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162 SMILES Strings for Beta-adrenergic receptor kinase 1

Compound NameSMILES String
BDBM3149 OC(=O)c1cccc(O)c1C(=O)c1c(O)cc(cc1O)C(=O)O[C@@H]1CCCNC[C@H]1NC(=O)c1ccc(O)cc1 |r|
BDBM25392 CC(C)NCC(O)c1ccc(O)c(O)c1
BDBM25770 CC(C)(C)NCC(O)c1cc(O)cc(O)c1
BDBM31715 OC(=O)c1cccc(c1)-n1[nH]c(=C)c(=CC=Cc2ccco2)c1=O |w:14.15|
BDBM31759 OC(=O)c1ccccc1-c1ccc(\C=c2/sc3nc4cc(Br)cnc4n3c2=O)o1
BDBM34235 CCOC(=O)C(C)Sc1nc2n(C)c(=O)[nH]c(=O)c2n1C\C=C(\C)Cl
BDBM46041 CC(C)NCC(=O)c1ccc(O)c(O)c1
BDBM48719 Cc1ccc(NC(=O)CN2C(=O)N\C(=C\c3cccn3-c3ccc(cc3)C(O)=O)C2=O)cc1
BDBM47934 Cc1cc2ccccc2n1CCNC(=O)c1cccs1
BDBM48373 Cc1cc(=O)[nH]c(SCC(=O)NCc2ccco2)n1
BDBM50236 OC(=O)C1Nc2c(cccc2C(O)=O)C2C(Cl)C(CC12)Sc1ccccc1[N+]([O-])=O
BDBM50714 CC(=C)C(=O)Nc1cccc(c1)C1=NOC2(C[C@H](N(C2)C(=O)c2ccc(Cl)cc2)C(N)=O)C1 |t:13|
BDBM50715 C\C=C\C(=O)N1CC2(C[C@@H]1C(N)=O)CC(=NO2)c1cccc(NC(=O)C(C)=C)c1 |c:15|
BDBM50716 CC(=C)C(=O)Nc1cccc(c1)C1=NOC2(C[C@@H](N(C2)C(=O)C(c2ccccc2)c2ccccc2)C(N)=O)C1 |t:13|
BDBM53121 COc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2ccco2)C1=O |w:15.16|
BDBM53267 OC(=O)c1ccc(cc1)-n1cccc1\C=C1\SC(=O)N(CC(=O)N2CCCC2)C1=O
BDBM51787 OC(=O)c1ccc(cc1Cl)-c1ccc(C=c2sc3nc4ccccc4n3c2=O)o1
BDBM54768 CC(C)(CS([O-])(=O)=O)NC(=O)CC[N+](C)(C)CCO
BDBM54754 OC(=O)c1c2CCC(=Cc3ccc(O)cc3)c2nc2ccccc12 |w:8.8|
BDBM54944 Oc1ccc(Cl)cc1N=Nc1c(O)c2c(O)cc(cc2cc1S([O-])(=O)=O)S([O-])(=O)=O |w:9.10|
BDBM55008 NC(=O)c1cc[n+](CC2=C(N3[C@H](SC2)[C@H](NC(=O)C(c2ccccc2)S([O-])(=O)=O)C3=O)C([O-])=O)cc1 |t:8|
BDBM57870 CCN1\C(Sc2ccc3sccc3c12)=C\c1ccc2cc(C)ccc2[n+]1CC
BDBM61066 [Br-].O=C(c1ccccc1)c1c-2c(cc3sc4ccccc4[n+]13)-c1cccc3cccc-2c13
BDBM61723 CCCCCC(=O)N1CC2(C[C@H]1C(N)=O)CC(=NO2)c1cccc(NC(=O)C(C)=C)c1 |c:17|
BDBM64129 CCc1ccccc1NC(=O)CCS(=O)(=O)c1ccc(OC)cc1
BDBM72975 CCOC(=O)CC(NS(=O)(=O)c1ccc2ncc(C(O)=O)c(O)c2c1)c1ccc(OCC)c(OC)c1
BDBM79514 [O-]C(=O)c1ccccc1-c1c2cc(I)c([O-])c(I)c2oc2c(I)c(=O)c(I)cc12 |(5.85,4.65,;5.85,3.11,;4.52,2.34,;7.18,2.34,;7.18,3.88,;8.52,4.65,;9.85,3.88,;9.85,2.34,;8.52,1.57,;8.52,.03,;9.85,-.74,;11.23,.08,;12.62,-.71,;13.95,.06,;12.62,-2.32,;13.95,-3.09,;11.23,-3.11,;11.21,-4.65,;9.85,-2.28,;8.52,-3.05,;7.18,-2.28,;5.81,-3.11,;5.82,-4.65,;4.41,-2.32,;3.08,-3.09,;4.41,-.71,;3.08,.06,;5.81,.08,;7.18,-.74,)|
BDBM79513 OC(=O)C1CCCCC1C(=O)Nc1cccc(Br)c1
BDBM79499 O=C(CSc1nc2ccccc2c(=O)n1-c1ccccc1)NC(=O)CN1CCCC1=O
BDBM79500 CC(=C)C(=O)Nc1cccc(c1)C1=NOC2(C[C@@H](N(C2)C(=O)c2ccccc2)C(N)=O)C1 |t:13|
BDBM79501 CC(=C)C(=O)Nc1cccc(c1)[C+]1CC2(CC(N(C2)C(=O)c2cc(cc(c2)[N+]([O-])=O)[N+]([O-])=O)C(N)=O)O[N-]1
BDBM79502 CC(=C)C(=O)Nc1cccc(c1)C1=NOC2(C[C@H](N(C2)C(=O)CC(c2ccccc2)c2ccccc2)C(N)=O)C1 |t:13|
BDBM79503 CCCCCC(=O)Nc1cccc(c1)C1=NOC2(C[C@H](N(C2)C(=O)c2ccc(OC)cc2)C(N)=O)C1 |t:15|
BDBM79504 CCOC(=O)C(C)N1C(=O)S\C(=C/c2ccc(o2)-c2ccccc2C(O)=O)C1=O
BDBM79505 CCOc1ccc(CCNC(=O)C2CC(C)=CCC2C(O)=O)cc1OCC |c:15|
BDBM79506 CCc1cccc(NC(=O)CCS(=O)(=O)c2ccc(Br)cc2)c1
BDBM79507 CCN(CC)c1ccc(NC(=O)CCS(=O)(=O)c2ccc(Br)cc2)c(C)c1
BDBM79508 COc1ccc(CNC(=O)CCS(=O)(=O)c2ccc(Br)cc2)cc1
BDBM79509 COc1ccc(cc1NC(=O)CCS(=O)(=O)c1ccc(Br)cc1)[N+]([O-])=O
BDBM79510 Cc1ccccc1NC(=O)CCS(=O)(=O)c1ccc(Br)s1
BDBM79511 CC(CS(=O)(=O)c1ccc2SCC(=O)Nc2c1)C(=O)NCc1ccccc1Cl
BDBM79512 CCCN(C(=O)c1cccc(c1)-n1cccc1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O
BDBM79496 CCCC[N+](C)(C)CCC(=O)NC(C)(C)CS([O-])(=O)=O
BDBM79497 OC(=O)C1CN(C(=O)C1)c1ccc2OCCOc2c1
BDBM79498 OC(=O)Cc1ccc(cc1)-n1cccc1
BDBM84342 CNCC(O)c1ccc(O)c(O)c1
BDBM92678 CC(C)(C)NCC(O)c1ccccc1
BDBM92679 CC(C)NCC(O)c1cccc(O)c1
BDBM92680 CC(C)NCC(O)c1ccc(O)cc1
BDBM50049820 NC(=O)c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2ncnc(N)c12 |r|
BDBM50113257 CCC(=O)n1nc2-c3ccccc3C(=O)c2c1C(C)(C)C
BDBM50113255 COC(=O)c1ccc(\C=C\c2ccc(o2)[N+]([O-])=O)o1
BDBM50113256 NC(=O)Cc1c(N)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
BDBM50295572 CC(C)NCC(O)c1cc(O)cc(O)c1
BDBM50384014 Cc1ccc(cc1)S(=O)(=O)NC(=O)Nc1ccc2nc(oc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50384015 Nc1ncc(cc1-c1nc2ccc(Nc3ccc(F)cc3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50384018 Nc1ncc(cc1-c1nc2ccc(NC(=O)Nc3ccccc3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50384019 Nc1ccc2nc(oc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50384020 Nc1ccc2oc(nc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50384021 Nc1ncc(cc1-c1nc2ccc(O)c(-c3ccccc3)c2o1)-c1cnn(c1)C1CCNCC1
BDBM50384024 Cc1c(O)ccc2nc(oc12)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50384025 Cc1cc2nc(oc2cc1O)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50384030 Nc1ncc(cc1-c1nc2ccc(Oc3ncccn3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50384034 CC(=O)Nc1ccc2oc(nc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50384035 CNc1ccc2oc(nc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50441685 CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CN)C(O)=O |r,wU:46.51,8.10,2.2,wD:54.59,35.43,24.32,14.21,4.4,(31.59,-26.8,;31.59,-25.27,;32.95,-24.49,;34.27,-25.25,;32.95,-22.91,;31.59,-22.13,;30.27,-22.9,;30.27,-24.47,;28.91,-22.11,;28.91,-20.59,;30.27,-19.8,;27.59,-22.88,;26.24,-22.1,;26.24,-20.57,;24.91,-22.86,;24.91,-24.42,;26.24,-25.19,;27.64,-24.59,;28.66,-25.75,;27.88,-27.08,;26.37,-26.75,;23.55,-22.08,;22.23,-22.84,;22.23,-24.41,;20.87,-22.05,;20.87,-20.53,;22.23,-19.74,;22.23,-18.21,;23.58,-17.43,;23.58,-15.9,;22.26,-15.14,;24.94,-15.12,;19.55,-22.82,;18.19,-22.04,;18.19,-20.51,;16.87,-22.8,;16.87,-24.36,;18.19,-25.13,;18.19,-26.7,;19.51,-27.47,;19.51,-29.03,;18.16,-29.81,;20.84,-29.79,;15.51,-22.02,;14.19,-22.78,;14.19,-24.35,;12.83,-22,;12.83,-20.47,;14.19,-19.69,;14.19,-18.16,;15.55,-20.47,;11.51,-22.77,;10.16,-21.98,;10.16,-20.45,;8.82,-22.75,;8.82,-24.31,;10.15,-25.08,;10.15,-26.64,;11.48,-24.31,;7.48,-21.97,;6.14,-22.75,;6.14,-24.29,;4.8,-21.97,;3.47,-22.74,;34.27,-22.16,;35.63,-22.94,;34.27,-20.63,)|
BDBM50444090 Nc1ncc(cc1-c1nc2ccc(cc2o1)N1CCCC1)-c1cnn(c1)C1CCNCC1
BDBM50444091 COc1ccc2nc(oc2c1-c1ccc2cn[nH]c2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444094 CCc1ccc2nc(oc2c1O)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444095 COc1ccc(cc1)-c1c(O)ccc2nc(oc12)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444097 Nc1ncc(cc1-c1nc2ccc(O)c(-c3ccc4cn[nH]c4c3)c2o1)-c1cnn(c1)C1CCNCC1
BDBM50444098 Nc1ncc(cc1-c1nc2cccc(-c3ccccn3)c2o1)-c1cccc(c1)C(=O)NCCN1CCOCC1
BDBM50444099 CN(C)COc1cccc(c1)-c1cnc(N)c(c1)-c1nc2cccc(-c3ccccn3)c2o1
BDBM50444100 CC(C)NC(=O)c1cc2nc(oc2cc1O)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444101 COc1ccc(cc1)-c1ccc2nc(oc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444102 CS(=O)(=O)Oc1ccc2nc(oc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444103 COc1ccc(cc1)C(=O)Nc1ccc2nc(oc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444104 Nc1ncc(cc1-c1nc2ccc(NC(=O)c3ccc(F)cc3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444105 Nc1ncc(cc1-c1nc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444106 Nc1ncc(cc1-c1nc2ccc(NC(=O)c3ccccc3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444107 Nc1ncc(cc1-c1nc2ccc(NC(=O)Nc3ccc(F)cc3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444108 COc1ccc(cc1)N(C(=O)Nc1ccc2nc(oc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1ccccc1
BDBM50444109 Nc1ncc(cc1-c1nc2ccc(Nc3ccccn3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444111 Nc1ncc(cc1-c1nc2ccc(Oc3ccc(nn3)-c3ccccc3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444112 Nc1ncc(cc1-c1nc2ccc(Oc3cc(ccn3)C#N)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444113 Nc1ncc(cc1-c1nc2ccc(Oc3cc(Cl)ccn3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444114 Nc1ncc(cc1-c1nc2ccc(Oc3ccc(F)cc3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444115 Nc1ncc(cc1-c1nc2ccc(OCc3ccc(F)cc3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444116 Nc1ncc(cc1-c1nc2ccc(cc2o1)-c1ccc2[nH]ncc2c1)-c1cnn(c1)C1CCNCC1
BDBM50444117 Nc1ncc(cc1-c1nc2ccc(Oc3ccccc3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444118 Nc1ncc(cc1-c1nc2ccc(OCc3ccccc3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444119 Nc1ncc(cc1-c1nc2ccc(cc2o1)-c1cn[nH]c1)-c1cnn(c1)C1CCNCC1
BDBM50444121 Nc1ncc(cc1-c1nc2ccc(Nc3cc(F)cc(F)c3)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444122 Nc1ncc(cc1-c1nc2ccc(Nc3c(F)cccc3F)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444123 Nc1ncc(cc1-c1nc2ccc(Nc3cc(cc(c3)C(F)(F)F)C(F)(F)F)cc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444124 CC(C)Nc1ccc2nc(oc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444125 Nc1ncc(cc1-c1nc2ccc(cc2o1)N1CCOCC1)-c1cnn(c1)C1CCNCC1
BDBM50444126 Nc1ncc(cc1-c1nc2ccc(cc2o1)N1CCCCC1)-c1cnn(c1)C1CCNCC1
BDBM50444127 Nc1ncc(cc1-c1nc2cc(ccc2o1)-c1ccccc1)-c1cnn(c1)C1CCNCC1
BDBM50444128 CCCNc1ccc2oc(nc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444129 CN(C)c1ccc2oc(nc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444130 CCCCNc1ccc2oc(nc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444132 Nc1ncc(cc1-c1nc2cc(Nc3ccccc3)ccc2o1)-c1cnn(c1)C1CCNCC1
BDBM50444133 CN(c1ccccc1)c1ccc2oc(nc2c1)-c1cc(cnc1N)-c1cnn(c1)C1CCNCC1
BDBM50444135 Nc1ncc(cc1-c1nc2cc(ccc2o1)N1CCCC1)-c1cnn(c1)C1CCNCC1
BDBM50444136 Nc1ncc(cc1-c1nc2cc(ccc2o1)N1CCOCC1)-c1cnn(c1)C1CCNCC1
BDBM50444137 Nc1ncc(cc1-c1nc2cc(ccc2o1)N1CCCCC1)-c1cnn(c1)C1CCNCC1
BDBM50135286 Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F
BDBM50134187 COCCN1CCC(CNC(=O)c2n[nH]c3ccc(cc23)-c2cccc(F)c2F)CC1
BDBM50173307 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCc1nccc2ccccc12)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173310 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCc1ccccn1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM258597 C[C@H](N)c1ccc(Oc2ccc3COB(O)c3c2C)c(F)c1 |r|
BDBM258598 C[C@@H](N)c1ccc(Oc2ccc3COB(O)c3c2C)c(F)c1 |r|
BDBM50173312 COc1cccc(CNC(=O)c2cc(ccc2F)C2NC(=O)NC(C)=C2C(=O)Nc2ccc3[nH]ncc3c2)c1 |c:25|
BDBM50173314 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCc1ccccc1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173317 CNC(=O)c1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:18|
BDBM50173318 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCc1c(cccc1C(F)(F)F)C(F)(F)F)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173319 COc1cccc(OC)c1CNC(=O)c1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:29|
BDBM50173320 CC1=C(C(NC(=O)N1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173323 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCc1c(F)cccc1F)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173324 COc1cccc(OC)c1CNC(=O)Cc1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:30|
BDBM50173325 COc1ccccc1CNC(=O)c1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:27|
BDBM50173326 CC1=C(C(NC(=O)N1)c1ccc(F)c(CC(=O)NCc2c(cccc2C(F)(F)F)C(F)(F)F)c1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173327 CC1=C(C(NC(=O)N1)c1ccc(F)c(CC(=O)NCc2c(C)cccc2C)c1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173328 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCCc1c(C)cccc1C)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173329 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCc1ncccc1C)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173330 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM258594 CC(N)c1ccc(Oc2ccc3COB(O)c3c2)c(F)c1
BDBM258595 Cc1c2B(O)OCc2ccc1Oc1ccc(CN)cc1F
BDBM258596 CC(N)c1ccc(Oc2ccc3COB(O)c3c2C)c(F)c1
BDBM258599 Cc1c2B(O)OCc2ccc1Oc1cccc(CNC(=O)OC(C)(C)C)c1F
BDBM258600 Cc1c2B(O)OCc2ccc1Oc1cccc(CN)c1F
BDBM50173305 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCCc1ccccn1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173306 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCCc1ccncc1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173308 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCc1c(Cl)cccc1Cl)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173309 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCc1c(C)cccc1C)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50173311 COc1ccc(CNC(=O)c2cc(ccc2F)C2NC(=O)NC(C)=C2C(=O)Nc2ccc3[nH]ncc3c2)cc1 |c:24|
BDBM50173315 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NCc1cccc(F)c1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM50191309 CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(O)=O |r|
BDBM50191320 OS(=O)(=O)O[C@H]1[C@H](OS(O)(=O)=O)[C@@H](OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@@H]1OS(O)(=O)=O |r|
BDBM50191322 CC[C@H](C)[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM50191323 O[C@H]1[C@H](O)[C@@H](O)[C@H](OP(O)(O)=O)[C@H](O)[C@@H]1O |r|
BDBM50191324 CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(O)=O |r|
BDBM50208911 CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3ccccc3)ncc12 |r|
BDBM50191315 CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(O)=O |r|
BDBM283993 CCC(C)N(C)C(=O)c1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:22|
BDBM283994 CC(CNC(=O)c1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1)N1CCCCCC1 |c:20|
BDBM283995 CN(CC1CCCCO1)C(=O)c1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:26|
BDBM283996 CCc1nc(CNC(=O)c2cc(ccc2F)C2NC(=O)NC(C)=C2C(=O)Nc2ccc3[nH]ncc3c2)no1 |c:23|
BDBM283997 COC(=O)C1(CCCCC1)NC(=O)c1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:28|
BDBM283998 COCc1noc(CNC(=O)c2cc(ccc2F)C2NC(=O)NC(C)=C2C(=O)Nc2ccc3[nH]ncc3c2)n1 |c:25|
BDBM283999 CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(=O)NC1CC2CC3(C)C2(C)C13C)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM284000 CN(Cc1cc(C)[nH]n1)C(=O)c1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:26|
BDBM284001 COc1ccccc1C(C)NC(=O)c1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:28|
BDBM284005 CC1=C(C(NC(=O)N1)c1ccc(F)c(CC(=O)N2CCOC(CCO)C2)c1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM284006 CC1=C(C(NC(=O)N1)c1ccc(F)c(CC(=O)N(CCO)Cc2ccco2)c1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM284007 CC1=C(C(NC(=O)N1)c1ccc(F)c(CC(=O)NCC2CCN(CC2)C2CC2)c1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM284008 CN(Cc1nc(C)c[nH]1)C(=O)Cc1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:27|
BDBM284009 CC1=C(C(NC(=O)N1)c1ccc(F)c(CC(=O)N(CC#C)Cc2ccco2)c1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|
BDBM284010 CC(C)CN(CC#C)C(=O)Cc1cc(ccc1F)C1NC(=O)NC(C)=C1C(=O)Nc1ccc2[nH]ncc2c1 |c:25|
BDBM284011 Cc1cnc(CNC(=O)CCc2cc(ccc2F)C2NC(=O)NC(C)=C2C(=O)Nc2ccc3[nH]ncc3c2)o1 |c:25|
BDBM284012 CC1=C(C(NC(=O)N1)c1ccc(F)c(CCC(=O)NCCc2ccccc2)c1)C(=O)Nc1ccc2[nH]ncc2c1 |t:1|