SMILES for L-lactate dehydrogenase B chain

441 SMILES Strings for L-lactate dehydrogenase B chain

Compound Name

SMILES String

BDBM50534309

CC(=O)N1CCN(CC1)c1ccc(cc1)C1(CC(O)=C(Sc2ccccc2Cl)C(=O)N1)c1ccsc1 |t:20|

BDBM50597900

CC(=O)Nc1cccc(c1)C1(CC(O)=C(Sc2ccccc2Cl)C(=O)O1)c1ccsc1 |t:14|

BDBM519572

CC(=O)OC1=C(Sc2cc(Cl)ccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |c:4|

BDBM519560

CC(=O)OC1=C(Sc2ccc(F)cc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(OCC2CCCC2)n1 |c:4|

BDBM50465088

CC(=O)c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM519573

CC(C)(C)C(=O)OC1=C(Sc2cc(Cl)ccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |c:7|

BDBM489160

CC(C)(C)NC(=O)c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616974

CC(C)(C)NC(=O)c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(cc1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488238

CC(C)(C)c1ccc(cc1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616959

CC(C)(C)c1ccc(cc1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50546995

CC(C)(C)c1ccc(s1)C#Cc1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488237

CC(C)(C)c1cccc(c1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM234446

CC(C)CNC(=O)C([O-])=O

BDBM519571

CC(C)COC(=O)OC1=C(Sc2cc(Cl)ccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |c:8|

BDBM519577

CC(C)COC(=O)OC1=C(Sc2ccc(F)cc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |c:8|

BDBM488272

CC(C)Cc1ccc(cc1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488271

CC(C)Cc1ccc(cc1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM617001

CC(C)Cc1ccc(cc1)-c1cccc(c1)-c1nn(c(CCC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50569439

CC(C)N1CC2(C1)CN(C2)c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50089926

CC(C)Oc1ccc(Cl)c(C2CC(O)=C(Sc3cc(O)ccc3C#N)C(=O)C2)c1Cl |t:13|

BDBM50089928

CC(C)Oc1ccc(Cl)c(C2CC(O)=C(Sc3cc(O)ccc3Cl)C(=O)C2)c1Cl |t:13|

BDBM50010438

CC(C)c1c(O)c(O)c(C#N)c2c(OC(C)=O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C#N)c2c1OC(C)=O |(.71,-9.15,;2.04,-8.36,;3.37,-9.15,;2.04,-6.82,;.71,-6.07,;-.65,-6.84,;.71,-4.51,;-.65,-3.72,;2.04,-3.74,;2.04,-2.2,;2.04,-.66,;3.37,-4.51,;4.67,-3.74,;4.67,-2.2,;6,-1.42,;7.33,-2.18,;5.98,.12,;6,-4.51,;6,-6.07,;6,-7.17,;4.67,-6.82,;3.37,-6.07,;8.66,-4.51,;8.66,-6.07,;8.68,-7.17,;9.99,-6.82,;11.29,-6.07,;12.61,-6.82,;12.61,-8.36,;13.96,-9.15,;11.29,-9.15,;13.96,-6.07,;15.31,-6.84,;13.96,-4.51,;15.31,-3.72,;12.61,-3.74,;12.61,-2.2,;12.61,-.66,;11.29,-4.51,;9.99,-3.74,;9.99,-2.2,;8.89,-1.1,;7.4,-1.49,;9.29,.39,)|

BDBM50066981

CC(C)c1c(O)c(O)c(C(O)=O)c2cc(C)c(C)cc12

BDBM50144770

CC(C)c1c(O)c(O)c(C(O)=O)c2cc(Cc3ccc(Cl)cc3)c(C)cc12

BDBM50066973

CC(C)c1c(O)c(O)c(C(O)=O)c2cc(Cc3ccc(cc3)C(F)(F)F)c(C)cc12

BDBM50066975

CC(C)c1c(O)c(O)c(C(O)=O)c2cc(Cc3ccccc3)c(C)cc12

BDBM50144776

CC(C)c1c(O)c(O)c(C(O)=O)c2cc(c(C)cc12)-c1ccc(C)cc1

BDBM50144793

CC(C)c1c(O)c(O)c(C(O)=O)c2cc(c(C)cc12)-c1cccc(C)c1

BDBM50144743

CC(C)c1c(O)c(O)c(C(O)=O)c2cc(c(C)cc12)-c1ccccc1C

BDBM50139139

CC(C)c1c(O)c(O)c(C(O)=O)c2cc(ccc12)-c1cc2c(C(O)=O)c(O)c(O)c(C(C)C)c2cc1C

BDBM50031638

CC(C)c1c(O)c(O)c(C(O)=O)c2ccc(C)cc12

BDBM23223

CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O |(-4.44,-1.63,;-5.78,-.86,;-7.11,-1.63,;-5.78,.68,;-7.11,1.45,;-8.44,.68,;-7.11,2.99,;-8.44,3.76,;-5.78,3.76,;-5.78,5.3,;-4.44,6.07,;-4.44,2.99,;-3.11,3.76,;-3.11,5.3,;-1.77,2.99,;-1.77,1.45,;-.44,.68,;-3.11,.68,;-4.44,1.45,;-.44,3.76,;-.44,5.3,;-1.77,6.07,;.89,6.07,;2.23,5.3,;3.56,6.07,;3.56,7.61,;4.89,8.38,;2.23,8.38,;4.89,5.3,;6.23,6.07,;4.89,3.76,;6.23,2.99,;3.56,2.99,;3.56,1.45,;4.89,.68,;2.23,3.76,;.89,2.99,;.89,1.45,)|

BDBM50010448

CC(C)c1c(O)c(O)c2C(=N)Oc3c(c(C)cc1c23)-c1c2OC(=N)c3c(O)c(O)c(C(C)C)c(cc1C)c23 |(17.54,-15.98,;16.19,-15.21,;14.86,-15.98,;16.19,-13.65,;17.54,-12.91,;18.85,-13.69,;17.54,-11.35,;18.85,-10.58,;16.19,-10.58,;16.18,-9.03,;17.26,-7.93,;13.55,-9.03,;13.55,-10.58,;12.21,-11.35,;12.21,-12.91,;12.24,-14.01,;13.55,-13.65,;14.86,-12.91,;14.86,-11.35,;9.55,-11.35,;8.21,-10.58,;8.21,-9.03,;5.59,-9.03,;4.5,-7.93,;5.59,-10.58,;4.26,-11.35,;2.92,-10.58,;4.26,-12.91,;2.92,-13.69,;5.59,-13.65,;5.59,-15.21,;6.92,-15.98,;4.26,-15.98,;6.92,-12.91,;8.21,-13.65,;9.55,-12.91,;9.55,-14.01,;6.92,-11.35,)|

BDBM50010449

CC(C)c1c(O)c(O)c2C(=O)Oc3c(c(C)cc1c23)-c1c2OC(=O)c3c(O)c(O)c(C(C)C)c(cc1C)c23 |(17.54,-15.98,;16.19,-15.21,;14.86,-15.98,;16.19,-13.65,;17.54,-12.91,;18.85,-13.69,;17.54,-11.35,;18.85,-10.58,;16.19,-10.58,;16.18,-9.03,;17.26,-7.93,;13.55,-9.03,;13.55,-10.58,;12.21,-11.35,;12.21,-12.91,;12.24,-14.01,;13.55,-13.65,;14.86,-12.91,;14.86,-11.35,;9.55,-11.35,;8.21,-10.58,;8.21,-9.03,;5.59,-9.03,;4.5,-7.93,;5.59,-10.58,;4.26,-11.35,;2.92,-10.58,;4.26,-12.91,;2.92,-13.69,;5.59,-13.65,;5.59,-15.21,;6.92,-15.98,;4.26,-15.98,;6.92,-12.91,;8.21,-13.65,;9.55,-12.91,;9.55,-14.01,;6.92,-11.35,)|

BDBM50433833

CC(C)c1ccc(NC(=O)CSc2nc(-c3ccc(Cl)cc3)c(C#N)c(=O)[nH]2)cc1

BDBM488244

CC(C)c1ccc(cc1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616960

CC(C)c1ccc(cc1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616999

CC(C)c1ccc(cc1)-c1cccc(c1)-c1nn(c(CCC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488256

CC(C)c1ccc(cc1)-c1cccc(n1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488255

CC(C)c1ccc(cc1)-c1cncc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50441119

CC(C)c1ccc(cc1-c1cnc(N)c(N[C@H](C)c2ccccc2)n1)C(O)=O |r|

BDBM488258

CC(C)c1ccc(cc1C)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488275

CC(C)c1ccc(cc1F)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488263

CC(C)c1ccc(nc1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50547004

CC(C)c1ccc(s1)C#Cc1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616962

CC(C)c1cccc(c1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488261

CC(C)c1cnc(nc1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488260

CC(C)c1cnc(s1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616903

CC(C1CC1)c1c(Cc2ccc(c(F)c2)S(N)(=O)=O)c(nn1-c1nc(cs1)C(O)=O)-c1cccc(c1)C#Cc1ccc(C)s1

BDBM50433842

CC(Sc1nc(-c2ccc(Cl)c(Cl)c2)c(C#N)c(=O)[nH]1)C(=O)Nc1ccc(cc1)S(N)(=O)=O

BDBM50433841

CC(Sc1nc(-c2ccc(Cl)c(F)c2)c(C#N)c(=O)[nH]1)C(=O)Nc1ccc(cc1)S(N)(=O)=O

BDBM50433843

CC(Sc1nc(-c2ccc(Cl)cc2)c(C#N)c(=O)[nH]1)C(=O)Nc1ccc(cc1)S(N)(=O)=O

BDBM616893

CC1(C)CCC(=CC1)c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O |c:5|

BDBM50534307

CC1(C)CN(CCO1)c1ccc(cc1)C1(CC(O)=C(Sc2ccccc2Cl)C(=O)N1)c1ccsc1 |t:19|

BDBM50465087

CC1CCC(=CC1)c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O |c:4|

BDBM50465090

CC1CCCC=C1c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O |c:5|

BDBM50534325

CC1CN(CC(C)O1)c1ccc(cc1)C1(CC(O)=C(Sc2ccccc2Cl)C(=O)N1)c1ccsc1 |t:19|

BDBM50546965

CCC#Cc1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM234447

CCC(C)NC(=O)C([O-])=O

BDBM50433840

CCC(Sc1nc(-c2ccc(Cl)cc2)c(C#N)c(=O)[nH]1)C(=O)Nc1ccc(cc1)S(N)(=O)=O

BDBM50433839

CCC(Sc1nc(-c2cccc(OC)c2)c(C#N)c(=O)[nH]1)C(=O)Nc1ccc(cc1)S(N)(=O)=O

BDBM50010444

CCCCC(=O)Oc1c(c(C)cc2c(C(C)C)c(O)c(O)c(C#N)c12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C#N)c2c1OC(=O)CCCC |(8.66,3.2,;7.33,2.42,;7.33,.88,;6,.11,;6,-1.43,;7.33,-2.2,;4.67,-2.2,;4.67,-3.74,;6,-4.51,;6,-6.07,;6,-7.17,;4.67,-6.82,;3.37,-6.07,;2.04,-6.82,;2.04,-8.36,;.71,-9.15,;3.37,-9.15,;.71,-6.07,;-.65,-6.84,;.71,-4.51,;-.65,-3.72,;2.04,-3.74,;2.04,-2.2,;2.04,-.66,;3.37,-4.51,;8.66,-4.51,;8.66,-6.07,;8.68,-7.17,;9.99,-6.82,;11.29,-6.07,;12.61,-6.82,;12.61,-8.36,;13.96,-9.15,;11.29,-9.15,;13.96,-6.07,;15.31,-6.84,;13.96,-4.51,;15.31,-3.72,;12.61,-3.74,;12.61,-2.2,;12.61,-.66,;11.29,-4.51,;9.99,-3.74,;9.99,-2.2,;9.2,-.86,;7.66,-.86,;9.97,.48,;9.19,1.81,;9.95,3.14,;9.18,4.47,)|

BDBM519563

CCCCCCCCCCOC(=O)OC1=C(Sc2cc(Cl)ccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(OCC2CCCC2)n1 |c:14|

BDBM234445

CCCCNC(=O)C([O-])=O

BDBM234444

CCCNC(=O)C([O-])=O

BDBM519561

CCCOC(=O)OC1=C(Sc2ccc(F)cc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |c:7|

BDBM50066979

CCCc1c(O)c(O)c(C(O)=O)c2cc(C)c(C)cc12

BDBM50066974

CCCc1c(O)c(O)c(C(O)=O)c2cc(Cc3ccccc3)c(C)cc12

BDBM50066977

CCCc1c(O)c(O)c(C(O)=O)c2ccc(C)cc12

BDBM50594020

CCN(CC)CC.OC(=O)c1cc(ccc1O)-c1ccc(CN(Cc2ccco2)Cc2ccccc2)o1

BDBM234443

CCNC(=O)C([O-])=O

BDBM50089923

CCOC(=O)Cc1ccc(Cl)c(SC2=C(O)CC(CC2=O)c2c(Cl)ccc(c2Cl)-c2ccccc2)c1 |c:13|

BDBM519558

CCOC(=O)OC1=C(Sc2ccc(F)cc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(OCC2CCCC2)n1 |c:6|

BDBM519562

CCOC(=O)OC1=C(Sc2cccc(Cl)c2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |c:6|

CCOC(=O)c1c[nH]oc1=O

CCOC(=O)c1co[nH]c1=O

CCOC(=O)c1no[nH]c1=O

CCOC(=O)c1nonc1OCc1ccc(OC)cc1

BDBM519540

CCOc1cccc(n1)C1(CC(=O)C(Sc2ccc(F)cc2Cl)C(=O)N1)c1ccsc1

BDBM50527814

CC[C@H](C)C(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H]1CSCc2cccc(CSC[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1)c2)C(N)=O |r|

BDBM50527808

CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CSCc2cccc(CSC[C@H](NC1=O)C(N)=O)c2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O |r|

BDBM50527817

CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCNC1=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O |r|

BDBM50527816

CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CSCc2cccc(CSC[C@H](NC(=O)[C@H](C)NC1=O)C(N)=O)c2)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O |r|

BDBM50527807

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CSCc2cccc(CSC[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)c2)C(N)=O |r|

BDBM50527812

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(O)=O |r|

BDBM50527810

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CSCc2ccc(CSC[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1)cc2)C(N)=O |r|

BDBM50527813

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CSCc2cccc(CSC[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1)c2)C(N)=O |r|

BDBM50527806

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CSCc2cccc(CSC[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1)c2)C(N)=O |r|

BDBM50527809

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CSCc2ccccc2CSC[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1)C(N)=O |r|

BDBM50527803

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CSc2c(F)c(F)c(SC[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1)c(F)c2F)C(N)=O |r|

BDBM50527804

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50527818

BDBM50527805

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(N)=O |r|

BDBM488231

CCc1cc(ccc1OC)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488227

CCc1cc(ccc1OC)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488235

CN(C)c1ccc(cc1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616967

CN(C)c1ccc(cc1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50534316

CN(C)c1ccc(cc1)C1(CC(O)=C(Sc2ccccc2Cl)C(=O)N1)c1ccsc1 |t:13|

BDBM488239

CN(C)c1cccc(c1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50433835

CNS(=O)(=O)c1ccc(NC(=O)CSc2nc(-c3ccc(Cl)cc3)c(C#N)c(=O)[nH]2)cc1

BDBM50441108

CNc1ncc(nc1N[C@H](C)c1ccccc1)-c1cccc(c1)C(O)=O |r|

BDBM519559

COC(=O)OC1=C(Sc2cccc(Cl)c2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(OCC2CCCC2)n1 |c:5|

BDBM519568

COC(=O)OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccsc1)c1ccc(Br)cn1 |c:5|

BDBM23248

COC(=O)c1c(C)[nH]oc1=O

BDBM616891

COC1CCC(=CC1)c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O |c:5|

BDBM50534306

COC1CCN(CC1)c1ccc(cc1)C1(CC(O)=C(Sc2ccccc2Cl)C(=O)N1)c1ccsc1 |t:19|

BDBM519564

COCCOC(=O)OC1=C(Sc2cc(Cl)ccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |c:8|

BDBM519579

COCCOC(=O)OC1=C(Sc2cc(Cl)ccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(OCC2CCCC2)n1 |c:8|

BDBM519584

COCCOC(=O)OC1=C(Sc2cc(Cl)ccc2Cl)C(=O)N[C@@](C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |r,c:8|

BDBM519583

COCCOC(=O)OC1=C(Sc2cc(Cl)ccc2Cl)C(=O)N[C@](C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |r,c:8|

BDBM519575

COCCOC(=O)OC1=C(Sc2ccc(Cl)cc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |c:8|

BDBM519569

COCCOC(=O)OC1=C(Sc2ccc(Cl)cc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(OCC2CCCC2)n1 |c:8|

BDBM519578

COCCOC(=O)OC1=C(Sc2ccc(F)cc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |c:8|

BDBM519580

COCCOC(=O)OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cnc(nc1)N1CCOCC1 |c:8|

BDBM23226

COc1cc(CCOc2cc(O)c3c(c2)oc(cc3=O)C(O)=O)ccc1NC(=O)C(O)=O

BDBM23224

COc1cc(COc2cc(O)c3c(c2)oc(cc3=O)C(O)=O)ccc1NC(=O)C(O)=O

BDBM616942

COc1cc(OC)cc(c1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50089925

COc1ccc(C#N)c(SC2=C(O)CC(CC2=O)c2c(Cl)ccc(OC(C)C)c2Cl)c1 |c:10|

BDBM23229

COc1ccc(CNC(=O)c2cc(=O)c3c(O)cc(OCCc4ccc(NC(=O)C(O)=O)c(OC)c4)cc3o2)cc1

BDBM23228

COc1ccc(CNC(=O)c2cc(=O)c3c(O)cc(OCCc4ccc(NC(=O)C(O)=O)c(c4)C#N)cc3o2)cc1

BDBM23227

COc1ccc(CNC(=O)c2cc(=O)c3c(O)cc(OCCc4ccc(NC(=O)C(O)=O)cc4)cc3o2)cc1

BDBM50089929

COc1ccc(Cl)c(SC2=C(O)CC(CC2=O)c2c(Cl)ccc(NC3CCOCC3)c2Cl)c1 |c:9|

BDBM50089927

COc1ccc(Cl)c(SC2=C(O)CC(CC2=O)c2c(Cl)ccc(OC(C)C)c2Cl)c1 |c:9|

BDBM50089924

COc1ccc(Cl)c(SC2=C(O)CC(CC2=O)c2c(Cl)ccc(c2Cl)-c2ccncc2)c1 |c:9|

BDBM50433847

COc1ccc(NC(=O)CSc2nc(-c3ccc(Cl)cc3)c(C#N)c(=O)[nH]2)cc1Cl

BDBM50534315

COc1ccc(cc1)C1(CC(O)=C(Sc2ccccc2Cl)C(=O)N1)c1ccsc1 |t:12|

BDBM50052253

COc1ccc(cc1)C1CC(O)=C(Sc2ccccc2Cl)C(=O)C1 |t:12|

BDBM50441118

COc1ccc(cc1-c1cnc(N)c(N[C@H](C)c2ccccc2)n1)C(O)=O |r|

BDBM616939

COc1ccc(cc1C)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616956

COc1ccc(cc1C)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488236

COc1ccc(cc1Cl)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616961

COc1ccc(cc1Cl)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM11273

COc1cccc(c1)-c1nc(SCC(=O)Nc2ccc(cc2)S(N)(=O)=O)[nH]c(=O)c1C#N

BDBM50103568

COc1ncc(-c2ccc3c(Nc4cc(Oc5cc(F)cc(F)c5)cc(c4)C(O)=O)c(cnc3c2)S(=O)(=O)NC2CC2)c(OC)n1

BDBM50144758

COc1ncc(-c2ccc3c(Nc4cc(cc(c4)C(O)=O)C4CCCC4)c(cnc3c2)S(=O)(=O)NC2CC2)c(OC)n1

BDBM23246

COc1nocc1C(O)=O

BDBM23253

COc1nsnc1C(O)=O

BDBM50441111

C[C@@H](Nc1cc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1 |r|

BDBM50441110

C[C@@H](Nc1cncc(n1)-c1cccc(c1)C(O)=O)c1ccccc1 |r|

BDBM50441105

C[C@@H](Nc1nc(c(C)nc1N)-c1cccc(c1)C(O)=O)c1ccccc1 |r|

BDBM50441109

C[C@@H](Nc1nc(c[nH]c1=O)-c1cccc(c1)C(O)=O)c1ccccc1 |r|

BDBM50441121

C[C@@H](Nc1nc(cnc1N)-c1cc(C)cc(c1)C(O)=O)c1ccccc1 |r|

BDBM50441120

C[C@@H](Nc1nc(cnc1N)-c1cc(ccc1C)C(O)=O)c1ccccc1 |r|

BDBM50441117

C[C@@H](Nc1nc(cnc1N)-c1cc(ccc1Cl)C(O)=O)c1ccccc1 |r|

BDBM50441126

C[C@@H](Nc1nc(cnc1N)-c1ccc(C(O)=O)c(O)c1)c1ccccc1 |r|

BDBM50441122

C[C@@H](Nc1nc(cnc1N)-c1ccc(C)c(c1)C(O)=O)c1ccccc1 |r|

BDBM50441127

C[C@@H](Nc1nc(cnc1N)-c1ccc(cc1)C(O)=O)c1ccccc1 |r|

BDBM50441123

C[C@@H](Nc1nc(cnc1N)-c1cccc(C(O)=O)c1C)c1ccccc1 |r|

BDBM50441130

C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(=O)NS(C)(=O)=O)c1ccccc1 |r|

BDBM50441131

C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(N)=O)c1ccccc1 |r|

BDBM50441113

C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)C1CCCCC1 |r|

BDBM50441115

C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccc(Cl)cc1 |r|

BDBM50441132

C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1 |r|

BDBM50441128

C[C@@H](Nc1nc(cnc1N)-c1ccccc1C(O)=O)c1ccccc1 |r|

BDBM50441129

C[C@@H](Nc1nc(cnc1N)-c1ccnc(c1)C(O)=O)c1ccccc1 |r|

BDBM50441124

C[C@@H](Nc1nc(cnc1N)-c1csc(c1)C(O)=O)c1ccccc1 |r|

BDBM50441125

C[C@@H](Nc1nc(cnc1N)-n1cc(cn1)C(O)=O)c1ccccc1 |r|

BDBM50441107

C[C@@H](Nc1nc(cnc1NC(C)=O)-c1cccc(c1)C(O)=O)c1ccccc1 |r|

BDBM50441106

C[C@@H](Nc1nc(cnc1NS(C)(=O)=O)-c1cccc(c1)C(O)=O)c1ccccc1 |r|

BDBM50441114

C[C@@H](Oc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1 |r|

BDBM50433851

Cc1c(Cl)cccc1NC(=O)CSc1nc(-c2ccc(Cl)cc2)c(C#N)c(=O)[nH]1

BDBM436175

Cc1c(\C=C2/Sc3ccccc3C2=O)c(O)n2c3ccccc3nc2c1C#N

BDBM488286

Cc1cc(C#Cc2cccc(c2)-c2nn(c(CC3CC3)c2Cc2ccc(c(F)c2)S(N)(=O)=O)-c2nc(cs2)C(O)=O)c(C)s1

BDBM488283

Cc1cc(C#Cc2cccc(c2)-c2nn(c(CCC3CC3)c2Cc2ccc(c(F)c2)S(N)(=O)=O)-c2nc(cs2)C(O)=O)c(C)s1

BDBM50547013

Cc1cc(C)c(s1)C#Cc1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616940

Cc1cc(C)cc(c1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM436669

Cc1cc(ccc1-c1ccc(\C=C2\NC(=O)N(Cc3ccc(Br)cc3)C2=O)o1)C(O)=O

BDBM488230

Cc1cc(ccc1Cl)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488240

Cc1cc(ccc1F)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488273

Cc1cc(ccc1O)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488285

Cc1cc(cs1)C#Cc1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488284

Cc1cc(cs1)C#Cc1cccc(c1)-c1nn(c(CCC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50066980

Cc1cc2c(C)c(O)c(O)c(C(O)=O)c2cc1C

BDBM50066976

Cc1cc2c(C)c(O)c(O)c(C(O)=O)c2cc1Cc1ccccc1

BDBM50433846

Cc1ccc(NC(=O)CSc2nc(-c3ccc(Cl)cc3)c(C#N)c(=O)[nH]2)cc1C

BDBM50433848

Cc1ccc(NC(=O)CSc2nc(-c3ccc(Cl)cc3)c(C#N)c(=O)[nH]2)cc1Cl

BDBM489129

Cc1ccc(Oc2cc(ccc2F)-c2nn(c(CC3CC3)c2Cc2ccc(c(F)c2)S(N)(=O)=O)-c2nc(cs2)C(O)=O)cc1

BDBM50465091

Cc1ccc(\C=C\c2cccc(c2)-c2nn(c(CC3CC3)c2Cc2ccc(c(F)c2)S(N)(=O)=O)-c2nc(cs2)C(O)=O)s1

BDBM488243

Cc1ccc(cc1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM436667

Cc1ccc(cc1)C1=NN(C(C1)c1cn(CCC(O)=O)nc1-c1ccccc1)c1ccccc1 |t:8|

BDBM50465092

Cc1ccc(cc1F)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616958

Cc1ccc(cc1F)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616995

Cc1ccc(cn1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616993

Cc1ccc(nc1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50547009

Cc1ccc(o1)C#Cc1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488277

Cc1ccc(o1)C#Cc1cccc(c1)-c1nn(c(CCC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488254

Cc1ccc(s1)-c1ccc(cc1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488253

Cc1ccc(s1)-c1ccc(cc1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616954

Cc1ccc(s1)C#Cc1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(N)=O

BDBM50546993

Cc1ccc(s1)C#Cc1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50547019

Cc1ccc(s1)C#Cc1cc(ccc1F)-c1nn(c(CCC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488278

Cc1ccc(s1)C#Cc1ccc(s1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488176

Cc1ccc(s1)C#Cc1cccc(c1)-c1nn(-c2nc(cs2)C(O)=O)c(C2CC22CC2)c1Cc1ccc(c(F)c1)[SH+](N)=O

BDBM616921

Cc1ccc(s1)C#Cc1cccc(c1)-c1nn(-c2nc(cs2)C(O)=O)c(C2CC2C2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O

BDBM616914

Cc1ccc(s1)C#Cc1cccc(c1)-c1nn(-c2nc(cs2)C(O)=O)c(c1Cc1ccc(c(F)c1)S(N)(=O)=O)C(C)(C)C1CC1

BDBM616910

Cc1ccc(s1)C#Cc1cccc(c1)-c1nn(c(CC2(C)CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488292

Cc1ccc(s1)C#Cc1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(co1)C(O)=O

BDBM50547002

Cc1ccc(s1)C#Cc1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50547020

Cc1ccc(s1)C#Cc1cccc(c1)-c1nn(c(CCC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488293

Cc1ccc(s1)C#Cc1cccc(c1)-c1nn(c(CCCC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488276

Cc1ccc(s1)C#Cc1cccc(n1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488282

Cc1ccc(s1)C#Cc1csc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488287

Cc1ccc(s1)C(=O)Cc1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616916

Cc1ccc(s1)C1CC1c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM616920

Cc1ccc(s1)C1C[C@@H](C1)c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O |r,wU:8.11,(10.71,3.98,;9.38,3.21,;8.9,1.74,;7.36,1.74,;6.89,3.21,;8.13,4.11,;5.4,3.6,;4.63,4.94,;3.3,4.17,;4.07,2.83,;1.81,4.57,;1.41,6.05,;-.08,6.45,;-1.17,5.36,;-.77,3.88,;.72,3.48,;-1.86,2.79,;-3.32,3.26,;-4.23,2.02,;-3.32,.77,;-3.72,-.72,;-5.21,-1.11,;-6.69,-.72,;-6.3,-2.2,;-1.86,1.25,;-.52,.48,;-.52,-1.06,;-1.86,-1.83,;-1.86,-3.37,;-.52,-4.14,;.81,-3.37,;2.14,-4.14,;.81,-1.83,;-.52,-5.68,;.81,-6.45,;-1.86,-6.45,;-1.86,-4.91,;-5.77,2.02,;-6.67,.77,;-8.14,1.25,;-8.14,2.79,;-6.67,3.26,;-9.23,.16,;-10.71,.56,;-8.83,-1.33,)|

BDBM616918

Cc1ccc(s1)[C@H]1C[C@H](C1)c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O |r,wU:8.11,6.6,(10.71,3.98,;9.38,3.21,;8.9,1.74,;7.36,1.74,;6.89,3.21,;8.13,4.11,;5.4,3.6,;4.07,2.83,;3.3,4.17,;4.63,4.94,;1.81,4.57,;1.41,6.05,;-.08,6.45,;-1.17,5.36,;-.77,3.88,;.72,3.48,;-1.86,2.79,;-3.32,3.26,;-4.23,2.02,;-3.32,.77,;-3.72,-.72,;-5.21,-1.11,;-6.69,-.72,;-6.3,-2.2,;-1.86,1.25,;-.52,.48,;-.52,-1.06,;-1.86,-1.83,;-1.86,-3.37,;-.52,-4.14,;.81,-3.37,;2.14,-4.14,;.81,-1.83,;-.52,-5.68,;.81,-6.45,;-1.86,-6.45,;-1.86,-4.91,;-5.77,2.02,;-6.67,.77,;-8.14,1.25,;-8.14,2.79,;-6.67,3.26,;-9.23,.16,;-10.71,.56,;-8.83,-1.33,)|

BDBM50066978

Cc1ccc2c(C(O)=O)c(O)c(O)c(C)c2c1

BDBM50052406

Cc1cccc(C)c1C1CC(O)=C(Sc2ccccc2C#N)C(=O)C1 |t:12|

BDBM50052400

Cc1cccc(C)c1C1CC(O)=C(Sc2ccccc2Cl)C(=O)C1 |t:12|

BDBM616927

Cc1cccc(c1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50547003

Cc1ccsc1C#Cc1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488262

Cc1cnc(nc1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50547010

Cc1cnc(o1)C#Cc1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50546997

Cc1cnc(s1)C#Cc1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488279

Cc1cnc(s1)C#Cc1cccc(c1)-c1nn(c(CCC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488281

Cc1nc(cs1)C#Cc1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488288

Cc1nc(cs1)C#Cc1cccc(c1)-c1nn(c(CCC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM86137

Cc1nc2ccc(NC(=O)CCNC(=O)CCCc3ccc(CC(C(O)=O)C(O)=O)cc3)cc2s1

BDBM616953

Cc1ncc([nH]1)-c1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488259

Cc1ncc(cn1)-c1cccc(c1)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM50546996

Cc1ncc(s1)C#Cc1cc(ccc1F)-c1nn(c(CC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM488280

Cc1ncc(s1)C#Cc1cccc(c1)-c1nn(c(CCC2CC2)c1Cc1ccc(c(F)c1)S(N)(=O)=O)-c1nc(cs1)C(O)=O

BDBM23244

Cc1o[nH]c(=O)c1C(O)=O

BDBM23238

Clc1ccc(COC(=O)c2no[nH]c2=O)cc1Cl

BDBM519576

Clc1ccc(Cl)c(SC2=C(CC(NC2=O)(c2ccsc2)c2ccc(cc2)N2CCOCC2)OC(=O)c2ccncc2)c1 |t:8|

BDBM519557

Clc1ccc(Cl)c(SC2C(=O)CC(NC2=O)(c2ccsc2)c2ccc(cc2)N2CCOCC2)c1

BDBM519541

Clc1ccc(Cl)c(SC2C(=O)CC(NC2=O)(c2ccsc2)c2cccc(OCC3CCCC3)n2)c1

BDBM519581

Clc1ccc(Cl)c(S[C@H]2C(=O)C[C@@](NC2=O)(c2ccsc2)c2ccc(cc2)N2CCOCC2)c1 |r|

BDBM519582

Clc1ccc(Cl)c(S[C@H]2C(=O)C[C@](NC2=O)(c2ccsc2)c2ccc(cc2)N2CCOCC2)c1 |r|

BDBM50433834

Clc1ccc(NC(=O)CSc2nc(-c3ccc(Cl)cc3)c(C#N)c(=O)[nH]2)cc1

BDBM519574

Clc1ccc(SC2C(=O)CC(NC2=O)(c2ccsc2)c2ccc(cc2)N2CCOCC2)c(Cl)c1

BDBM519530

Clc1ccc(SC2C(=O)CC(NC2=O)(c2ccsc2)c2cccc(OCC3CCCC3)n2)c(Cl)c1

BDBM50433852

Clc1ccc(cc1)-c1nc(SCC(=O)Nc2cccc(Cl)c2)[nH]c(=O)c1C#N

BDBM519556

Clc1cccc(SC2C(=O)CC(NC2=O)(c2ccsc2)c2ccc(cc2)N2CCOCC2)c1Cl

BDBM519546

Clc1cccc(SC2C(=O)CC(NC2=O)(c2ccsc2)c2cccc(Br)n2)c1Cl

BDBM519549

Clc1cccc(SC2C(=O)CC(NC2=O)(c2ccsc2)c2cccc(OCC3CCCC3)n2)c1Cl

BDBM519565

Clc1ccccc1SC1C(=O)CC(OC1=O)(c1ccsc1)c1ccc(Br)nc1

BDBM519567

Clc1ccccc1SC1C(=O)CC(OC1=O)(c1ccsc1)c1ccccn1

BDBM519570

Clc1ccccc1SC1C(=O)CC(OC1=O)(c1ccsc1)c1cnc(nc1)N1CCOCC1

BDBM519566

Clc1ccccc1SC1C(=O)CC(OC1=O)(c1ccsc1)c1cncnc1

BDBM23255

Cn1nc(C(O)=O)c(=O)[nH]1

BDBM23254

Cn1nnc(O)c1C(O)=O

BDBM23245

Cn1occ(C(O)=O)c1=O

BDBM50433849

Fc1ccc(NC(=O)CSc2nc(-c3ccc(Cl)cc3)c(C#N)c(=O)[nH]2)cc1Cl

BDBM519555

Fc1ccc(SC2C(=O)CC(NC2=O)(c2ccsc2)c2ccc(cc2)N2CCOCC2)c(Cl)c1

BDBM519531

Fc1ccc(SC2C(=O)CC(NC2=O)(c2ccsc2)c2cccc(Br)n2)c(Cl)c1

BDBM519537

Fc1ccc(SC2C(=O)CC(NC2=O)(c2ccsc2)c2cccc(OCC3CCCC3)n2)c(Cl)c1

BDBM436668

Fc1cccc(c1)C(=O)Oc1cccc(\C=C2/SC(=S)NC2=O)c1

BDBM50594019

N.N.OC(=O)c1cc(ccc1O)-c1ccc(CN(CC#C)Cc2ccc(o2)-c2ccc(O)c(c2)C(O)=O)o1

BDBM50594018

N.N.OC(=O)c1cc(ccc1O)-c1ccc(CN(Cc2ccc(o2)-c2ccc(O)c(c2)C(O)=O)Cc2ccccc2)o1

BDBM50594017

N.OC(=O)c1cc(ccc1O)-c1ccc(CNCC#C)o1

BDBM50594021

N.OC(=O)c1cc(ccc1O)-c1ccc(CNCc2ccccc2)o1

BDBM50594014

N.OC(=O)c1cc(ccc1O)-c1ccc(CNc2ccc(Br)cc2)o1

BDBM50594016

N.OC(=O)c1cc(ccc1O)-c1ccc(CNc2ccc(cc2)C(=O)c2ccc(NC(=O)CCCC#C)cc2)o1

BDBM50594015

N.OC(=O)c1cc(ccc1O)-c1ccc(CNc2ccc(cc2)[N+]([O-])=O)o1

BDBM23222

NC(=O)C(O)=O

BDBM86114

NC(=O)C1=CN(CCC1)[C@@H]1OC(COP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O |r,t:3|

BDBM50421763

NC(=O)c1csc(n1)[C@H]1O[C@@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@H](O)[C@@H]1O |r|

BDBM50420178

NC(N)=N

BDBM50569440

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(NC(=O)c3ccccc3)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM489092

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(OC3CC3)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM537077

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(OCC3CC3(F)F)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM489093

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(OCc3ccc(o3)C(F)(F)F)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM489147

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(OCc3cccc(F)c3)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM616949

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2cc(Cl)cc(Cl)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM616945

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2cc(F)cc(F)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM488257

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ccc(C3CC3)c(F)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM616930

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ccc(Cl)c(F)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM616925

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ccc(Cl)cc2)-c2nc(cs2)C(O)=O)cc1F

BDBM616922

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ccc(F)c(F)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM488246

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ccc(cc2)C#N)-c2nc(cs2)C(O)=O)cc1F

BDBM488270

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ccc(cc2)C(F)(F)C(F)(F)F)-c2nc(cs2)C(O)=O)cc1F

BDBM616924

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ccc(cc2)C(F)(F)F)-c2nc(cs2)C(O)=O)cc1F

BDBM616929

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ccc3CCCCc3c2)-c2nc(cs2)C(O)=O)cc1F

BDBM616944

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ccc3CCCc3c2)-c2nc(cs2)C(O)=O)cc1F

BDBM616937

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2cccc(Cl)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM488241

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2cccc(F)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM488245

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2cccc(c2)C#N)-c2nc(cs2)C(O)=O)cc1F

BDBM488242

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ccco2)-c2nc(cs2)C(O)=O)cc1F

BDBM616952

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2nc3ccccc3[nH]2)-c2nc(cs2)C(O)=O)cc1F

BDBM616951

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)-c2ncc[nH]2)-c2nc(cs2)C(O)=O)cc1F

BDBM489162

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)C(=O)N2CCCC2)-c2nc(cs2)C(O)=O)cc1F

BDBM489161

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)C(=O)NCc2ccccc2)-c2nc(cs2)C(O)=O)cc1F

BDBM616889

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)C2=CCC(CC2)C(F)(F)F)-c2nc(cs2)C(O)=O)cc1F |t:28|

BDBM50465089

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)C2=CCC(F)(F)CC2)-c2nc(cs2)C(O)=O)cc1F |t:28|

BDBM616895

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)C2=CCC3(CC3)CC2)-c2nc(cs2)C(O)=O)cc1F |t:28|

BDBM616932

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)C2=CCCCC2)-c2nc(cs2)C(O)=O)cc1F |t:28|

BDBM616936

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)C2=CCCO2)-c2nc(cs2)C(O)=O)cc1F |t:28|

BDBM616892

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)C2=Cc3ccccc3C2)-c2nc(cs2)C(O)=O)cc1F |t:28|

BDBM488247

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccc(F)c(c2)N2CCCC2=O)-c2nc(cs2)C(O)=O)cc1F

BDBM489104

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(Nc3ccccc3)c2)-c2nc(cs2)C(O)=O)cc1

BDBM537017

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(OCc3ccccc3)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM616966

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2cc(F)cc(F)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM488232

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc(CC(F)(F)F)cc2)-c2nc(cs2)C(O)=O)cc1F

BDBM616955

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc(Cl)c(F)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM616957

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc(Cl)cc2)-c2nc(cs2)C(O)=O)cc1F

BDBM488274

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc(O)c(F)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM616965

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc(cc2)C#N)-c2nc(cs2)C(O)=O)cc1F

BDBM488269

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc(cc2)C(F)(F)C(F)(F)F)-c2nc(cs2)C(O)=O)cc1F

BDBM488264

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc(cc2)C(F)(F)F)-c2nc(cs2)C(O)=O)cc1F

BDBM488228

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc(cc2)C2CC2)-c2nc(cs2)C(O)=O)cc1F

BDBM488229

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc(cc2)C2CCC2)-c2nc(cs2)C(O)=O)cc1F

BDBM616963

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc3CCCCc3c2)-c2nc(cs2)C(O)=O)cc1F

BDBM488265

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccc3CCCc3c2)-c2nc(cs2)C(O)=O)cc1F

BDBM616964

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2cccc(Cl)c2)-c2nc(cs2)C(O)=O)cc1F

BDBM50250656

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2ccccc2)-c2nc(cs2)C(O)=O)cc1

BDBM488234

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)-c2nc3ccccc3[nH]2)-c2nc(cs2)C(O)=O)cc1F

BDBM50547006

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)C#Cc2ccc(Cl)s2)-c2nc(cs2)C(O)=O)cc1F

BDBM50547008

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)C#Cc2ccc(s2)C(F)(F)F)-c2nc(cs2)C(O)=O)cc1F

BDBM50547007

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)C#Cc2ccc(s2)C(F)F)-c2nc(cs2)C(O)=O)cc1F

BDBM50547005

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)C#Cc2ccc(s2)C2CC2)-c2nc(cs2)C(O)=O)cc1F

BDBM488290

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)C#Cc2ccc(s2)C2CCC2)-c2nc(cs2)C(O)=O)cc1F

BDBM616931

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)C(=O)N2CCCC2)-c2nc(cs2)C(O)=O)cc1

BDBM50569438

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(c2)N2CCOCC2)-c2nc(cs2)C(O)=O)cc1F

BDBM50250655

NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2ccccc2)-c2nc(cs2)C(O)=O)cc1

BDBM616997

NS(=O)(=O)c1ccc(Cc2c(CCC3CC3)n(nc2-c2cccc(c2)-c2ccc(cc2)C(F)(F)C(F)(F)F)-c2nc(cs2)C(O)=O)cc1F

BDBM488289

NS(=O)(=O)c1ccc(Cc2c(CCC3CC3)n(nc2-c2cccc(c2)C#Cc2ccc(s2)C2CC2)-c2nc(cs2)C(O)=O)cc1F

BDBM488291

NS(=O)(=O)c1ccc(Cc2c(CCC3CC3)n(nc2-c2cccc(c2)C#Cc2ccc(s2)C2CCC2)-c2nc(cs2)C(O)=O)cc1F

BDBM50250674

NS(=O)(=O)c1ccc(Cc2c(O)n(nc2-c2ccc(F)c(F)c2)-c2nc(cs2)C(O)=O)cc1

BDBM50250644

NS(=O)(=O)c1ccc(Cc2c(O)n(nc2-c2cccc(Br)c2)-c2nc(cs2)C(O)=O)cc1

BDBM50250645

NS(=O)(=O)c1ccc(Cc2c(O)n(nc2-c2cccc(c2)-c2ccccc2)-c2nc(cs2)C(O)=O)cc1

BDBM50250646

NS(=O)(=O)c1ccc(Cc2c(O)n(nc2-c2cccc(c2)-c2ccccc2F)-c2nc(cs2)C(O)=O)cc1

BDBM50250650

NS(=O)(=O)c1ccc(Cc2c(nn(-c3nc(cs3)C(O)=O)c2-c2cccnc2)-c2ccccc2)cc1

BDBM50250651

NS(=O)(=O)c1ccc(Cc2c(nn(-c3nc(cs3)C(O)=O)c2-c2ccncc2)-c2ccccc2)cc1

BDBM50250652

NS(=O)(=O)c1ccc(Cc2c(nn(-c3nc(cs3)C(O)=O)c2C(F)(F)F)-c2cccc(c2)-c2ccccc2)cc1

BDBM50250677

NS(=O)(=O)c1ccc(Cc2c(nn(-c3nc(cs3)C(O)=O)c2C2CC2)-c2cccc(c2)-c2ccccc2)cc1

BDBM50250653

NS(=O)(=O)c1ccc(Cc2c(nn(-c3nc(cs3)C(O)=O)c2C2CC2)-c2ccccc2)cc1

BDBM50250675

NS(=O)(=O)c1ccc(Cc2cn(nc2-c2ccc(F)c(F)c2)-c2nc(cs2)C(O)=O)cc1

BDBM50250648

NS(=O)(=O)c1ccc(Cc2cn(nc2-c2cccc(c2)-c2ccccc2)-c2nc(cs2)C(O)=O)cc1

BDBM50250647

NS(=O)(=O)c1ccc(Cc2cn(nc2-c2ccccc2)-c2nc(cs2)C(O)=O)cc1

BDBM50433836

NS(=O)(=O)c1ccc(NC(=O)CSc2nc(-c3ccc(Cl)cc3)c(C#N)c(=O)[nH]2)cc1

BDBM50433845

NS(=O)(=O)c1ccc(NC(=O)CSc2nc(-c3ccccc3)c(C#N)c(=O)[nH]2)cc1

BDBM50250649

NS(=O)(=O)c1ccc(Nc2cn(nc2-c2cccc(c2)-c2ccccc2)-c2nc(cs2)C(O)=O)cc1

BDBM50250676

NS(=O)(=O)c1ccc(Nc2cn(nc2-c2ccccc2)-c2nc(cs2)C(O)=O)cc1

BDBM50250654

NS(=O)(=O)c1ccc(Oc2c(nn(-c3nc(cs3)C(O)=O)c2C2CC2)-c2cccc(c2)-c2ccccc2)cc1

BDBM50250667

Nc1c(Cc2ccc(cc2)S(N)(=O)=O)c(nn1-c1nc(cs1)C(O)=O)-c1cccc(c1)-c1ccccc1

BDBM50534308

Nc1cccc(c1)C1(CC(O)=C(Sc2ccccc2Cl)C(=O)N1)c1ccsc1 |t:11|

BDBM50597899

Nc1cccc(c1)C1(CC(O)=C(Sc2ccccc2Cl)C(=O)O1)c1ccccc1 |t:11|

BDBM50597898

Nc1cccc(c1)C1(CC(O)=C(Sc2ccccc2Cl)C(=O)O1)c1ccsc1 |t:11|

BDBM50441112

Nc1ncc(nc1NCC1CCCC1)-c1cccc(c1)C(O)=O

BDBM50441116

Nc1ncc(nc1NCc1ccccc1)-c1cccc(c1)C(O)=O

BDBM23234

Nc1nonc1C(O)=O

BDBM23252

Nc1nsnc1C(O)=O

BDBM23225

OC(=O)C(=O)Nc1ccc(CCOc2cc(O)c3c(c2)oc(cc3=O)C(O)=O)cc1

BDBM23237

OC(=O)Cc1no[nH]c1=O

BDBM23256

OC(=O)c1c(O)nnn1Cc1ccccc1

BDBM50463040

OC(=O)c1cc(ccc1O)-c1ccc(C=O)o1

OC(=O)c1cnn[nH]1

OC(=O)c1cnon1

OC(=O)c1co[nH]c1=O

OC(=O)c1nn(Cc2ccccc2)[nH]c1=O

BDBM23232

OC(=O)c1no[nH]c1=O

BDBM23250

OC(=O)c1noc(C(O)=O)c1O

BDBM23243

OC(=O)c1nocc1O

BDBM23240

OC(=O)c1nonc1OC\C=C\c1ccccc1

BDBM23251

OC(=O)c1ns[nH]c1=O

BDBM50052407

OC1=C(Sc2ccccc2C#N)C(=O)CC(C1)c1c(Br)cccc1Br |c:1|

BDBM50052247

OC1=C(Sc2ccccc2C#N)C(=O)CC(C1)c1c(Cl)cccc1Br |c:1|

BDBM50052405

OC1=C(Sc2ccccc2C#N)C(=O)CC(C1)c1c(Cl)cccc1C(F)(F)F |c:1|

BDBM50052246

OC1=C(Sc2ccccc2C#N)C(=O)CC(C1)c1c(Cl)cccc1Cl |c:1|

BDBM50052404

OC1=C(Sc2ccccc2C#N)C(=O)CC(C1)c1ccc(Cl)cc1 |c:1|

BDBM50052403

OC1=C(Sc2ccccc2C#N)C(=O)CC(C1)c1cccc(Cl)c1 |c:1|

BDBM50052249

OC1=C(Sc2ccccc2C#N)C(=O)CC(C1)c1ccccc1 |c:1|

BDBM50052402

OC1=C(Sc2ccccc2C#N)C(=O)CC(C1)c1ccccc1Cl |c:1|

BDBM50052399

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1c(Br)cccc1Br |c:1|

BDBM50052331

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1c(Cl)ccc(Br)c1Cl |c:1|

BDBM50052258

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1c(Cl)cccc1Br |c:1|

BDBM50052259

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1c(Cl)cccc1C(F)(F)F |c:1|

BDBM50052254

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1c(Cl)cccc1Cl |c:1|

BDBM50052257

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1c(F)cccc1Cl |c:1|

BDBM50052260

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1c(F)cccc1F |c:1|

BDBM50052401

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1c(cccc1C(F)(F)F)C(F)(F)F |c:1|

BDBM50052252

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1ccc(Cl)cc1 |c:1|

BDBM50052251

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1cccc(Cl)c1 |c:1|

BDBM50040030

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1ccccc1 |c:1|

BDBM50052250

OC1=C(Sc2ccccc2Cl)C(=O)CC(C1)c1ccccc1Cl |c:1|

BDBM50597915

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccc(cc1)N1CCOCC1)c1cccc(Nc2ccc(F)cc2)n1 |c:1|

BDBM50597916

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccc(cc1)N1CCOCC1)c1cccc(Oc2ccc(F)cc2)n1 |c:1|

BDBM50597908

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1cccc(NC2CCCCC2)n1)c1cccc(Nc2ccc(F)c(F)c2)n1 |c:1|

BDBM50597909

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1cccc(NC2CCOCC2)n1)c1cccc(Nc2ccc(F)c(F)c2)n1 |c:1|

BDBM50597911

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1cccc(NCCC2CC2)n1)c1cccc(Nc2ccc(F)c(F)c2)n1 |c:1|

BDBM50597912

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1cccc(NCc2ccc(F)cc2)n1)c1cccc(Nc2ccc(F)c(F)c2)n1 |c:1|

BDBM50597914

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1cccc(Nc2ccc(F)c(F)c2)n1)c1cccc(Oc2cccc3ncccc23)n1 |c:1|

BDBM50597913

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1cccc(Nc2ccc(F)c(F)c2)n1)c1cccc(Oc2ccccc2)n1 |c:1|

BDBM50534336

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccccc1)c1ccccc1 |c:1|

BDBM50534329

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(O)cc1 |c:1|

BDBM50534314

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)C#N |c:1|

BDBM50534328

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)C1CC1 |c:1|

BDBM50534320

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)C1CCCCC1 |c:1|

BDBM50534331

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCC(CC1)C#N |c:1|

BDBM50534327

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCC2(COC2)CC1 |c:1|

BDBM50534323

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCCC1 |c:1|

BDBM50534330

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCCCC1 |c:1|

BDBM50534322

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCN(CC1)C1COC1 |c:1|

BDBM50534321

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCNCC1 |c:1|

BDBM50534334

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |c:1|

BDBM50534326

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1=O |c:1|

BDBM50534335

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccc(cc1)N1CCS(=O)(=O)CC1 |c:1|

BDBM50534303

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(Br)c1 |c:1|

BDBM50534305

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(NC2CCCCC2)c1 |c:1|

BDBM50534304

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(NC2CCOCC2)c1 |c:1|

BDBM50597910

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(Nc2ccc(F)c(F)c2)n1 |c:1|

BDBM50534318

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(Nc2ccc(F)cc2)c1 |c:1|

BDBM50534313

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(O)c1 |c:1|

BDBM50534319

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(OC2CCOCC2)c1 |c:1|

BDBM50534333

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(Oc2ccc(F)cc2)c1 |c:1|

BDBM50534317

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1cccc(c1)N1CCOCC1 |c:1|

BDBM50534311

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccccc1 |c:1|

BDBM197159

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccccc1 |w:14.17,14.23,c:1|

BDBM50534310

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccccc1F |c:1|

BDBM50534332

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1ccsc1)c1ccccn1 |c:1|

BDBM50534312

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)(c1cscn1)c1ccccc1 |c:1|

BDBM50040031

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)c1ccccc1 |c:1|

BDBM197158

OC1=C(Sc2ccccc2Cl)C(=O)NC(C1)c1ccccc1 |w:14.17,c:1|

BDBM50597907

OC1=C(Sc2ccccc2Cl)C(=O)N[C@@](C1)(c1cccc(Nc2ccc(F)cc2)n1)c1cccc(Nc2ccc(F)c(F)c2)n1 |r,c:1|

BDBM197160

OC1=C(Sc2ccccc2Cl)C(=O)N[C@@](C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |r,c:1|

BDBM50597906

OC1=C(Sc2ccccc2Cl)C(=O)N[C@](C1)(c1cccc(Nc2ccc(F)cc2)n1)c1cccc(Nc2ccc(F)c(F)c2)n1 |r,c:1|

BDBM50534324

OC1=C(Sc2ccccc2Cl)C(=O)N[C@](C1)(c1ccsc1)c1ccc(cc1)N1CCOCC1 |r,c:1|

BDBM50597887

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccccc1)c1ccccc1 |c:1|

BDBM50597895

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccccc1)c1ccccc1O |c:1|

BDBM50597888

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccccc1)c1ccccn1 |c:1|

BDBM50597889

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccccn1)c1ccccn1 |c:1|

BDBM50597891

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1cccs1)c1ccccc1 |c:1|

BDBM50597894

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1cccs1)c1cccs1 |c:1|

BDBM50597901

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccsc1)c1cccc(NCC(F)(F)F)c1 |c:1|

BDBM50597905

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccsc1)c1cccc(Nc2ccc(F)cc2)n1 |c:1|

BDBM50597904

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccsc1)c1cccc(Nc2ccc(F)cn2)c1 |c:1|

BDBM50597890

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccsc1)c1ccccc1 |c:1|

BDBM50597897

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccsc1)c1ccccc1F |c:1|

BDBM50597896

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccsc1)c1ccccc1O |c:1|

BDBM50597893

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1ccsc1)c1ccccn1 |c:1|

BDBM50597892

OC1=C(Sc2ccccc2Cl)C(=O)OC(C1)(c1cscn1)c1ccccc1 |c:1|

BDBM50597902

OC1=C(Sc2ccccc2Cl)C(=O)O[C@@](C1)(c1ccsc1)c1cccc(Nc2ccc(F)cc2)c1 |r,c:1|

BDBM50597903

OC1=C(Sc2ccccc2Cl)C(=O)O[C@](C1)(c1ccsc1)c1cccc(Nc2ccc(F)cc2)c1 |r,c:1|

BDBM50052248

OC1=C(Sc2ccccc2[N+]([O-])=O)C(=O)CC(C1)c1ccccc1 |c:1|

BDBM23235

OCCNc1nonc1C(O)=O

BDBM50144747

Oc1cc2C(=O)Cc3cc(O)c(=O)oc3-c2c(O)c1O

BDBM50592886

Oc1cc2oc(=O)c3cc(=O)c(O)c(O)c3c2oc1O

BDBM50527815

[H][C@@]1(CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@]([H])(NC(=O)[C@H](CCCCNC(=O)C[C@H](NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(N)=O)NC(C)=O)[C@@H](C)O |r|

BDBM50527811

[H][C@]1(NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(N)=O)[C@@H](C)O |r|

BDBM436670

[O-][N+](=O)c1ccc(COc2cccc(\C=C3\SC(=S)NC3=O)c2)cc1