ccon1)c1ccccc1 | |
| O=S(=O)(Nc1cnccn1)c1ccccc1 | |
| O=S(=O)(Nc1ncco1)c1ccccc1 | |
| c1ccccc1 | |
| O=S(=O)(Nc1ccnn1-c1ccccc1)c1ccccc1 | |
| O=S(=O)(Nc1ccccn1)c1ccccc1 | |
| O=S(=O)(Nc1ccccn1)c1ccc(/N=N/c2ccccc2)cc1 | |
| O=S(=O)(Nc1nccs1)c1ccccc1 | |
| O=C1C(CCS(=O)c2ccccc2)C(=O)N(c2ccccc2)N1c1ccccc1 | |
| O=S(=O)(Nc1ccno1)c1ccccc1 | |
| O=S(=O)(c1ccccc1)c1ccccc1 | |
| C1=Cc2ccccc2/C1=C\c1ccccc1 | |
| O=C(NCC1CCCN1)c1ccccc1 | |
| c1ccc2[nH]ccc2c1 | |
| O=C1Nc2ccccc2/C1=C/c1ccc[nH]1 | |
| O=C(c1ccccc1)c1cccs1 | |
| O=C(Nc1cccc(C(=O)Nc2cccc(C(=O)Nc3cccc4ccccc34)c2)c1)Nc1cccc(C(=O)Nc2cccc(C(=O)Nc3cccc4ccccc34)c2)c1 | |
| c1ccc2nc3c(cc2c1)CCCC3 | |
| O=C1C/C=C/CCCC[C@@H]2CCCC(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@H](C=CC2CCCCC2)CCC1 | |
| O=C1NCC(=O)N2[C@@H]1Cc1c([nH]c3ccccc13)[C@H]2c1ccc2c(c1)OCO2 | |
| C(=C/C1CCCC1)\CCOc1ccccc1 | |
| O=C1CC(=O)NC(=O)N1 | |
| O=C(Nc1ccc2c(c1)CCCC2)c1ccccc1 | |
| C(=C(c1ccccc1)c1ccccc1)c1ccccc1 | |
| c1ccc(CCNCCOc2ccccc2)cc1 | |
| c1ccccc1 | |
| O=C1CCc2cncnc2N1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 | |
| C(#Cc1ccccn1)c1ccc2c(c1)CCCS2 | |
| O=C1C[C@@H]2N1CC(Cn1ccnn1)S2(=O)=O | |
| O=C(CNC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)CNC(=O)[C@@H](NC(=O)c1cnccn1)C1CCCCC1)C(=O)NC1CC1 | |
| O=C1CCc2ccc(cc2)Oc2cc3cc(c2O[C@@H]2OCCC[C@H]2O[C@H]2CCCCO2)Oc2ccc(cc2)C[C@@H]2NC(=O)[C@H](NC(=O)[C@@H]3NC(=O)CN1)c1cccc(c1)-c1ccccc1CNC2=O | |
| O=c1ccn([C@@H]2CCCO2)c(=O)[nH]1 | |
| O=C1CC(=O)OCC2OC(=O)N(CCCCn3cnc(-c4cccnc4)c3)[C@@H]2CC(=O)CCC[C@H](O[C@H]2CCCCO2)C1 | |
| c1ccc(-c2ccc(Cn3cnc4ccc(-c5nc6ccccc6[nH]5)cc43)cc2)cc1 | |
| O=C1CN=C(c2ccccc2)c2ccccc2N1 | |
| O=c1[nH]nnc2cncn12 | |
| O=C1CC/C=C/CC(=O)C[C@@H](CCC2CCCCC2)OC(=O)[C@@H]2CCCCN2C(=O)C(=O)C2CCC[C@@H](CC/C=C/C=C/C=C/CCC1)O2 | |
| O=C1OC[C@@H]2[C@H](O[C@H]3CC[C@@H]4OC(c5cccs5)OC[C@H]4O3)c3cc4c(cc3[C@@H](c3ccccc3)[C@@H]12)OCO4 | |
| c1ncc2nc[nH]c2n1 | |
| O=C1C(=CNc2ccccn2)NS(=O)(=O)c2ccsc21 | |
| O=C(C1CCCO1)N1CCN(c2ncc3ccccc3n2)CC1 | |
| c1ccc2ccccc2c1 | |
| c1ccccc1 | |
| c1ccc([C@@]2(Cn3cncn3)OC[C@H](COc3ccc(N4CCNCC4)cc3)O2)cc1 | |
| c1ccc(CCCCN2CCC(C(c3ccccc3)c3ccccc3)CC2)cc1 | |
| O=C1CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSSC[C@@H](C(=O)N2CCCC2)NC(=O)CN1 | |
| O=C1C=CC2C(=C1)CC[C@H]1[C@@H]3CCC(=O)OC3CC[C@H]21 | |
| O=C1C=C2CC[C@@H]3[C@H](CCC4CCC[C@H]43)C2CC1 | |
| O=C1CCN2CCc3ccccc3C2C1 | |
| O=C1C2=CC3C(=O)C=CC[C@@H]3C[C@@H]2Cc2ccccc21 | |
| O=c1nc[nH]c2c1NCCN2 | |
| O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)N1 | |
| O=c1[nH]c(=O)c2[nH]cnc2[nH]1 | |
| O=c1[nH]c(=O)c2[nH]cnc2[nH]1 | |
| c1ccc2[nH]c(-c3cscn3)nc2c1 | |
| c1ncc(C[n+]2ccsc2)cn1 | |
| O=C1CC(=O)NC(=S)N1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCCN1CCNCC1 | |
| S=c1nc[nH]c2nc[nH]c12 | |
| O=C1CC(=O)NC(=S)N1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCCN1CCNCC1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCC1CCCCN1 | |
| S=P(N1CC1)(N1CC1)N1CC1 | |
| C(CCN1CCNCC1)=C1c2ccccc2Sc2ccccc21 | |
| C(CCN1CCCCC1)=C(c1cccs1)c1cccs1 | |
| c1ccc([C@@H]2C[C@H]2Nc2ncnc3c2nnn3C2CCCC2)cc1 | |
| O=C(Cc1ccsc1)N[C@@H]1C(=O)N2CCS[C@H]12 | |
| c1ccc(CN2CCc3sccc3C2)cc1 | |
| O=C1C2=CC3C(=O)C=CC[C@@H]3C[C@@H]2Cc2ccccc21 | |
| c1ccccc1 | |
| c1nsnc1N1CCOCC1 | |
| c1c[nH]cn1 | |
| c1ccc(C(Cn2ccnc2)OCc2ccsc2)cc1 | |
| O=C(OC1C[C@@H]2[NH2+][C@H](C1)[C@@H]1O[C@H]21)C(c1cccs1)c1cccs1 | |
| O=C1CC(CCc2ccccc2)OC=C1Cc1cccc(NS(=O)(=O)c2ccccn2)c1 | |
| c1ccc(OCCCCC2CCNCC2)cc1 | |
| c1cc(NC2=NCCN2)c2nsnc2c1 | |
| C1CC[C@@H](O[C@H]2CCC[C@@H](O[C@@H]3CCCCO3)C2)OC1 | |
| c1ccccc1 | |
| C1=NN=C(c2ccccc2)c2ccccc2C1 | |
| O=C(NN1CCCCCC1)NS(=O)(=O)c1ccccc1 | |
| c1ccc(CC2=NCCN2)cc1 | |
| c1ccccc1 | |
| O=C(c1ccccc1)c1ccccc1 | |
| O=C(c1ccccc1)c1ccc[nH]1 | |
| S=C(Nc1ccccc1)Oc1ccc2ccccc2c1 | |
| c1ccc(Cc2ccccc2)cc1 | |
| O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1 | |
| C1OC2OC[C@H]3OCO[C@H]3[C@@H]2O1 | |
| O=C1Cc2cc3n(c(=O)c2CO1)Cc1cc2ccccc2nc1-3 | |
| c1ccc(Nc2ccncc2)cc1 | |
| C(=C(c1ccccc1)c1ccccc1)c1ccccc1 | |
| O=C1OC[C@H]2c3c(ccc4c3OCO4)[C@@H](SC[C@]13NCCc1ccccc13)[C@H]1[C@@H]3N[C@@H](Cc4ccccc43)CN21 | |
| c1ccc(C2CCCCC2)cc1 | |
| O=c1cc2c(c(Nc3ccccc3)[nH]1)c(=O)n(C1CC1)c(=O)n2-c1ccccc1 | |
| O=C(CNCCCc1ccccc1)N1CC[C@H]2CCCC[C@@H]21 | |
| c1ccc(C2CC2)cc1 | |
| C(=C/C1CCCC1)\CCOc1ccccc1 | |
| O=c1n(CCCN2CCN(c3ccccc3)CC2)nc2ccccn12 | |
| c1ccc2c(c1)C[C@@H]1CCC[C@@H]1C2 | |
| C1=CCCCC1 | |
| O=C1C=CC2C(=C1)CC[C@@H]1C2CCC2CCC[C@H]21 | |
| c1ccc(-c2cnc3ncncc3n2)cc1 | |
| c1ccc(C2=NCc3nncn3-c3ccccc32)cc1 | |
| O=S1(=O)NCNc2ccccc21 | |
| c1ccc(CC2CCCCC2)cc1 | |
| c1ccc2c(c1)Sc1ccccc1N2CCCN1CCNCC1 | |
| c1ccc2c(c1)Nc1ccccc1S2 | |
| O=c1ccn([C@H]2CCCO2)c(=O)[nH]1 | |
| c1ccc(C(CCN2CCCCC2)C2CCCCC2)cc1 | |
| C1=C[C@H]2O[C@]23CC[C@@H]2[C@H](CCC4CCC[C@H]42)C3C1 | |
| c1ccc2c(c1)Nc1ccccc1S2 | |
| O=C1COC(=O)N1 | |
| O=C1N(Cc2ccccc2)C2C[S+]3CCCC3C2N1Cc1ccccc1 | |
| O=C(NCc1ccccc1)c1ccccc1 | |
| c1ccc(Cc2cncnc2)cc1 | |
| c1ccc(NCc2ccc3ncncc3c2)cc1 | |
| c1ccc2c(c1)CCc1ccccc1N2 | |
| O=c1ccc2cc3ccoc3cc2o1 | |
| c1ccc(CNc2ccccn2)cc1 | |
| C(\CN1CCCC1)=C(\c1ccccc1)c1ccccn1 | |
| c1ccccc1.c1ccccc1.c1ccccc1 | |
| O=C1C[C@@H](O[C@H]2CCCCO2)C[C@@H](O[C@H]2CCCCO2)CC[C@@]2(CO2)C(=O)CCCCO1 | |
| O=C(Cc1ccccc1)NCc1ccncc1 | |
| O=C(OC1CC2CCC(C1)[N+]21CCCC1)C(c1ccccc1)c1ccccc1 | |
| O=c1ccn(-c2ccccc2)c2nc(N3C[C@H]4C[C@H]4C3)ccc12 | |
| c1cc2cc(c1)Oc1ccc3c(c1)[C@H](Cc1ccc(cc1)Oc1cccc4c1[C@@H](C2)[NH2+]CC4)NCC3 | |
| c1ccc(OCC2=NCCN2)cc1 | |
| O=c1nc(-c2cccc(S(=O)(=O)NCCC3CCCN3)c2)[nH]c2cn[nH]c12 | |
| O=c1nc[nH]c2[nH]cnc12 | |
| O=c1nc[nH]c2[nH]cnc12 | |
| O=C1c2ccccc2C(=O)c2cc3c(cc21)CCC[C@@H]3OC1CCCCO1 | |
| c1ccc(-c2ccccc2-c2nn[nH]n2)cc1 | |
| O=C1CCc2ccc(cc2)Oc2cc3cc(c2O[C@@H]2OCCC[C@H]2O[C@H]2CCCCO2)Oc2ccc(cc2)C[C@@H]2NC(=O)[C@H](NC(=O)[C@@H]3NC(=O)CN1)c1cccc(c1)-c1ccccc1CNC2=O | |
| c1ccc(Nc2ncnc3cc(OCC4CCNCC4)ccc23)cc1 | |
| O=C1CNC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(Cc2ccccc2)NC(=O)C(NC(=O)CCc2ccccc2)CSSCC(C(=O)NCCc2cc3ccccc3[nH]2)NC(=O)CN1 | |
| O=c1nc(-c2cccc(S(=O)(=O)N3CCNCC3)c2)[nH]n2cncc12 | |
| c1cnc2cc3c(cc2n1)[C@H]1CNC[C@@H]3C1 | |
| C1CCN([C@@H]2CC[C@@H]3CC[C@H]4[C@@H]5C[C@H]([NH+]6CCCCC6)CC5CC[C@@H]4C3C2)CC1 | |
| O=C(c1ccccc1)c1c[nH]c2ncc(-c3ccccc3)cc12 | |
| c1ccc(CC2CCCCC2)cc1 | |
| c1ccc(CCCCNCCc2ccccc2)cc1 | |
| C1=CCC2C(=C1)c1cc3ccc(cc4ccc(cc5ccc(cc2n1)[nH]5)n4)[nH]3 | |
| c1ncc2ncn([C@H]3CCCO3)c2n1 | |
| c1ccc2c(CCCCN3CCN(c4ccc5occc5c4)CC3)c[nH]c2c1 | |
| O=C(CNC12CC3CC(CC(C3)C1)C2)N1CCCC1 | |
| C1=CC2CC[C@@H]3Nc4ccc(C5C[C@H]6CCCN(CCc7c5[nH]c5ccccc75)C6)cc4[C@@]34CCN(C1)[C@@H]24 | |
| C1=CC2CC[C@@H]3Nc4ccc(C5C[C@H]6CCCN(CCc7c5[nH]c5ccccc75)C6)cc4[C@@]34CCN(C1)[C@@H]24 | |
| C1=CC2CC[C@@H]3Nc4ccc(C5C[C@H]6CCCN(CCc7c5[nH]c5ccccc75)C6)cc4[C@@]34CCN(C1)[C@@H]24 | |
| C1=C[C@H]2CC(c3ccc4c(c3)[C@@]35CCN6CC=CC(CC[C@@H]3N4)[C@H]65)c3[nH]c4ccccc4c3CN(C1)C2 | |
| O=C(Nc1cccc(-c2ccccn2)c1)c1ccccc1 | |
| C=C1CN[C@@H]2Cc3c([nH]c4ccccc34)[C@@H](c3ccc4c5c([nH]c4c3)C3C[C@@H]4CC[C@@H]3N(CC5)C4)C[C@@H]1C2 | |
| C1CCCCC1 | |
| c1ccc(C(Cc2ccncn2)Cn2cncn2)cc1 | |
| c1ccccc1 | |
| O=c1oc2ccccc2cc1Cc1ccccc1 | |
| C1=CC(/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C2=CCCCC2)CCC1 | |
| O=C(NCc1ccccc1)[C@@H]1CCN1C(=O)CC1CCCCC1 | |
| c1ccc(CC2=NCCN2)cc1 | |
| c1ccc2c3c([nH]c2c1)[C@@H]1C[C@@H]2CCCC[C@H]2CN1CC3 | |
| O=C(Nc1ccc2[nH]cc(Cc3ccc(C(=O)NS(=O)(=O)c4ccccc4)cc3)c2c1)OC1CCCC1 | |
| O=c1ncccn1[C@H]1CCCO1 | |
| c1ccc(-c2ccnc3ccnn23)cc1 | |
| C1=COCCC1 | |
| O=c1ccn([C@H]2CCCO2)c(=O)[nH]1 | |
| c1ccc2sccc2c1 | |
| O=C1Cc2cc(CCN3CCN(c4nsc5ccccc45)CC3)ccc2N1 | |
| c1c[nH]cn1 | |
| O=C1N[C@@H](Cc2ccc3[nH]ccc3c2)CO1 | |
| c1ccc(-c2cn3ccccc3n2)cc1 | |
| c1ccc2oncc2c1 | |
| O=C(OC1c2nccnc2C(=O)N1c1ccccn1)N1CCNCC1 | |
| C(CCN1CCNCC1)=C1c2ccccc2Sc2ccccc21 |
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