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261 SMILES Strings for Lactoylglutathione lyase

Compound NameSMILES String
BDBM7462 Oc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1O
BDBM7459 Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1
BDBM7460 Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
BDBM7457 Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
BDBM7461 Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccccc1
BDBM15236 Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O
BDBM16452 OC(=O)Cc1nn(Cc2nc3cc(ccc3s2)C(F)(F)F)c(=O)c2ccccc12
BDBM17638 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1
BDBM23419 Oc1ccc(cc1)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |r|
BDBM26658 Oc1ccc(c(O)c1)-c1oc2cc(O)cc(O)c2c(=O)c1O
BDBM54705 CC(C(O)=O)c1cccc(Oc2ccccc2)c1
BDBM54054 COc1ccc(\C=C(/CC(O)=O)c2nc3ccccc3o2)cc1
BDBM58565 Cc1ccc2cccc(NS(=O)(=O)c3ccccc3)c2n1
BDBM62042 COc1ccc(cc1)C(=O)Nc1ccccc1C(O)=O
BDBM50009001 Oc1cc2oc(cc(=O)c2c(O)c1O)-c1ccccc1
BDBM50012899 CC1=C(CC(O)=O)c2cc(F)ccc2\C1=C/c1ccc(cc1)S(C)=O |c:1|
BDBM50022271 CC(C(O)=O)c1cccc(c1)C(=O)c1ccccc1
BDBM50027952 Cc1cc(CC(O)=O)n(C)c1C(=O)c1ccc(Cl)cc1
BDBM50039108 [NH3+]C(CCC(=O)NC(CSC(=O)N(O)c1ccc(Cl)cc1)C(=O)NCC([O-])=O)C([O-])=O
BDBM50039109 C[C@@H](O)C(=O)SCC(C([NH3+])C([O-])=O)C([O-])=O
BDBM50039110 CN(O)C(=O)SCC(C([NH3+])C([O-])=O)C([O-])=O
BDBM50039111 [NH3+]C(CCC(=O)NC(CSC(=O)N(O)c1ccc(Br)cc1)C(=O)NCC([O-])=O)C([O-])=O
BDBM50039112 CNC(=O)SCC(C([NH3+])C([O-])=O)C([O-])=O
BDBM50039113 [NH3+]C(CCC(=O)NC(CSC(=O)N(O)c1ccccc1)C(=O)NCC([O-])=O)C([O-])=O
BDBM50039114 CCC(=O)SCC(C([NH3+])C([O-])=O)C([O-])=O
BDBM50039115 CCOC(=O)C(CSC(=O)N(C)O)C([NH3+])C([O-])=O
BDBM50039116 CCOC(=O)C(CSC(=O)[C@@H](C)O)C([NH3+])C([O-])=O
BDBM50045936 Oc1cc(O)cc(\C=C\c2ccc(O)c(O)c2)c1
BDBM50126960 ON(C(=O)SCC(NC(=O)CCC(NCCC(=O)OCCNC(=O)CCNC(=O)CC(=O)NCCNC(=O)CC(=O)NCCC(=O)NCCOC(=O)CCNC(CCC(=O)NC(CSC(=O)N(O)c1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O)C(O)=O)C(=O)NCC(O)=O)c1ccc(Br)cc1
BDBM50059989 Oc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(O)cc2)cc1 |w:12.11,5.4|
BDBM50067040 COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O |w:12.11,5.4|
BDBM50069024 CN(O)C(=O)CCC(NC(=O)CCC([NH3+])C([O-])=O)C(=O)NCC(O)=O
BDBM50069025 [NH3+]C(CCC(=O)NC(CCC(=O)NO)C(=O)NCC(O)=O)C([O-])=O
BDBM50069026 CCOC(=O)CNC(=O)C(CCC(=O)N(C)O)NC(=O)CCC([NH3+])C([O-])=O
BDBM50069027 CCOC(=O)CNC(=O)C(CCC(=O)NO)NC(=O)CCC([NH3+])C([O-])=O
BDBM50076046 NC(CNC(=O)NC(CSCc1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50092822 CCCCN(O)C(=O)SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50092823 CN(O)C(=O)SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50092824 N[C@@H](CCC(=O)N[C@@H](CSC(=O)N(O)c1ccc(Cl)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50092825 N[C@@H](CCC(=O)N[C@@H](CSC(=O)N(O)c1ccccc1)C(=O)NCC(O)=O)C(O)=O
BDBM50092826 N[C@@H](CCC(=O)N[C@@H](CSC(=O)N(O)c1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50092827 CCCCCCN(O)C(=O)SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50092828 N[C@@H](CCC(=O)N[C@@H](CSC(=O)NO)C(=O)NCC(O)=O)C(O)=O
BDBM50092829 CCCN(O)C(=O)SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50092830 CCCCCN(O)C(=O)SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50092831 CCCCCCCN(O)C(=O)SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50092832 CCN(O)C(=O)SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50160866 NC(CCC(=O)NC(CSCC1C[C@@H](O)[C@@H](O)C(=O)C1=O)C(=O)NCC(O)=O)C(O)=O
BDBM50227494 O=S(=O)(Nc1cccc2cccnc12)c1ccccc1
BDBM50233538 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O |r,t:19|
BDBM50241121 N[C@@H](CCC(=O)N[C@@H](CSCc1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O |r|
BDBM50241503 Oc1cc2oc(c(O)cc2c(=[OH+])c1)-c1ccc(O)c(O)c1
BDBM50295287 Cc1ccc(cc1)C(=O)c1ccc(CC(O)=O)n1C
BDBM50297424 CCOC(=O)\C=C\c1ccc(O)c(OC)c1
BDBM50326998 Oc1ccc(cc1)-c1oc2cc(O)cc(=[OH+])c2cc1O
BDBM50326997 Oc1cc2oc(c(O)cc2c(=[OH+])c1)-c1cc(O)c(O)c(O)c1
BDBM50317343 Cc1ccc2cccc(NS(C)(=O)=O)c2n1
BDBM50336255 O=C(CC(=O)C=Cc1ccco1)C=Cc1ccco1 |w:13.14,5.4|
BDBM50343659 OC(=O)c1ccc(cc1)N=Nc1ccc(O)c2ncccc12 |w:9.9|
BDBM50336268 CCOC(=O)C(=CC=C(C(C)=O)C(=O)OCC)C(C)=O |w:6.6,8.8|
BDBM50336269 COC(=O)\C=C\c1ccc(F)cc1
BDBM50336270 NC(=O)\C=C\c1ccc(F)cc1
BDBM50336271 COc1cc(C=CC(=O)CC(C)=O)ccc1O |w:5.4|
BDBM50336272 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)OCC(O)=O)c2c1
BDBM50336251 Fc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(F)cc2)cc1 |w:13.13,6.6|
BDBM50336252 COc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(O)cc2)cc1OC |w:6.5,13.12|
BDBM50336253 COc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(CO)o2)cc1 |w:14.14,7.7|
BDBM50336254 COc1cc(C=CC(=O)CC(=O)C=Cc2ccc[nH]2)ccc1O |w:5.4,12.11|
BDBM50336256 [#6]-[#8]-c1ccc(\[#6]=[#6](/[#6](=O)/[#6]=[#6]/c2ccc(-[#8])c(-[#8]-[#6])c2)-[#6](=O)\[#6]=[#6]\c2ccc(-[#8])c(-[#8]-[#6])c2)cc1-[#8]-[#6]
BDBM50336257 [#6]-[#8]-c1cc(\[#6]=[#6]\[#6](=O)-[#6](=[#6]/c2cccc(F)c2)\[#6](=O)\[#6]=[#6]\c2ccc(-[#8])c(-[#8]-[#6])c2)ccc1-[#8]
BDBM50336258 [#6]-[#8]-c1cc(\[#6]=[#6]\[#6](=O)-[#6](=[#6]/c2ccc(F)cc2)\[#6](=O)\[#6]=[#6]\c2ccc(-[#8])c(-[#8]-[#6])c2)ccc1-[#8]
BDBM50336259 [#6]-[#8]-c1ccc(\[#6]=[#6]\[#6](=O)-[#6](=[#6]/c2ccc(-[#6]=O)c(-[#6]=O)c2)\[#6](=O)\[#6]=[#6]\c2ccc(-[#8]-[#6])c(-[#8]-[#6])c2)cc1-[#8]-[#6]
BDBM50336260 COc1ccc(C=CC(=O)C(C=O)C(=O)C=Cc2ccc(OC)cc2)cc1 |w:7.7,16.16|
BDBM50336261 [#6]-[#8]-c1cc(\[#6]=[#6]\[#6](=O)-[#6](=[#6]/c2ccc(-[#8])c(-[#8]-[#6])c2)\[#6](=O)\[#6]=[#6]\c2ccc(-[#8])c(-[#8]-[#6])c2)ccc1-[#8]
BDBM50336262 [#6]-[#8]-c1ccc(\[#6]=[#6](\[#6](-[#6])=O)-[#6](-[#6])=O)cc1
BDBM50336263 [#6]-[#6](=O)-[#6](=[#6]\c1cccc(c1)-[#7+](-[#8-])=O)\[#6](-[#6])=O
BDBM50336264 [#6]-[#6](=O)-[#6](=[#6]\c1ccc(o1)-[#7+](-[#8-])=O)\[#6](-[#6])=O
BDBM50336265 [#8]-[#6](=O)-[#6](=[#6]\c1cccc(c1)-[#7+](-[#8-])=O)\[#6](-[#8])=O
BDBM50336266 CCOC(=O)C(=Cc1ccc(cc1)[N+]([O-])=O)C(C)=O |w:6.6|
BDBM50336267 CCOC(=O)C(=Cc1cccc(c1)[N+]([O-])=O)C(C)=O |w:6.6|
BDBM50355547 COc1ccc(\C=C(\CC(O)=O)c2nc3ccccc3s2)cc1
BDBM50355548 COc1ccc(cc1)C(=O)Nc1sc2CCCCc2c1C(O)=O
BDBM50372518 O=S(=O)(Nc1cccc2cccnc12)c1cccs1
BDBM50384788 [#6]\[#6](-[#6])=[#6]/[#6]-[#6]-1-[#6](=O)-[#6](=O)-c2ccccc2-[#6]-1=O
BDBM50402209 CCCCc1cc(-c2ccccc2)n(O)c(=O)c1
BDBM50402210 CCC#Cc1cc(-c2ccccc2)n(O)c(=O)c1
BDBM50402211 On1c(cc(cc1=O)-c1ccc(cc1)-c1ccccc1)-c1ccccc1
BDBM50402212 On1c(cc(cc1=O)-c1ccc(cc1)C(F)(F)F)-c1ccccc1
BDBM50402213 On1c(cc(cc1=O)-c1cccnc1)-c1ccccc1
BDBM50402214 On1c(cc(cc1=O)-c1ccsc1)-c1ccccc1
BDBM50402215 On1c(cc(cc1=O)-c1ccccc1)-c1ccccc1
BDBM50402199 CCCCCn1ccc2cc(cnc12)-c1cc(cc(=O)n1O)-c1ccccc1
BDBM50402200 CCCCn1ccc2cc(cnc12)-c1cc(cc(=O)n1O)-c1ccccc1
BDBM50402201 COCCCn1ccc2cc(ccc12)-c1cc(cc(=O)n1O)-c1ccccc1
BDBM50402202 COCCCn1ccc2cc(cnc12)-c1cc(cc(=O)n1O)-c1ccccc1
BDBM50402203 COCCn1ccc2cc(ccc12)-c1cc(cc(=O)n1O)-c1ccccc1
BDBM50402204 COCCn1ccc2cc(cnc12)-c1cc(cc(=O)n1O)-c1ccccc1
BDBM50402205 NC(=O)c1cccc(Cn2ccc3cc(ccc23)-c2cc(cc(=O)n2O)-c2ccccc2)c1
BDBM50402206 NC(=O)c1cccc(Cn2ccc3cc(cnc23)-c2cc(cc(=O)n2O)-c2ccccc2)c1
BDBM50402207 On1c(cc(cc1=O)-c1ccccc1)-c1ccc2[nH]ccc2c1
BDBM50402208 On1c(cc(cc1=O)-c1ccccc1)-c1cnc2[nH]ccc2c1
BDBM50422268 N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(O)=O)C(O)=O |r|
BDBM50016877 CCCCSC(=O)C(C)O
BDBM50016878 CC(O)C(=O)SCc1ccccc1
BDBM50016879 CCCCSC(=O)C(O)c1ccccc1
BDBM50016889 COC(=O)CSC(=O)C(O)c1ccccc1
BDBM50016896 COC(=O)CCSC(=O)C(O)c1ccccc1
BDBM50016880 OC(C(=O)SCc1ccccc1)c1ccccc1
BDBM50016893 CCCCOC(=O)CSC(=O)C(O)c1ccccc1
BDBM50126958 CC(=O)CNC(CCC(=O)NC(CSC(=O)N(O)c1ccc(Cl)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50126959 NCCC(=O)NC(CCC(=O)NC(CSC(=O)N(O)c1ccc(Cl)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50126961 ON(C(=O)SCC(NC(=O)CCC(NCCC(=O)OCCOCCOCCOCCNC(=O)CCCCCCC(=O)NCCCOCCOCCOCCCNC(=O)CCCCCCC(=O)NCCOCCOCCOCCOC(=O)CCNC(CCC(=O)NC(CSC(=O)N(O)c1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O)C(O)=O)C(=O)NCC(O)=O)c1ccc(Br)cc1
BDBM224012 Sc1cccc2cc(cnc12)C(=O)NCCc1nccs1
BDBM50140172 COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O
BDBM50126957 CCOC(=O)CCNC(CCC(=O)NC(CSC(=O)N(O)c1ccc(Cl)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM225232 CSC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50227425 Clc1c(OCCCBr)oc(=O)c2cc(NC(=O)Nc3ccccc3)ccc12
BDBM50227427 Cc1ccc(CSCC(NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O)cc1
BDBM50227428 N[C@@H](CCC(=O)NC(CSCc1ccccc1Cl)C(=O)NCC(O)=O)C(O)=O
BDBM50227429 N[C@@H](CCC(=O)NC(CSCc1cccc(c1)C(F)(F)F)C(=O)NCC(O)=O)C(O)=O
BDBM50227432 N[C@@H](CCC(=O)NC(CSCC(=O)c1ccc(cc1)-c1ccccc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227434 Cc1occc(=O)c1O
BDBM50227438 CCCCCSCC(NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50227439 OC(=O)CCCC(=O)NC(CSCc1ccc(Br)cc1)C(=O)NCC(O)=O
BDBM50227440 N[C@@H](CCC(=O)NC(CSCc1ccccc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227441 N[C@@H](CCC(=O)NC(CSCc1ccc(F)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227442 N[C@@H](CCC(=O)NC(CSCCCCc1ccccc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227444 N[C@@H](CCC(=O)NC(CSCc1cccc(Cl)c1)C(=O)NCC(O)=O)C(O)=O
BDBM50227445 N[C@@H](CCC(=O)NC(CSCCCc1ccccc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227446 CCCCSCC(NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50227447 N[C@@H](CCC(=O)NC(CSCC(=O)c1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227449 N[C@@H](CCC(=O)NC(CSCCCCCc1ccccc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227450 Cc1cccc(CSCC(NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O)c1
BDBM50227452 CCCCCCCCSCC(NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50227454 N[C@@H](CCC(=O)NC(CSCC(=O)c1ccc(N)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227455 CCOC(=O)c1oc2cc(O)cc(O)c2c(=O)c1-c1ccc(OC)cc1
BDBM50227419 N[C@@H](CCC(=O)NC(CSCCc1ccccc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227421 CCSC[C@@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50227424 N[C@@H](CCC(=O)NC(CSCCC(=O)c1ccccc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227416 N[C@@H](CCC(=O)NC(CSCc1ccc(Cl)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227417 N[C@@H](CCC(=O)NC(CSCC(=O)c1ccccc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227418 N[C@@H](CCC(=O)NC(CSCC(=O)c1ccc(Cl)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227422 N[C@@H](CCC(=O)NC(CSCC(=O)c1ccc(O)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227430 COc1ccc(CSCC(NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O)cc1
BDBM50227436 CCCCCCCSCC(NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50227448 CCCSCC(NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
BDBM50227453 CC(=O)N[C@@H](CCC(=O)NC(CSCc1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O
BDBM50227431 N[C@@H](CCC(=O)NC(CSCc1ccc(cc1)C#N)C(=O)NCC(O)=O)C(O)=O
BDBM50277834 COc1ccc(cc1)S(=O)(=O)Nc1cccc2cccnc12
BDBM50277922 CS(=O)(=O)Nc1cccc2cccnc12
BDBM50517451 O=S(=O)(Nc1cccc2cccnc12)c1cccnc1
BDBM50517470 CS(=O)(=O)Nc1ccc(-c2ccc3OCOc3c2)c2cccnc12
BDBM50517472 CS(=O)(=O)Nc1ccc(N2CCCCC2)c2cccnc12
BDBM50517473 COc1ccc(cc1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12
BDBM50517459 CC(=O)Nc1cccc2cccnc12
BDBM50517460 CS(=O)(=O)Oc1cccc2cccnc12
BDBM50517478 CS(=O)(=O)Nc1cccc2ncccc12
BDBM50517479 CS(=O)(=O)Nc1ccc(-c2ccco2)c2cccnc12
BDBM50517480 CS(=O)(=O)Nc1ccc(-c2ccccc2)c2cccnc12
BDBM50517436 CS(=O)(=O)Nc1ccc(N2CCOCC2)c2cccnc12
BDBM50517437 O=S(=O)(Nc1ccc(CCc2ccccc2)c2cccnc12)c1ccccn1
BDBM50517440 COc1ccccc1S(=O)(=O)Nc1cccc2cccnc12
BDBM50517441 CS(=O)(=O)Nc1ccc(-c2ccc(F)c(F)c2)c2cccnc12
BDBM50517444 O=S(=O)(CCCc1ccccc1)Nc1cccc2cccnc12
BDBM50517445 O=S(=O)(CCc1ccccc1)Nc1cccc2cccnc12
BDBM50517447 O=S(=O)(Nc1cccc2cccnc12)c1ccc2ccccc2c1
BDBM50517453 O=S(=O)(Nc1cccc2cccnc12)c1cccc(c1)C#N
BDBM50517454 COc1cccc(c1)S(=O)(=O)Nc1cccc2cccnc12
BDBM50517455 Cn1cc(cn1)S(=O)(=O)Nc1cccc2cccnc12
BDBM50517456 O=S(=O)(Nc1cccc2cccnc12)C1CCCCC1
BDBM50517457 CCCCS(=O)(=O)Nc1cccc2cccnc12
BDBM50517461 COc1cc(OC)cc(c1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12
BDBM50517465 Clc1ccc(cc1Cl)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12
BDBM50517466 COc1ccc(cc1Cl)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12
BDBM50517468 Clc1cccc(c1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12
BDBM50517475 CS(=O)(=O)Nc1cccc2ccncc12
BDBM50517477 Fc1ccc(cc1)S(=O)(=O)Nc1cccc2cccnc12
BDBM50517481 O=S(=O)(Nc1cccc2cccnc12)c1ccc2ncsc2c1
BDBM50517482 O=S(=O)(Nc1cccc2cccnc12)c1ccc2OCOc2c1
BDBM50517484 O=S(=O)(Nc1cccc2cccnc12)c1ccccc1C#N
BDBM50517485 Cn1cnc(c1)S(=O)(=O)Nc1cccc2cccnc12
BDBM50526942 N[C@@H](CCC(=O)N[C@@H](CSC(=O)N(O)c1ccc(I)cc1)C(=O)NCC(O)=O)C(O)=O |r|
BDBM50526943 N[C@@H](CCC(=O)N[C@@H](CCC(=O)N(O)c1cccc(c1)C#C)C(=O)NCC(O)=O)C(O)=O |r|
BDBM50526944 N[C@@H](CCC(=O)N[C@@H](CSC(=O)N(O)c1ccc(cc1)C#C)C(=O)NCC(O)=O)C(O)=O |r|
BDBM50526945 ON(C(=O)SC[C@H](NC(=O)CC[C@H](NC(=O)CCNC(=O)CCNC(=O)CCNC(=O)CCNC(=O)CCNC(=O)CCNC(=O)CCCCCCC(=O)NCCC(=O)NCCC(=O)NCCC(=O)NCCC(=O)NCCC(=O)NCCC(=O)N[C@@H](CCC(=O)N[C@@H](CSC(=O)N(O)c1ccc(Cl)cc1)C(=O)NCC(O)=O)C(O)=O)C(O)=O)C(=O)NCC(O)=O)c1ccc(Cl)cc1 |r|
BDBM50526946 NS(=O)(=O)c1ccc2C(=O)NS(=O)(=O)c2c1
BDBM50526947 Cc1cc(O)c(O)c(Oc2cc(C)c(C(O)=O)c(O)c2)c1
BDBM50526948 N[C@@H](CCC(=O)N[C@@H](CSC(=O)N(O)c1cccc(c1)C#C)C(=O)NCC(O)=O)C(O)=O |r|
BDBM50517438 O=S(=O)(Cc1ccccc1)Nc1cccc2cccnc12
BDBM50517439 O=S(=O)(Nc1cccc2cccnc12)c1ccc(cn1)N1CCOCC1
BDBM50517442 CS(=O)(=O)Nc1ccc(-c2ccc(Cl)cc2)c2cccnc12
BDBM50517443 CS(=O)(=O)Nc1ccc(-c2cncnc2)c2cccnc12
BDBM50517446 CSc1nc2ccc(cc2s1)S(=O)(=O)Nc1cccc2cccnc12
BDBM50517448 O=C1Cc2cc(ccc2N1)S(=O)(=O)Nc1cccc2cccnc12
BDBM50517449 Fc1ccc(cc1F)S(=O)(=O)Nc1cccc2cccnc12
BDBM50517450 CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1cccc2cccnc12
BDBM50517452 O=S(=O)(Nc1cccc2cccnc12)c1ccc(cc1)C#N
BDBM50517458 CC(C)S(=O)(=O)Nc1cccc2cccnc12
BDBM50517462 O=S(=O)(Nc1cc(CCc2ccccc2)cc2cccnc12)c1ccccn1
BDBM50517463 Fc1ccc(CCc2ccc(NS(=O)(=O)c3ccccn3)c3ncccc23)cc1
BDBM50517464 COC(=O)c1c(C)cc(Oc2cc(C)cc(O)c2O)cc1O
BDBM50517467 COc1cccc(c1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12
BDBM50517469 Clc1ccc(cc1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12
BDBM50517471 Fc1ccc(cc1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12
BDBM50517474 O=S(=O)(Nc1ccc(-c2ccccc2)c2cccnc12)c1ccccn1
BDBM50517476 CS(=O)(=O)Nc1ccc(-c2ccncc2)c2cccnc12
BDBM50517483 O=S(=O)(Nc1cccc2cccnc12)c1ccccn1
BDBM50517486 O=S(=O)(Nc1cccc2cccnc12)C1CC1
BDBM50517487 CNS(=O)(=O)c1cccc2cccnc12
BDBM50517488 COc1cc(CCc2cc(NS(=O)(=O)c3ccccn3)c3ncccc3c2)cc(OC)c1
BDBM50517489 Fc1ccc(CCc2cc(NS(=O)(=O)c3ccccn3)c3ncccc3c2)cc1
BDBM50517490 CS(=O)(=O)Nc1ccc(-c2cccs2)c2cccnc12
BDBM50543568 CC(C)(O)[C@@H]1Cc2c(O1)cc(O)c1c2occ(-c2ccc(O)cc2)c1=O |r|
BDBM50543569 CC(C)(O)[C@H]1Cc2c(O1)cc(O)c1c2occ(-c2ccc(O)cc2)c1=O |r|
BDBM50543570 CC(C)(O)C1Cc2c(O1)cc(O)c1c2occ(-c2ccc(O)cc2)c1=O
BDBM50556275 Cc1ccccc1-c1n[nH]c(=S)n1\N=C\c1ccc(O)cc1O
BDBM50556274 Cc1ccccc1-c1n[nH]c(=S)n1\N=C\c1ccccc1C(O)=O
BDBM50556276 Cc1ccccc1-c1n[nH]c(=S)n1\N=C\c1ccc(OCc2ccccc2)cc1
BDBM50556277 OC(=O)c1ccccc1\C=N\n1c(n[nH]c1=S)-c1ccccc1
BDBM50556278 OC(=O)c1ccccc1\C=N\n1c(n[nH]c1=S)-c1ccc2ccccc2c1
BDBM50556279 OC(=O)c1ccccc1\C=N\n1c(Cc2ccc3ccccc3c2)n[nH]c1=S
BDBM50556280 S=c1[nH]nc(-c2cccc(c2)-c2ccccc2)n1\N=C\c1ccc(OCc2ccccc2)cc1
BDBM50560150 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1ccc(O)c2ncccc12
BDBM50560151 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1ccc(N)c2cc(O)ccc12
BDBM50560152 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1ccc(N)c2cccc(O)c12
BDBM50560153 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1ccc(N)c2ccccc12
BDBM50560154 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1c(O)ccc2ccccc12
BDBM50560155 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1c(O)ccc2cccc(N)c12
BDBM50560156 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1cc2ccccc2c(C=O)c1O
BDBM50560157 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1cc2ccc(=O)oc2cc1O
BDBM50560158 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1ccc(O)c(c1)C(O)=O
BDBM50560159 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1cc(C(O)=O)c(O)c2ccccc12
BDBM50560160 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1cc2ccccc2c(C(O)=O)c1O
BDBM50560161 Nc1ccc(\N=N\c2cccc(c2)S(N)(=O)=O)c2ccc(O)cc12
BDBM50560162 Nc1ccc(\N=N\c2cccc(c2)S(N)(=O)=O)c2ccccc12
BDBM50560163 NS(=O)(=O)c1cccc(c1)\N=N\c1c(O)ccc2ccccc12
BDBM50560164 NS(=O)(=O)c1cccc(c1)\N=N\c1cc2ccc(=O)oc2cc1O
BDBM50560165 NS(=O)(=O)c1cccc(c1)\N=N\c1ccc(O)c(c1)C(O)=O
BDBM50560166 NS(=O)(=O)c1cccc(c1)\N=N\c1cc(C(O)=O)c(O)c2ccccc12
BDBM50560167 NS(=O)(=O)c1cccc(c1)\N=N\c1ccc(O)c2ncccc12
BDBM50560168 NS(=O)(=O)c1cccc(c1)\N=N\c1ccc(O)c2ccccc12
BDBM50560169 NS(=O)(=O)c1cccc(c1)\N=N\c1ccc(O)cc1
BDBM50560170 Oc1ccc(\N=N\c2ccccc2)c2cccnc12
BDBM50560171 OC(=O)c1cccc(c1)\N=N\c1ccc(O)c2ncccc12
BDBM50560172 Oc1ccc(\N=N\c2ccc(cc2)S(O)(=O)=O)c2cccnc12
BDBM50560173 Cc1ccc(cc1S(N)(=O)=O)\N=N\c1ccc(N)c2ccc(O)cc12
BDBM50569120 COc1ccc(\C=C(/CC(O)=O)c2nc3ccccc3s2)cc1
BDBM50569121 COc1cccc(\C=C(/CC(O)=O)c2nc3ccccc3s2)c1
BDBM50569126 Cc1ccc(\C=C(/CC(O)=O)c2nc3ccccc3s2)cc1
BDBM50569127 OC(=O)C\C(=C/c1ccc(CC(O)=O)cc1)c1nc2ccccc2s1
BDBM50569128 COC(=O)Cc1ccc(\C=C(/CC(O)=O)c2nc3ccccc3s2)cc1
BDBM50569129 OC(=O)C\C(=C/c1ccc2ccccc2c1)c1nc2ccccc2s1
BDBM50569130 OC(=O)C\C(=C/c1ccc2OCOc2c1)c1nc2ccccc2s1
BDBM50569131 OC(=O)C\C(=C/c1cc2OCOc2c(Br)c1)c1nc2ccccc2s1
BDBM50569132 OC(=O)C\C(=C/c1ccc(Br)cc1)c1nc2ccccc2s1
BDBM50569133 CCOc1cc(\C=C(/CC(O)=O)c2nc3ccccc3[nH]2)ccc1OCC(=O)Nc1ccccc1
BDBM50569134 Cc1nn(C2CCS(=O)(=O)C2)c(C)c1\C=C(/CC(O)=O)c1nc2ccccc2[nH]1
BDBM50569122 COc1ccccc1\C=C(/CC(O)=O)c1nc2ccccc2s1
BDBM50569123 OC(=O)C\C(=C/c1ccc(O)cc1)c1nc2ccccc2s1
BDBM50569124 OC(=O)COc1ccc(\C=C(/CC(O)=O)c2nc3ccccc3s2)cc1
BDBM50569125 COC(=O)c1ccc(\C=C(/CC(O)=O)c2nc3ccccc3s2)cc1