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528 SMILES Strings for Beta-2 adrenergic receptor

Compound NameSMILES String
BDBM25748 OC(CNCCNC(=O)Nc1ccccc1)COc1ccccc1C#N
BDBM25749 CC(C)NCC(O)COc1ccc(NC(C)=O)cc1
BDBM25753 CC(C)NCC(O)COc1ccc(CC(N)=O)cc1
BDBM25392 CC(C)NCC(O)c1ccc(O)c(O)c1
BDBM25756 COCCc1ccc(OCC(O)CNC(C)C)cc1
BDBM25758 CC(CCc1ccccc1)NCC(O)c1ccc(O)c(c1)C(N)=O
BDBM25760 CC(C)NCC(O)c1ccc2ccccc2c1
BDBM25761 CC(C)NCC(O)COc1cccc2ccccc12
BDBM25762 CC(C)NCC(O)c1ccc(NS(C)(=O)=O)cc1
BDBM25769 CC(C)(C)NCC(O)c1ccc(O)c(CO)c1
BDBM25770 CC(C)(C)NCC(O)c1cc(O)cc(O)c1
BDBM25771 OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc1ccccc1
BDBM29525 Cn1cc(C(=O)OCC2CCN(CCNS(C)(=O)=O)CC2)c2ccccc12
BDBM27958 CC(C)(C)NCC(O)c1cc(Cl)c(N)c(Cl)c1
BDBM50773 COc1ccccc1N1CCN(CC(O)COc2cccc3ccccc23)CC1
BDBM55121 NCCc1ccc(O)c(O)c1
BDBM60973 CC(C)NC[C@@H](O)COc1cccc2ccccc12
BDBM82481 COc1cc(CC2NCCc3c(F)c(O)c(O)cc23)cc(OC)c1OC
BDBM82482 COc1cc(C[C@@H]2NCCc3cc(O)c(O)c(F)c23)cc(OC)c1OC
BDBM82483 COc1cc(C[C@H]2NCCc3cc(O)c(O)cc23)cc(OC)c1OC
BDBM82484 COc1cc(CC2NCCc3cc(O)c(O)cc23)cc(I)c1OC
BDBM82486 COc1cc(CC2N(C)CCc3cc(O)c(O)cc23)cc(OC)c1OC
BDBM82487 COc1c(I)cc(CC2NCCc3cc(O)c(O)cc23)cc1I
BDBM82488 COc1cc(CC2NCCc3c(I)c(O)c(O)cc23)cc(OC)c1OC
BDBM82489 COc1cc(CC2=NCCc3cc(O)c(O)cc23)cc(OC)c1OC |t:6|
BDBM82490 COc1cc(CC2N(CCO)CCc3cc(O)c(O)cc23)cc(OC)c1OC
BDBM82491 COc1cc(CC2NCCc3cc(O)c(O)cc23)cc(c1OC)[N+]([O-])=O
BDBM82492 COc1cc(CC2N(Cc3cccc(Cl)c3)CCc3cc(O)c(O)cc23)cc(OC)c1OC
BDBM82493 COc1cc(CC2NCCc3cc(O)c(O)c(F)c23)cc(OC)c1OC
BDBM82495 COc1cc(CC2N(Cc3ccc(Cl)c(Cl)c3)CCc3cc(O)c(O)cc23)cc(OC)c1OC
BDBM82496 COc1cc(CC2N(Cc3cccc(c3)[N+]([O-])=O)CCc3cc(O)c(O)cc23)cc(OC)c1OC
BDBM82497 COc1cc(C[C@H]2NCCc3cc(O)c(O)c(F)c23)cc(OC)c1OC
BDBM82498 COc1cc(CC2NCCc3c(F)c(O)c(O)c(F)c23)cc(OC)c1OC
BDBM82499 COc1cc(CC2N(Cc3cccc(N)c3)CCc3cc(O)c(O)cc23)cc(OC)c1OC
BDBM82500 COc1cc(CC2NCCc3cc(O)c(O)cc23)cc(N)c1OC
BDBM82501 COc1cc(CC2NCCc3cc(O)c(O)cc23)cc2OS(=O)Oc12
BDBM82502 COc1cc(CC2NCCc3cc(O)c(O)c(I)c23)cc(OC)c1OC
BDBM82503 COc1cc(C[C@@H]2NCCc3cc(O)c(O)cc23)cc(OC)c1OC
BDBM82504 COc1cc(CC2NCCc3c2cc(O)c(O)c3C(F)(F)F)cc(OC)c1OC
BDBM81886 CC(C)CNCC(O)COc1cccc2ccccc12
BDBM81447 CCCc1ccccc1OCC(O)CNC(C)C
BDBM86453 COc1ccc(CC(C)NCC(O)c2ccc(O)c(NC=O)c2)cc1
BDBM92679 CC(C)NCC(O)c1cccc(O)c1
BDBM92680 CC(C)NCC(O)c1ccc(O)cc1
BDBM50404987 CC(C)(C)NC[C@H](O)COc1ccc(cc1)-c1nc(c[nH]1)C(F)(F)F |r|
BDBM50405407 COc1ccc(CCNC[C@H](O)COc2ccc(Cc3nc(c[nH]3)C(C)=O)cc2)cc1OC
BDBM50002150 Brc1cnc(N2CCNCC2)c2nccn12
BDBM50002151 C1CN(CCN1)c1nccn2ccnc12
BDBM50002152 Cc1cn2ccnc2c(n1)N1CCNCC1
BDBM50001897 Clc1ccc(cc1)N1CCNCC1
BDBM50001862 COc1ccccc1N1CCNCC1
BDBM50001898 C1CN(CCN1)c1ccccc1
BDBM50001899 CC(=O)c1ccc(cc1)N1CCNCC1
BDBM50001900 CS(=O)(=O)Nc1ccc(NCC2CN(CCN2)c2ccccc2)cc1
BDBM50001894 CS(=O)(=O)Nc1ccc(NCC2CNCCN2c2ccccc2)cc1
BDBM50001895 CS(=O)(=O)Nc1ccc(OCC2CN(CCN2)c2ccccc2)cc1
BDBM50001896 O=C(NCC1CN(CCN1)c1ccccc1)c1ccccc1
BDBM50001901 Clc1ccccc1N1CCNCC1
BDBM50001902 CS(=O)(=O)Nc1ccc(cc1)C(=O)NCC1CNCCN1c1ccccc1
BDBM50001903 Cc1ccccc1N1CCNCC1
BDBM50002133 C[C@H](Cc1ccc(OCC(O)=O)cc1)NC[C@H](O)c1cccc(Cl)c1
BDBM50001904 Cc1cccc(c1)N1CCNCC1
BDBM50001905 COc1cccc(c1)N1CCNC(CNC(=O)c2ccc(NS(C)(=O)=O)cc2)C1
BDBM50001906 COc1ccccc1N1CCNC(CNC(=O)c2ccc(NS(C)(=O)=O)cc2)C1
BDBM50001907 O=C(NCC1CN(CCN1)c1ccccc1)c1ccc(cc1)-n1ccnc1
BDBM50001908 [O-][N+](=O)c1ccc(cc1)N1CCNCC1
BDBM50001909 CS(=O)(=O)Nc1ccc(CNCC2CN(CCN2)c2ccccc2)cc1
BDBM50002139 Cc1cnc2c(nccn12)N1CCNCC1
BDBM50001910 CN(c1ccc(cc1)C(=O)NCC1CN(CCN1)c1ccccc1)S(C)(=O)=O
BDBM50001911 Cc1ccc(cc1)N1CCNCC1
BDBM50001912 CS(=O)(=O)Nc1ccc(cc1)C(=O)NCC1CN(CCN1)c1ccccc1
BDBM50002141 CC1CN=C2N1C=CN=C2N1CCNCC1 |c:3,7,9|
BDBM50002142 Cc1cnc(N2CCNCC2)c2nccn12
BDBM50002143 CCc1cnc2c(nccn12)N1CCNCC1
BDBM50001913 COc1ccc(cc1)N1CCNCC1
BDBM50001914 CS(=O)(=O)Nc1ccc(cc1)C(=O)NCC1CN(CCN1)c1cccc(Cl)c1
BDBM50001915 Clc1cccc(c1)N1CCNCC1
BDBM50001916 CS(=O)(=O)Nc1ccc(NC(=O)C2CN(CCN2)c2ccccc2)cc1
BDBM50002146 Cc1cnc2c(nc(C)cn12)N1CCNCC1
BDBM50001917 COc1cccc(c1)N1CCNCC1
BDBM50002147 CCCc1cnc2c(nccn12)N1CCNCC1
BDBM50002149 CC(C)c1cnc2c(nccn12)N1CCNCC1
BDBM50008824 NC[C@@H]1O[C@@H](Cc2c(O)c(Br)ccc12)c1ccccc1
BDBM50008825 Cc1ccc2[C@H](CN)O[C@@H](Cc2c1O)C1CCCCC1
BDBM50007476 CC(C)(C)NCC(O)COc1ccc(O)c(O)c1
BDBM50007477 CC(C)(C)NCC(O)COc1ccc(O)c(O)c1F
BDBM50010891 NCC1OCCc2c(O)c(O)ccc12
BDBM50010828 Cc1cccc(OCC(O)CN2CCN(CC2)c2ccc(NS(C)(=O)=O)cc2)c1
BDBM50010829 Cc1cccc(OCC(O)CNCc2ccc(NS(C)(=O)=O)cc2)c1
BDBM50010830 COCCc1ccc(OCC(O)CNCc2ccc(NS(C)(=O)=O)cc2)cc1
BDBM50010833 CS(=O)(=O)Nc1ccc(OCC(O)CNCCOc2ccc(cc2)-n2ccnc2)cc1
BDBM50010834 OC(CNCCOc1ccc(cc1)-n1ccnc1)COc1ccccc1
BDBM50010837 COCCc1ccc(OCC(O)CNCCOc2ccc(cc2)-n2ccnc2)cc1
BDBM50010838 CS(=O)(=O)Nc1ccc(OCC(O)CNCc2ccc(cc2)-n2ccnc2)cc1
BDBM50010840 Cc1cccc(OCC(O)CNCCOc2ccc(cc2)-n2ccnc2)c1
BDBM50010841 Cc1ccccc1OCC(O)CNCc1ccc(cc1)-n1ccnc1
BDBM50010842 Cc1ccccc1OCC(O)CN1CCN(CC1)c1ccc(NS(C)(=O)=O)cc1
BDBM50010844 CS(=O)(=O)Nc1ccc(cc1)C(O)CNCCOc1ccc(cc1)-n1ccnc1
BDBM50014154 Cc1nc[nH]c1Cc1nc(cs1)-c1ccccc1
BDBM50017713 COc1ccc(OC)c(c1)C(O)C(C)NC(C)(C)C
BDBM50015190 CC(C)(COc1ccc(cc1)-n1ccnc1)NCC(O)COc1ccc(NS(C)(=O)=O)cc1
BDBM50015191 CN(c1ccc(OCC(O)CNCCOc2ccc(cc2)-n2ccnc2C)cc1)S(C)(=O)=O
BDBM50015193 CS(=O)(=O)Nc1ccc(OC[C@H](O)CNCCOc2ccc(cc2)-n2ccnc2)cc1
BDBM50015194 Cc1nccn1-c1ccc(OCCNCC(O)COc2ccc(NS(C)(=O)=O)cc2)cc1
BDBM50015195 CS(=O)(=O)Nc1ccc(OC[C@@H](O)CNCCOc2ccc(cc2)-n2ccnc2)cc1
BDBM50015196 CN(c1ccc(OCC(O)CNCCOc2ccc(cc2)-n2ccnc2)cc1)S(C)(=O)=O
BDBM50017378 CC(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCC12OCCO
BDBM50017379 COc1cc(CCNCC(O)CO\N=C2\c3ccccc3C3CCCCCC23OC)cc(OC)c1
BDBM50017380 CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCCC12OCCO
BDBM50017381 COc1cc(CCNCC(O)CO\N=C2\c3cc(F)ccc3C3CCCCC23OC)cc(OC)c1
BDBM50017382 COC12CCCCCCCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)C
BDBM50017383 COC12CCCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)(C)C
BDBM50017384 COC12CCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)(C)C
BDBM50017385 CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCCC12O
BDBM50017386 COC12CCCCC1c1ccc(F)cc1\C2=N\OCC(O)CNC(C)C
BDBM50017387 CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCC12O
BDBM50017388 COC12CCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)C
BDBM50017389 COc1cc(CCNCC(O)CO\N=C2\c3ccccc3C3CCCCCCCCCC23OC)cc(OC)c1
BDBM50017390 CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCC12OCCO
BDBM50017391 CC(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCCC12OCCO
BDBM50017392 COC12CCCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)C
BDBM50017393 CC(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCC12O
BDBM50017394 COc1cc(CCNCC(O)CO\N=C2\c3ccccc3C3CCCCC23OC)cc(OC)c1
BDBM50017395 CC(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCCC12O
BDBM50017396 COC12CCCCC1c1ccc(F)cc1\C2=N\OCC(O)CNC(C)(C)C
BDBM50019443 CC(C)NCC(O)COc1cccc2[nH]ccc12
BDBM50019057 CNCC(O)c1cc(O)c(O)cc1F
BDBM50019355 COc1cc(CC2NCCc3cc(O)c(O)cc23)cc(OC)c1OC
BDBM50019059 CNCC(O)c1ccc(O)c(O)c1F
BDBM50019060 NCC(O)c1ccc(O)c(O)c1F
BDBM50019061 NCC(O)c1cc(O)c(O)cc1F
BDBM50029050 CNC[C@H](O)c1ccc(O)c(O)c1 |r|
BDBM50029051 NC[C@H](O)c1ccc(O)c(O)c1 |r|
BDBM50029182 CCOC(=O)c1ccc(OCC(O)CNC(C)C)cc1
BDBM50036835 CC(C)NCC(O)c1ccc(Cl)c(Cl)c1
BDBM50036836 CC\C=N\OCC(O)CNC(C)C
BDBM50036837 CCCO\N=C\C(O)CNC(C)C
BDBM50036838 C\C=N\OCC(O)CNC(C)(C)C
BDBM50036839 CCO\N=C\C(O)CNC(C)C
BDBM50036840 CC\C=N\OCC(O)CNC(C)(C)C
BDBM50036841 CCO\N=C\C(O)CNC(C)(C)C
BDBM50036842 CCCO\N=C\C(O)CNC(C)(C)C
BDBM50036843 C\C=N\OCC(O)CNC(C)C
BDBM50041914 NCC1OCCc2cc(O)c(O)cc12
BDBM50041915 CC(C)NCC1OCCc2cc(O)c(O)cc12
BDBM50057128 COc1cccc2[C@H](CN(C)CCc3ccc4ccoc4c3)CCCc12
BDBM50064223 OC(CNc1ccccn1)CON=C(C1CC1)C1CC1
BDBM50064224 CCCCc1ccc(NCC(O)CON=C(C2CC2)C2CC2)cc1
BDBM50064225 OC(CNc1ccccc1I)CON=C(C1CC1)C1CC1
BDBM50064226 OC(CNc1ccc(cc1)C(O)=O)CON=C(C1CC1)C1CC1
BDBM50064227 OC(CNc1cccc(I)c1)CON=C(C1CC1)C1CC1
BDBM50064228 OC(CNc1ccc(Cl)cc1)CON=C(C1CC1)C1CC1
BDBM50064229 OC(CNc1ccc(O)cc1)CON=C(C1CC1)C1CC1
BDBM50064230 OC(CNc1ccccc1-c1ccccc1)CON=C(C1CC1)C1CC1
BDBM50064231 Cc1ccc(NCC(O)CON=C(C2CC2)C2CC2)nc1
BDBM50064232 CN(CC(O)CON=C(C1CC1)C1CC1)c1ccccc1
BDBM50064233 CC(C)(Cc1ccc(N)cc1)NCC(O)CON=C(C1CC1)C1CC1
BDBM50064234 CC(C)(Cc1ccc(NCC(O)CON=C(C2CC2)C2CC2)cc1)NCC(O)CON=C(C1CC1)C1CC1
BDBM50064204 OC(CNc1ccc(cc1)-c1ccccc1)CON=C(C1CC1)C1CC1
BDBM50064205 CC(C)(C)c1ccc(NCC(O)CON=C(C2CC2)C2CC2)cc1
BDBM50064206 Cc1cccc(NCC(O)CON=C(C2CC2)C2CC2)c1
BDBM50064207 Cc1ccc(NCC(O)CON=C(C2CC2)C2CC2)cc1
BDBM50064208 Cc1ccccc1NCC(O)CON=C(C1CC1)C1CC1
BDBM50064209 Cc1cccc(NCC(O)CON=C(C2CC2)C2CC2)n1
BDBM50064210 CC(C)(N)Cc1ccc(NCC(O)CON=C(C2CC2)C2CC2)cc1
BDBM50064212 OC(CNc1ccc(I)cc1)CON=C(C1CC1)C1CC1
BDBM50064211 OC(CNc1ccncc1)CON=C(C1CC1)C1CC1
BDBM50064214 OC(CNc1ccc(cc1)C(F)(F)F)CON=C(C1CC1)C1CC1
BDBM50064215 OC(CNc1nc2ccccc2s1)CON=C(C1CC1)C1CC1
BDBM50064216 OC(CNc1ccc(Br)cc1)CON=C(C1CC1)C1CC1
BDBM50064217 OC(CNc1nc2ccccc2[nH]1)CON=C(C1CC1)C1CC1
BDBM50064218 CCOC(=O)c1ccc(NCC(O)CON=C(C2CC2)C2CC2)cc1
BDBM50064219 Cc1ccnc(NCC(O)CON=C(C2CC2)C2CC2)c1
BDBM50064220 CC(C)(Cc1ccc(NCC(O)CO[N-][C+](C2CC2)C2CC2)cc1)[N+]([O-])=O
BDBM50064221 OC(CNc1ccc(cc1)[N+]([O-])=O)CO[N-][C+](C1CC1)C1CC1
BDBM50064222 OC(CNc1ccc(F)cc1)CON=C(C1CC1)C1CC1
BDBM50064213 OC(CNc1ccccc1)CON=C(C1CC1)C1CC1
BDBM50086660 OC(COc1ccc2SCC(=O)Nc2c1)CN1CCN(CC1)C(=O)c1ccc(F)cc1
BDBM50086662 COc1ccccc1N1CCN(CCCN2C(=O)CSc3ccccc23)CC1
BDBM50086663 OC(COc1ccc2SCC(=O)Nc2c1)CN1CCN(CC1)c1ccc(F)cc1
BDBM50086664 OC(COc1cccc2NC(=O)CSc12)CN1CCN(CC1)C(=O)c1ccco1
BDBM50086665 OC(COc1ccc2NC(=O)CSc2c1)CN1CCN(CC1)c1ccc(F)cc1
BDBM50086666 COc1ccccc1N1CCN(CCCN2C(=O)CSc3c(OCC(O)CNC(C)(C)C)cccc23)CC1
BDBM50086668 COc1ccccc1N1CCN(CC(O)COc2ccc3NC(=O)CSc3c2)CC1
BDBM50086670 COc1ccccc1N1CCN(CC(O)COc2cccc3NC(=O)CSc23)CC1
BDBM50086672 OC(COc1ccc2NC(=O)CSc2c1)CN1CCN(CC1)C(=O)c1ccco1
BDBM50086673 CC(C)(C)NCC(O)COc1cccc2NC(=O)CSc12
BDBM50086674 OC(COc1ccc2SCC(=O)Nc2c1)CN1CCN(CC1)C(=O)c1ccco1
BDBM50086675 OC(COc1cccc2NC(=O)CSc12)CN1CCN(CC1)C(=O)c1ccc(F)cc1
BDBM50086677 COc1ccccc1N1CCN(CC(O)COc2ccc3SCC(=O)Nc3c2)CC1
BDBM50086678 OC(COc1ccc2NC(=O)CSc2c1)CN1CCN(CC1)C(=O)c1ccc(F)cc1
BDBM50086679 OC(COc1cccc2NC(=O)CSc12)CN1CCN(CC1)c1ccc(F)cc1
BDBM50087512 CNC[C@@H](O)c1ccc(O)c(O)c1 |r|
BDBM50087513 NC[C@H](O)c1cc(O)c(O)cc1F
BDBM50087514 CNC[C@@H](O)c1ccc(O)c(O)c1F
BDBM50087515 CNC[C@H](O)c1cc(O)c(O)cc1F
BDBM50087516 NC[C@@H](O)c1ccc(O)c(O)c1F
BDBM50087518 NC[C@H](O)c1ccc(O)c(O)c1F
BDBM50087520 CNC[C@H](O)c1ccc(O)c(O)c1F
BDBM50122648 C[C@@H](NCCc1ccc(OCC(O)=O)c(Cl)c1)[C@@H](O)c1ccc(O)cc1
BDBM50122649 CCOC(=O)COc1ccc(CCNC(C)C(O)c2ccc(O)cc2)cc1Cl
BDBM50122651 CC(NCCc1ccc(OCC(O)=O)c(Cl)c1)[C@H](O)c1ccc(O)cc1
BDBM50131280 CC(Cc1ccc(OCCF)cc1)NCC(O)c1cc(O)cc(O)c1
BDBM50131281 CC(Cc1ccc(O)cc1)NCC(O)c1cc(O)cc(O)c1
BDBM50151720 COc1ccc(C[C@@H](C)NC[C@H](O)c2ccc(O)c(NC=O)c2)cc1 |r|
BDBM50156304 CCOc1no[n+]([O-])c1S(=O)(=O)c1ccccc1
BDBM50169785 CC(C)NCC(O)COc1ccccc1
BDBM50186613 NC(=O)c1c(CO)no[n+]1[O-]
BDBM50221767 CC(Cc1ccc(OCc2no[n+]([O-])c2C)cc1)NCC(O)c1cc(O)cc(O)c1 |w:1.0,20.22|
BDBM50221768 CC(Cc1ccc(O)cc1)NCC(O)c1cc(O)cc(O)c1 |w:1.0,12.13|
BDBM50221770 CC(Cc1ccc(OCc2nonc2C(N)=O)cc1)NCC(O)c1cc(O)cc(O)c1 |w:1.0,21.23|
BDBM50221771 CC(Cc1ccc(OCc2nonc2C)cc1)NCC(O)c1cc(O)cc(O)c1 |w:1.0,19.21|
BDBM50221772 CC(Cc1ccc(Oc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)cc1)NCC(O)c1cc(O)cc(O)c1 |w:1.0,27.30|
BDBM50221773 CC(Cc1ccc(OCc2no[n+]([O-])c2C(N)=O)cc1)NCC(O)c1cc(O)cc(O)c1 |w:1.0,22.24|
BDBM50221776 CC(Cc1ccc(Oc2nonc2S(=O)(=O)c2ccccc2)cc1)NCC(O)c1cc(O)cc(O)c1 |w:1.0,26.29|
BDBM50241366 CC(C)NC[C@H](O)COc1cccc(C)c1 |r|
BDBM50292219 CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1 |r|
BDBM50285930 O[C@@H](CN[C@H]1CCCc2cc3OC(Oc3cc2C1)(C([O-])=O)C([O-])=O)c1cccc(Cl)c1
BDBM50295572 CC(C)NCC(O)c1cc(O)cc(O)c1
BDBM50295573 CC(C)(C)NC[C@@H](O)c1ccc(OB(O)O)c(CO)c1 |r|
BDBM50318154 CCc1ccc(CC)c2CC(Cc12)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 |r|
BDBM50318155 COc1cc2CC(Cc2cc1OC)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 |r|
BDBM50318156 COc1ccc(C[C@@H](C)NC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)cc1 |r|
BDBM50318157 CCCCc1cc2CC(Cc2cc1CCCC)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 |r|
BDBM50318158 CCCc1cc2CC(Cc2cc1CCC)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 |r|
BDBM50318159 CCc1cc2CC(Cc2cc1CC)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 |r|
BDBM50318160 Cc1cc2CC(Cc2cc1C)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 |r|
BDBM50318161 O[C@@H](CNC1Cc2ccccc2C1)c1ccc(O)c2[nH]c(=O)ccc12 |r|
BDBM50324855 O[C@@H](CN[C@H]1CCC[C@@H]1OCc1ccccc1)c1ccc(O)c2[nH]c(=O)sc12 |r|
BDBM50324856 O[C@@H](CN[C@@H]1CCC[C@@H]1C1CCCC1)c1ccc(O)c2[nH]c(=O)sc12 |r|
BDBM50337297 OC(CNCCc1cccc(NC(=O)NCC23CC4CC(CC(C4)C2)C3)c1)c1ccc(O)c2[nH]c(=O)ccc12 |TLB:19:20:17.18.23:24,THB:19:18:24:25.20.21,21:20:17:23.22.24,21:22:17:25.19.20|
BDBM50337298 OC(CNCCc1cccc(NC(=O)Nc2cccc(Oc3ccccc3)c2)c1)c1ccc(O)c2[nH]c(=O)ccc12
BDBM50337299 OC(CNCCc1cccc(NC(=O)Nc2ccccc2)c1)c1ccc(O)c2[nH]c(=O)ccc12
BDBM50337300 OC(CNCCc1cccc(NC(=O)NCc2ccccc2)c1)c1ccc(O)c2[nH]c(=O)ccc12
BDBM50337301 OC(CNCCc1cccc(NC(=O)NCCc2ccccc2)c1)c1ccc(O)c2[nH]c(=O)ccc12
BDBM50337302 NC(=O)c1cccc(CNC(=O)Nc2cccc(CCNCC(O)c3ccc(O)c4[nH]c(=O)ccc34)c2)c1
BDBM50337303 CC(C)(C)c1ccc(CNC(=O)Nc2cccc(CCNCC(O)c3ccc(O)c4[nH]c(=O)ccc34)c2)cc1
BDBM50337291 OC(CNCCc1cccc(NC(=O)NCCCc2ccccc2)c1)c1ccc(O)c2[nH]c(=O)ccc12
BDBM50337292 COc1ccccc1CNC(=O)Nc1cccc(CCNCC(O)c2ccc(O)c3[nH]c(=O)ccc23)c1
BDBM50337293 OC(CNCCc1cccc(NC(=O)NCc2ccc(F)cc2)c1)c1ccc(O)c2[nH]c(=O)ccc12
BDBM50337294 OC(CNCCc1cccc(NC(=O)NCc2c(Cl)cccc2Cl)c1)c1ccc(O)c2[nH]c(=O)ccc12
BDBM50337295 OC(CNCCc1cccc(NC(=O)NC(c2ccccc2)c2ccccc2)c1)c1ccc(O)c2[nH]c(=O)ccc12
BDBM50337296 OC(CNCCc1cccc(NC(=O)Nc2ccccc2-c2ccccc2)c1)c1ccc(O)c2[nH]c(=O)ccc12
BDBM50343161 CC(C)N(CC[C@H](c1ccccc1)c1cc(CCCCOc2ccc(CCNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)cc2)ccc1O)C(C)C |r|
BDBM50343153 CC(C)N(CC[C@H](c1ccccc1)c1cc(CCCNC(=O)Cc2cccc(CC(C)(C)NC[C@H](O)c3ccc(O)c(NS(C)(=O)=O)c3)c2)ccc1O)C(C)C |r|
BDBM50365056 COc1ccc(cc1OC)C1=NN(CCNCC(O)c2ccc(O)c(NC=O)c2)C(=O)C2CCCCC12 |t:11|
BDBM50365057 COc1ccc(cc1OC)C1=NN(CCCCNCC(O)c2ccc(O)c(NC=O)c2)C(=O)C2CCCCC12 |t:11|
BDBM50365058 COc1ccc(cc1OC)C1=NN(CCCCNC[C@H](O)c2ccc(O)c(NC=O)c2)C(=O)C2CCCCC12 |r,t:11|
BDBM50365059 COc1ccc(cc1OC)C1=NN(CCCCNC[C@@H](O)c2ccc(O)c(NC=O)c2)C(=O)C2CCCCC12 |r,t:11|
BDBM50365060 COc1ccc(cc1OC)C1=NN(CCCCCNCC(O)c2ccc(O)c(NC=O)c2)C(=O)C2CCCCC12 |t:11|
BDBM50365061 COc1ccc(cc1OC)C1=NN(CCCCCCNCC(O)c2ccc(O)c(NC=O)c2)C(=O)C2CCCCC12 |t:11|
BDBM50367950 CS(=O)(=O)Nc1ccc(OC[C@H](O)CNCCOc2ccc(cc2)-n2ccnc2)cc1 |r|
BDBM50367951 CS(=O)(=O)Nc1ccc(OC[C@@H](O)CNCCOc2ccc(cc2)-n2ccnc2)cc1 |r|
BDBM50407517 CC(C)NC[C@H](O)c1ccc(O)c(O)c1
BDBM50407518 CC(C)NC[C@@H](O)c1ccc(O)c(O)c1 |r|
BDBM50406463 [#6]\[#6](=[#7]/[#8]-[#6]-[#6](-[#8])-[#6]-[#7]C([#6])([#6])[#6])-c1cc(Cl)c(\[#7]=[#6]-2\[#7]-[#6]-[#6]-[#7]-2)c(Cl)c1
BDBM50406465 CC(Oc1c(Cl)cc(cc1Cl)C(\C)=N\OCC(O)CNC(C)(C)C)C1=NCCN1 |t:25|
BDBM50404976 OC(CNC1CC1)COc1ccc(cc1)-c1ncc[nH]1
BDBM50404977 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nc(c[nH]2)-c2cccs2)cc1OC
BDBM50404978 OC(CNC1CC1)COc1ccc(cc1)-c1ncc([nH]1)C(F)(F)F
BDBM50404979 COc1ccc(CCNC[C@H](O)COc2ccc(cc2)-c2ncc[nH]2)cc1OC |r|
BDBM50404980 COc1ccc(CCNC[C@H](O)COc2ccc(cc2)-c2nc(c[nH]2)-c2cccs2)cc1OC |r|
BDBM50404981 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nc(C)c[nH]2)cc1OC
BDBM50404982 CC(C)(C)NCC(O)COc1ccc(cc1)-c1nc(c[nH]1)-c1cccs1
BDBM50404983 Cc1c[nH]c(n1)-c1ccc(OCC(O)CNC2CC2)cc1
BDBM50404984 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2ncc([nH]2)C(F)(F)F)cc1OC
BDBM50404985 COc1ccc(CCNC[C@@H](O)COc2ccc(cc2)-c2nc(c[nH]2)-c2cccs2)cc1OC |r|
BDBM50404986 Cc1c[nH]c(n1)-c1ccc(OCC(O)CNC(C)(C)C)cc1
BDBM50404988 CC(C)NCC(O)COc1ccc(cc1)-c1nc(c[nH]1)-c1cccs1
BDBM50404989 O[C@@H](CNC1CC1)COc1ccc(cc1)-c1nc(c[nH]1)-c1cccs1 |r|
BDBM50404990 COc1ccc(CC(C)(C)NCC(O)COc2ccc(cc2)-c2nc(c[nH]2)-c2cccs2)cc1OC
BDBM50404991 OC(CNCCc1ccccc1)COc1ccc(cc1)-c1nc(c[nH]1)-c1cccs1
BDBM50404992 COc1ccc(CC(C)NCC(O)COc2ccc(cc2)-c2nc(c[nH]2)-c2cccs2)cc1OC
BDBM50404993 CC(C)(C)NCC(O)COc1ccc(cc1)-c1ncc[nH]1
BDBM50404994 O[C@@H](CNC1CC1)COc1ccc(cc1)-c1ncc([nH]1)C(F)(F)F |r|
BDBM50405013 [#6]C([#6])([#6])[#7]-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6](/[#6]-1-[#6]-[#6]1)-[#6]-1-[#6]-[#6]-1
BDBM50405014 [#6]\[#6](-[#6])=[#7]\[#8]-[#6]-[#6](-[#8])-[#6]-[#7]C([#6])([#6])[#6]
BDBM50405015 C\C(CC1CC1)=N\OCC(O)CNC(C)(C)C
BDBM50405238 [#6]-[#6](-[#6])-[#7]-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6]-1/[#6]-[#6]-[#6]-[#6]-1
BDBM50405239 [#6]-[#6]-[#6]\[#6](-[#6]-[#6]-[#6])=[#7]\[#8]-[#6]-[#6](-[#8])-[#6]-[#7]C([#6])([#6])[#6]
BDBM50405240 [#6]-[#6]\[#6](-[#6]-[#6])=[#7]\[#8]-[#6]-[#6](-[#8])-[#6]-[#7]C([#6])([#6])[#6]
BDBM50405408 COCc1cnc([nH]1)-c1ccc(OC[C@@H](O)CNCCc2ccc(OC)c(OC)c2)cc1 |r|
BDBM50405409 COc1ccc(CCNCC(O)COc2ccc(cc2Cl)-c2ncc(Br)[nH]2)cc1OC
BDBM50405410 COc1ccc(CCNCC(O)COc2ccc(cn2)-c2nc(c[nH]2)-c2cccs2)cc1OC
BDBM50405411 COc1ccc(CCNCC(O)COc2ccc(cc2Cl)-c2nc(c[nH]2)-c2cccs2)cc1OC
BDBM50405412 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2ncco2)cc1OC
BDBM50405414 COc1ccc(CCNCC(O)COc2ccc(cc2OC)-c2nc(C)c[nH]2)cc1OC
BDBM50405415 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2ncc(CN3CCOCC3)[nH]2)cc1OC
BDBM50405416 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2ncc(Br)[nH]2)cc1OC
BDBM50405417 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nccs2)cc1OC
BDBM50405418 CCOCc1cnc([nH]1)-c1ccc(OCC(O)CNCCc2ccc(OC)c(OC)c2)cc1
BDBM50405419 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nc(C)c(C)[nH]2)cc1OC
BDBM50405420 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2ncc([nH]2)C(N)=O)cc1OC
BDBM50405421 COc1ccc(CCNCC(O)COc2ccc(CCc3nc(c[nH]3)-c3cccs3)cc2)cc1OC
BDBM50405422 OC(CNCCNC(=O)Nc1ccccc1)COc1ccc(cc1)-c1ncc[nH]1
BDBM50405423 COCCc1cnc([nH]1)-c1ccc(OCC(O)CNCCc2ccc(OC)c(OC)c2)cc1
BDBM50405424 COc1ccc(CCNC[C@H](O)COc2ccc(cc2)-c2nc(c[nH]2)C(C)(C)C)cc1OC |r|
BDBM50405425 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nc(C)c(Cl)[nH]2)cc1OC
BDBM50405426 CCCCNC(=O)NCCNCC(O)COc1ccc(cc1)-c1nc(C)c[nH]1
BDBM50405427 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nc(C)c(Br)[nH]2)cc1OC
BDBM50405428 CC(C)(C)NCC(O)COc1ccc(Cc2nc(c[nH]2)-c2cccs2)cc1
BDBM50405429 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nccn2C)cc1OC
BDBM50405430 CC(C)NCC(O)COc1ccc(cc1)-c1nc(c[nH]1)C(C)C
BDBM50405431 COc1ccc(CCNCC(O)COc2ccc(OCc3ncc[nH]3)cc2)cc1OC
BDBM50405432 COc1ccc(CCNCC(O)COc2ccc(Cc3ncc(C)[nH]3)cc2)cc1OC
BDBM50405433 CCOCCNC[C@H](O)COc1ccc(cc1)-c1nc(c[nH]1)-c1cccs1 |r|
BDBM50405434 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2ncc(Cl)[nH]2)cc1OC
BDBM50405435 OC(CNCCc1ccncc1)COc1ccc(cc1)-c1nc(c[nH]1)-c1cccs1
BDBM50405626 O[C@H](COc1cccc2ccccc12)[C@H]1CCCCN1
BDBM50405627 Cc1cccc(OC[C@@H](O)[C@H]2CCCCN2)c1
BDBM50405628 O[C@H](COc1ccc2ccccc2c1)[C@@H]1CCCCN1
BDBM50404770 CC(C)CNCC(O)COc1ccccc1C
BDBM50404771 COC(=O)CCNCC(O)COc1ccccc1C
BDBM50404774 CCOC(=O)CCCNCC(O)COc1ccccc1C
BDBM50405016 CC(C)(C)NCC(O)COCC1CC1
BDBM50405017 C\C(=N\OCC(O)CNC(C)(C)C)C1CC1
BDBM50405018 CC1C\C(CC(C)(C)C1)=N\OCC(O)CNC(C)(C)C
BDBM50405617 O[C@H](COCc1ccccc1)[C@H]1CCCCN1
BDBM50405618 CC(C)NCC(O)COCCCc1ccccc1
BDBM50405619 Cc1cccc(OC[C@@H](O)[C@@H]2CCCCN2)c1
BDBM50405629 O[C@H](COCc1ccccc1)[C@@H]1CCCCN1
BDBM50405630 CC(C)NCC(O)COCc1ccccc1
BDBM50405631 CN1CCCC[C@H]1[C@H](O)COc1ccccc1
BDBM50404775 NCC(O)COc1cccc2ccccc12
BDBM50404776 CCOC(=O)CCNCC(O)COc1cccc2ccccc12
BDBM50404778 CCOC(=O)CNCC(O)COc1cccc2ccccc12
BDBM50405019 CC(C)(C)NCC(O)COC(C)(C)C=C
BDBM50405020 CC(OCC(O)CNC(C)(C)C)C1CC1
BDBM50405021 CC(C)(C)NCC(O)COC(C1CC1)C1CC1
BDBM50405024 CC(C)(C)NCC(O)CO\N=C/C1CC1
BDBM50405146 CC(C)NCC(O)COC1=CC(=O)C(=O)c2ccccc12 |t:9|
BDBM50405436 CCOC(=O)c1cnc([nH]1)-c1ccc(OCC(O)CNCCc2ccc(OC)c(OC)c2)cc1
BDBM50405437 Cc1cnc(Cc2ccc(OCC(O)CNC(C)(C)C)cc2)[nH]1
BDBM50405438 COc1ccc(CCNCC(O)COc2ccc(cc2C)-c2nc(c[nH]2)-c2cccs2)cc1OC
BDBM50405439 COCc1[nH]c(nc1C)-c1ccc(OCC(O)CNCCc2ccc(OC)c(OC)c2)cc1
BDBM50405443 COc1ccc(CCNCC(O)COc2ccc(cc2Br)-c2nc(C)c[nH]2)cc1OC
BDBM50405444 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nc(C)c([nH]2)C(C)=O)cc1OC
BDBM50405620 O[C@H](COc1ccccc1)[C@H]1CCCCN1
BDBM50405621 O[C@H](COc1ccccc1)[C@@H]1CCCCN1
BDBM50405622 Cc1ccc(OC[C@@H](O)[C@@H]2CCCCN2)cc1
BDBM50405632 CC(C)NCC(O)COc1ccc2ccccc2c1
BDBM50405633 CC(C)NCC(O)COc1ccc(C)cc1
BDBM50405634 CC(C)N(C)CC(O)COc1ccccc1
BDBM50405025 CC(C)C(\C)=N/OCC(O)CNC(C)(C)C
BDBM50405026 CC(NOCC(O)CNC(C)(C)C)C1CC1
BDBM50405027 CC1CC(CC(C)(C)C1)OCC(O)CNC(C)(C)C
BDBM50405147 CC(C)NCC(O)COc1ccc(O)c2ccccc12
BDBM50405623 Cc1ccc(OC[C@@H](O)[C@H]2CCCCN2)cc1
BDBM50405624 O[C@H](COCCCc1ccccc1)[C@@H]1CCCCN1
BDBM50405625 O[C@H](COc1cccc2ccccc12)[C@@H]1CCCCN1
BDBM50405635 O[C@H](COc1ccc2ccccc2c1)[C@H]1CCCCN1
BDBM50405636 CN1CCCC[C@@H]1[C@H](O)COc1ccccc1
BDBM50404695 COc1ccc(CCNCC(O)C2=COc3ccccc3O2)cc1OC |t:12|
BDBM50404696 CC(C)(C)NCC(O)C1=COc2ccccc2O1 |t:8|
BDBM50404697 OC(CN1CCCCC1)C1=COc2ccccc2O1 |t:10|
BDBM50404779 NC(=O)CNCC(O)COc1cccc2ccccc12
BDBM50404780 COC(=O)CNCC(O)COc1ccccc1C
BDBM50404698 OC(CN1CCCCCC1)C1=COc2ccccc2O1 |t:11|
BDBM50404699 CC(C)NCC(O)C1=COc2ccccc2O1 |t:7|
BDBM50404781 NCC(O)COc1ccccc1
BDBM50404782 CCOC(=O)CCNCC(O)COc1ccccc1Cl
BDBM50404783 CCOC(=O)CCCCNCC(O)COc1ccccc1C
BDBM50404784 CC(C)CNCC(O)COc1ccccc1
BDBM50404785 CCOC(=O)CC(C)(C)NCC(O)COc1ccccc1C
BDBM50404786 CCOC(=O)CCNCC(O)COc1ccc(CCC(=O)OC)cc1
BDBM50404788 COC(=O)CCc1ccc(OCC(O)CNCCCc2ccccc2)cc1
BDBM50404789 CCOC(=O)CCNCC(O)COc1ccccc1C(=O)OC
BDBM50405384 CC(CCc1ccccc1)NCC(O)c1cc(C(N)=O)c2n(C)ccc2c1
BDBM50404787 CC(C)NCC(O)COc1ccccc1C(=O)OC=C
BDBM50405385 CC(CCc1ccccc1)NCC(O)c1cc(C(N)=O)c2[nH]ccc2c1
BDBM50404480 CC(C)OCC(O)CNC(C)(C)C
BDBM50404481 CC(C)NCC(O)CO
BDBM50404482 CC(C)(C)NCC(O)CO
BDBM50404483 CC(C)(C)NCC(O)CO\N=C1/CC2CCC1(C)C2(C)C
BDBM50404790 COC(=O)c1ccccc1OCC(O)CNC(C)C
BDBM50404791 COC(=O)CCc1ccc(OCC(O)CNC(C)(C)C)cc1
BDBM50404484 CC(C)COCC(O)CNC(C)(C)C
BDBM50404485 CC(C)NCC(O)CO\N=C(/C)\C=C\c1ccccc1
BDBM50404486 CC(C)NCC(O)CO\N=C1/CC2CCC1(C)C2(C)C
BDBM50404487 C\C(CCc1ccccc1)=N\OCC(O)CNC(C)(C)C
BDBM50404488 C\C(\C=C\c1ccccc1)=N/OCC(O)CNC(C)(C)C
BDBM50404793 COC(=O)CCc1ccc(OCC(O)CNCCc2ccc(OC)c(OC)c2)cc1
BDBM50404794 COC(=O)\C=C\c1ccc(OCC(O)CNC(C)C)cc1
BDBM50405508 CC(C)NCC(O)COC(=O)C1CCCCC1
BDBM50404489 CCC\C(C)=N/OCC(O)CNC(C)C
BDBM50404751 CCOC(=O)CCNCC(O)COc1ccccc1
BDBM50404796 COC(=O)CCc1ccc(OCC(O)CNC(C)C)cc1
BDBM50405509 CC(C)NCC(O)COC(=O)c1cccs1
BDBM50405510 CCC(=O)OCC(O)CNC(C)(C)C
BDBM50405511 CC(C)(C)NCC(O)COC(=O)c1cccs1
BDBM50404490 CC\C(C)=N/OCC(O)CNC(C)C
BDBM50404491 [#6]-[#6](-[#6])-[#7]-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6]-1\[#6]-[#6]-[#6]-[#6]-[#6]-1
BDBM50404492 CC(C)NCC(O)CO\N=C(\C)CCc1ccccc1
BDBM50404752 CCOC(=O)CCCNCC(O)COc1ccccc1
BDBM50404754 CCOC(=O)CNCC(O)COc1ccccc1
BDBM50404797 CC(C)NCC(O)COc1ccc(cc1)C(=O)OC=C
BDBM50404798 COC(=O)c1ccc(OCC(O)CNC(C)(C)C)cc1
BDBM50404799 COC(=O)CCc1ccc(OCC(O)CNCc2ccccc2)cc1
BDBM50405402 COc1ccc(CCNCC(O)COc2ccc(COCc3ncc[nH]3)cc2)cc1OC
BDBM50405403 CC(C)NCC(O)COc1ccc(Cc2ncc(Br)[nH]2)cc1
BDBM50405513 CC(C)(C)NCC(O)COC(=O)C1CCCCC1
BDBM50405514 CC(C)NCC(O)COC(=O)C(C)C
BDBM50404493 CC(C)(C)NCC(O)CNC(C)(C)C
BDBM50404494 CC(C)NCC(O)COC(C)C
BDBM50404495 CC(C)COCC(O)CNC(C)C
BDBM50404496 CCC\C(C)=N/OCC(O)CNC(C)(C)C
BDBM50404755 CCOC(=O)CNCC(O)COc1ccccc1C
BDBM50404757 CCOC(=O)CCNCC(O)COc1cccc(Cl)c1
BDBM50404800 COC(=O)CCCc1ccc(OCC(O)CNC(C)C)cc1
BDBM50404801 COC(=O)Cc1ccc(OCC(O)CNC(C)C)cc1
BDBM50405515 CC(C)NCC(O)COC(=O)Cc1cccs1
BDBM50405516 CC(C)C(=O)OCC(O)CNC(C)(C)C
BDBM50405521 CC(C)NCC(O)COc1ccc(CCOCC2CC2)cc1
BDBM50404497 [#6]-[#6](-[#6])-[#7]-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6](/[#6])-[#6]
BDBM50404498 [#6]C([#6])([#6])[#7]-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6]-1\[#6]-[#6]-[#6]-[#6]-[#6]-1
BDBM50404499 CC(C)NOCC(O)CNC(C)(C)C
BDBM50404500 COCC(O)CNC(C)(C)C
BDBM50404758 CCOC(=O)CCNCC(O)COc1ccc(Cl)cc1
BDBM50404760 CCOC(=O)CCNCC(O)COc1cccc(OC)c1
BDBM50404803 CCCOC(=O)CCc1ccc(OCC(O)CNC(C)C)cc1
BDBM50404804 COC(=O)c1ccccc1OCC(O)CNC(C)(C)C
BDBM50404805 CCOC(=O)c1ccccc1OCC(O)CNC(C)(C)C
BDBM50404807 CCOC(=O)C(C)(C)NCC(O)COc1ccccc1C(=O)OC
BDBM50404808 COC(=O)CCc1ccccc1OCC(O)CNC(C)C
BDBM50404501 CC\C(C)=N/OCC(O)CNC(C)(C)C
BDBM50404502 [#6]\[#6](-[#6])=[#7]/[#8]-[#6]-[#6](-[#8])-[#6]-[#7]C([#6])([#6])[#6]
BDBM50404763 CCOC(=O)CCNCC(O)COc1ccccc1C
BDBM50404806 COC(=O)c1ccc(OCC(O)CNC(C)C)cc1
BDBM50405232 [#6]-[#6](-[#6])-[#6](=[#7]/[#8]-[#6]-[#6](-[#8])-[#6]-[#7]C([#6])([#6])[#6])\[#6](-[#6])-[#6]
BDBM50405233 [#6]C([#6])([#6])[#7]-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6]-1/[#6]-[#6]-[#6]-[#6]-[#6]-1
BDBM50405234 [#6]-[#6]-[#6]\[#6](-[#6]-[#6]-[#6])=[#7]/[#8]-[#6]-[#6](-[#8])-[#6]-[#7]-[#6](-[#6])-[#6]
BDBM50405277 [#6]C([#6])([#6])[#7]-[#6]-[#6@@H](-[#8])-[#6]-[#8]\[#7]=[#6](/[#6]-1-[#6]-[#6]1)-[#6]-1-[#6]-[#6]-1 |r|
BDBM50405278 C\C(=N/OCC(O)CNC(C)(C)C)C1CC1
BDBM50405279 C\C(=N/OC[C@H](O)CNC(C)(C)C)C1CC1
BDBM50405404 CC(C)NCC(O)COc1ccc(cc1)-c1ncc[nH]1
BDBM50405405 COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nc(c[nH]2)C(C)(C)C)cc1OC
BDBM50405406 CCCNCC(O)COc1ccc(cc1)-c1nc(c[nH]1)-c1cccs1
BDBM50404764 CCOC(=O)CCNCC(O)COc1ccc(OC)cc1
BDBM50404765 CCOC(=O)CCNCC(O)COC1=CC=CCC1(C)C |c:15,t:13|
BDBM50404766 CCOC(=O)CCNCC(O)COc1cccc(C)c1
BDBM50404767 COC(=O)CCNCC(O)COc1cccc2ccccc12
BDBM50404809 CC(C)NCC(O)COc1cccc(c1)C(=O)OC=C
BDBM50404810 COC(=O)c1ccccc1OCC(O)CNC(C)(C)CO
BDBM50404811 CCOC(=O)CCc1ccc(OCC(O)CNC(C)C)cc1
BDBM50404813 COC(=O)c1ccccc1OCC(O)CNCCc1ccc(OC)c(OC)c1
BDBM50405011 CC(C)(C)COCC(O)CNC(C)(C)C
BDBM50405012 CC(C)(C)NCC(O)CO\N=C(\CC(=O)C(C)(C)C)C1CC1
BDBM50405235 [#6]C([#6])([#6])[#7]-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6]-1\[#6]-[#6]-[#6]-[#6]-1
BDBM50405236 [#6]-[#6](-[#6])-[#7]-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6](\[#6](-[#6])-[#6])-[#6](-[#6])-[#6]
BDBM50405237 [#6]-[#6]\[#6](-[#6]-[#6])=[#7]/[#8]-[#6]-[#6](-[#8])-[#6]-[#7]-[#6](-[#6])-[#6]
BDBM50405280 [#6]C([#6])([#6])[#7]-[#6]-[#6]-[#6]-[#8]\[#7]=[#6](\[#6]-1-[#6]-[#6]1)-[#6]-1-[#6]-[#6]-1
BDBM50405281 C\C(=N/OC[C@@H](O)CNC(C)(C)C)C1CC1
BDBM50405282 [#6]C([#6])([#6])[#7]-[#6]-[#6@H](-[#8])-[#6]-[#8]\[#7]=[#6](/[#6]-1-[#6]-[#6]1)-[#6]-1-[#6]-[#6]-1 |r|
BDBM50409693 C[C@H](NCCc1ccc(OCC(O)=O)c(Cl)c1)[C@@H](O)c1ccc(O)cc1 |r|
BDBM50419015 OCc1cc(ccc1O)[C@@H](O)CNCCCCCCOCCCCc1cccc(c1)-n1cc(O)[nH]c1=O |r|
BDBM50419309 NC(=O)Nc1cccc(CCCCOCCCCCCNC[C@H](O)c2ccc(O)c(CO)c2)c1 |r|
BDBM50419310 NC(=O)CNC(=O)Nc1cccc(CCCCOCCCCCCNC[C@H](O)c2ccc(O)c(CO)c2)c1 |r|
BDBM50419312 Cc1cc(CCCCOCCCCCCNC[C@H](O)c2ccc(O)c(CO)c2)cc(NC(N)=O)c1 |r|
BDBM50419317 CCNC(=O)Nc1cccc(CCCCOCCCCCCNC[C@H](O)c2ccc(O)c(CO)c2)c1 |r|
BDBM50419008 OCc1cc(ccc1O)[C@@H](O)CNCCCCCCOCCCCc1cccc(c1)-n1c(=O)cc[nH]c1=O |r|
BDBM50419010 OCc1cc(ccc1O)[C@@H](O)CNCCCCCCOCCCCc1cccc(NC(=O)NCC(O)=O)c1 |r|
BDBM50419011 OCc1cc(ccc1O)[C@@H](O)CNCCCCCCOCCCCc1cccc(c1)-n1c(O)c[nH]c1=O |r|
BDBM50419652 O[C@@H](CNCCc1ccc(NC[C@H](O)c2ccccc2)cc1)c1ccc(O)c(NC=O)c1 |r|
BDBM50419660 COCCNCc1cccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)sc23)c1 |r|
BDBM50419670 O[C@@H](CNCCc1cccc(CNCCc2ccccc2F)c1)c1ccc(O)c2[nH]c(=O)sc12 |r|
BDBM50419675 Cc1cccc2c(CCNCc3ccc(CCNC[C@H](O)c4ccc(O)c5[nH]c(=O)sc45)cc3)c[nH]c12 |r|
BDBM50419680 COc1ccccc1CNCc1cccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)sc23)c1 |r|
BDBM50419687 C[C@@H](NCc1ccccc1-c1ccc(CCNCCc2ccc(O)c3[nH]c(=O)sc23)cc1)c1ccccc1 |r|
BDBM50419688 Oc1ccc(CCNCCc2cccc(c2)-c2cccc(CNCc3ccccc3)c2)c2sc(=O)[nH]c12
BDBM50419689 O[C@@H](CNCCc1cccc(CNCCc2ccccn2)c1)c1ccc(O)c2[nH]c(=O)sc12 |r|
BDBM50421325 CCc1cc2CC(Cc2cc1CC)NC[C@H](O)c1ccc(O)c2NC(=O)CCc12 |r|
BDBM50421326 CCc1cc2CC(Cc2cc1CC)NCCc1ccc(O)c2[nH]c(=O)ccc12
BDBM50421760 COc1ccc(CCNC[C@H](O)COc2ccc(cc2)-c2ncc([nH]2)C(C)=O)cc1OC
BDBM50421715 CC(C)(C)NCC(O)c1ccc(O)c(N)c1
BDBM50421716 CC(C)NC[C@H](O)COc1ccc(O)cc1
BDBM50421717 CC(C)(C)NCC(O)c1ccccc1Cl
BDBM50422434 C[C@@H](NCCc1ccc(OCC(O)=O)c(Cl)c1)[C@H](O)c1ccc(O)cc1 |r|
BDBM50421718 CC(C)NCC(O)c1ccc(O)c(N)c1
BDBM50421719 CC(C)NCC(O)COc1cc(C)cc(C)c1
BDBM50421720 CC(C)NCC(O)c1ccc(cc1)[N+]([O-])=O
BDBM50421721 CNc1cc(ccc1O)C(O)CNC(C)(C)C
BDBM50421722 CC(C)NCC(O)COc1ccccc1OCC#C
BDBM50421723 CC(C)NCC(O)c1ccc(O)c(CO)c1
BDBM50421724 CC(C)NCC(O)COc1ccccc1C1CC1
BDBM50421725 CCC(C)c1cccc(OCC(O)CNC(C)C)c1
BDBM50421726 CC(C)NCC(O)COc1ccccc1CO
BDBM50421727 CC(C)(C)NCC(O)c1ccc(O)c(c1)C(N)=O
BDBM50421728 CC(C)(C)NCC(O)c1ccc(O)c(O)c1
BDBM50421729 CC(C)NCC(O)COc1ccccc1C
BDBM50421730 CC(C)NCC(O)COc1ccccc1C#N
BDBM50421731 CC(C)NCC(O)c1cc(Cl)c(N)c(Cl)c1
BDBM50421732 CC(C)(C)NCC(O)c1cc(Cl)c(O)c(Cl)c1
BDBM50421733 CC(C)(C)NCC(O)c1ccc(O)cc1
BDBM50444835 COc1ccc(cc1OC)C1=NN(CCCCCCOc2ccc(C[C@@H](C)NC[C@H](O)c3ccc(O)c(NC=O)c3)cc2)C(=O)C2CCCCC12 |r,t:11|
BDBM50444836 COc1ccc(cc1OC)C1=NN(CCCCCCOc2ccc(CC(C)NCC(O)c3ccc(O)c(NC=O)c3)cc2)C(=O)C2CCCCC12 |t:11|
BDBM50444837 COc1ccc(cc1OC)C1=NN(CCCCCOc2ccc(CC(C)NCC(O)c3ccc(O)c(NC=O)c3)cc2)C(=O)C2CCCCC12 |t:11|
BDBM50444838 COc1ccc(cc1OC)C1=NN(CCCCOc2ccc(CC(C)NCC(O)c3ccc(O)c(NC=O)c3)cc2)C(=O)C2CCCCC12 |t:11|
BDBM50018563 CCOc1ccc(Nc2ccc(CCNCC(O)c3ccc(O)c(CO)c3)cc2)cc1
BDBM50018588 COc1ccc(Nc2ccc(CCNC[C@H](O)c3ccc(O)c(NC=O)c3)cc2)cc1-c1ccccc1 |r|
BDBM50018587 COc1ccc(Nc2ccc(CCNC[C@H](O)c3ccc(O)c(CO)c3)cc2)cc1-c1ccccc1 |r|
BDBM50018589 COc1ccc(Nc2ccc(CCNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)cc2)cc1-c1ccccc1 |r|
BDBM50055251 O[C@@H](CN[C@@H]1CCC[C@@H]1C1CCCCC1)c1ccc(O)c2[nH]c(=O)sc12 |r|
BDBM50055258 Cc1cccc(c1)[C@H]1CCC[C@H]1NC[C@H](O)c1ccc(O)c2[nH]c(=O)sc12 |r|
BDBM50055245 CCCCc1cccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)sc23)c1 |r|
BDBM50055249 CCCCOc1cccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)sc23)c1 |r|
BDBM50055250 O[C@@H](CN[C@H]1CCC[C@H]1C1CCCC1)c1ccc(O)c2[nH]c(=O)sc12 |r|
BDBM50055252 CC(C)[C@H]1CCC[C@H]1NC[C@H](O)c1ccc(O)c2[nH]c(=O)sc12 |r|
BDBM50055253 O[C@@H](CN[C@@H]1CCC[C@@H]1c1ccccc1)c1ccc(O)c2[nH]c(=O)sc12 |r|
BDBM50055254 CCCc1cccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)sc23)c1 |r|
BDBM50055255 CCCc1ccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)sc23)cc1 |r|
BDBM50055256 CCc1cccc(c1)[C@H]1CCC[C@H]1NC[C@H](O)c1ccc(O)c2[nH]c(=O)sc12 |r|
BDBM50060974 CC(C)C[B-]1(O)OCc2cc(ccc2O1)[C@@H](O)C[NH2+]C(C)(C)C |r|
BDBM50128835 O[C@@H](CNCCc1ccc(CCN2CCC(Cn3cnc(n3)[C@@](O)(C3CCCCC3)c3ccccc3)CC2)cc1)c1ccc(O)c2[nH]c(=O)ccc12 |r|
BDBM50222540 CC(Oc1ccc(C)c(C)c1)C(O)CNC(C)(C)C
BDBM50222721 CC(NC(C)(C)C)C(O)COc1ccc(C)c(C)c1
BDBM50222769 CC(Oc1ccccc1)C(O)CNC(C)(C)C
BDBM50222722 CC(C)NCC(O)C(C)Oc1ccc2ccccc2c1
BDBM50222723 CC(Oc1ccccc1CC=C)C(O)CNC(C)(C)C
BDBM50222773 CC(C)NCC(O)C(C)Oc1ccccc1CC=C
BDBM50222770 CC(C)NCC(O)C(C)Oc1ccc(C)c(C)c1
BDBM50222772 CC(NC(C)(C)C)C(O)COc1ccccc1
BDBM50222774 CCc1ccc(OCC(O)C(C)NC(C)C)cc1
BDBM50222775 CC(C)NCC(O)C(C)Oc1ccc(Cl)c(Cl)c1
BDBM50222776 CC(Oc1ccc2ccccc2c1)C(O)CNC(C)(C)C
BDBM50223404 CC(C)NC(C)C(O)COc1ccc(C)c(C)c1
BDBM50222724 CCc1ccc(OC(C)C(O)CNC(C)(C)C)cc1
BDBM50222768 CCc1ccc(OC(C)C(O)CNC(C)C)cc1
BDBM50222725 CCc1ccc(OCC(O)C(C)NC(C)(C)C)cc1