SMILES for Branched-chain-amino-acid aminotransferase, mitochondrial

CCCOc1cc(C#N)c(Oc2ccccc2C)cc1-n1c(=O)cc([nH]c1=O)C(F)(F)F |(4.68,-6.16,;3.34,-5.39,;3.34,-3.85,;2.01,-3.08,;2.01,-1.54,;3.34,-.76,;3.33,.77,;4.67,1.54,;6,2.31,;2,1.54,;2,3.08,;3.33,3.85,;4.67,3.08,;6,3.85,;6,5.39,;4.66,6.16,;3.33,5.39,;2,6.16,;.67,.77,;.67,-.77,;-.66,-1.54,;-2,-.77,;-2,.77,;-3.33,-1.54,;-3.33,-3.08,;-2,-3.85,;-.66,-3.08,;.67,-3.85,;-4.67,-3.85,;-4.67,-5.39,;-6,-3.08,;-6,-4.62,)|

BDBM50118617

CCCc1cc(=O)n2nc(C(=O)Nc3ccc(Cl)cc3)c(C#N)c2[nH]1

BDBM50118614

CCCc1cc(=O)n2nc(CC(=O)N3CCCC3)c(C#N)c2[nH]1

BDBM50118613

CCCc1cc(=O)n2nc(CCc3ccc(Cl)cc3)c(C#N)c2[nH]1

BDBM50118620

CCCc1cc(=O)n2nc(CNc3ccc(Cl)cc3)c(C#N)c2[nH]1

BDBM50118612

CCCc1cc(=O)n2nc(COc3ccc(Cl)cc3)c(C#N)c2[nH]1

BDBM50118632

CCCc1cc(=O)n2nc(N)c(C#N)c2[nH]1

BDBM50118618

CCCc1cc(=O)n2nc(NC(=O)c3ccc(Cl)cc3)c(C#N)c2[nH]1

BDBM50118635

CCCc1cc(=O)n2nc(NCC3CCOCC3)c(C#N)c2[nH]1

BDBM50118611

CCCc1cc(=O)n2nc(NCCc3ccc(Cl)cc3)c(C#N)c2[nH]1

BDBM50118522

CCCc1cc(=O)n2nc(NCc3c(F)cc(Cl)cc3F)c(C#N)c2[nH]1

BDBM50118588

CCCc1cc(=O)n2nc(NCc3ccc(Br)cc3)c(C#N)c2[nH]1

BDBM50118525

CCCc1cc(=O)n2nc(NCc3ccc(Br)cc3)nc2[nH]1

BDBM50118523

CCCc1cc(=O)n2nc(NCc3ccc(Br)cc3F)c(C#N)c2[nH]1

BDBM50118520

CCCc1cc(=O)n2nc(NCc3ccc(Br)cn3)c(C#N)c2[nH]1

BDBM50118615

CCCc1cc(=O)n2nc(NCc3ccc(C)cc3)c(C#N)c2[nH]1

BDBM50118616

CCCc1cc(=O)n2nc(NCc3ccc(Cl)c(C)c3)c(C#N)c2[nH]1

BDBM50118674

CCCc1cc(=O)n2nc(NCc3ccc(Cl)c(F)c3)c(C#N)c2[nH]1

BDBM50118578

CCCc1cc(=O)n2nc(NCc3ccc(Cl)cc3)c(C#N)c2[nH]1

BDBM50118526

CCCc1cc(=O)n2nc(NCc3ccc(Cl)cc3)nc2[nH]1

BDBM50118521

CCCc1cc(=O)n2nc(NCc3ccc(Cl)cc3F)c(C#N)c2[nH]1

BDBM50118634

CCCc1cc(=O)n2nc(NCc3ccc(Cl)cc3OC)c(C#N)c2[nH]1

BDBM50118636

CCCc1cc(=O)n2nc(NCc3ccc(Cl)nc3)c(C#N)c2[nH]1

BDBM50118633

CCCc1cc(=O)n2nc(NCc3ccccc3)c(C#N)c2[nH]1

BDBM50118673

CCCc1cc(=O)n2nc(N[C@@H](C)c3ccc(Br)cc3F)c(C#N)c2[nH]1 |r|

BDBM50118524

CCCc1cc(=O)n2nc(N[C@H](C)c3ccc(Br)cc3F)c(C#N)c2[nH]1 |r|

BDBM50118619

CCCc1cc(=O)n2nc(OCc3ccc(Cl)cc3)c(C#N)c2[nH]1

BDBM50162320

CCOC(=O)Cc1ccccc1NC(=O)c1sc2nc[nH]c(=O)c2c1C

BDBM50118631

CCOc1nn2c([nH]c(C)cc2=O)c1C#N

BDBM50118629

CCc1cc(=O)n2nc(C)c(C#N)c2[nH]1

BDBM50118622

CCc1cc(=O)n2nc(NCc3ccc(Cl)cc3)c(C#N)c2[nH]1

BDBM50607282

CCc1cccc(C)c1Oc1cc(c(F)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,6.54,;2,5,;.66,4.23,;-.67,5,;-2,4.23,;-2,2.7,;-.67,1.92,;-.67,.38,;.67,2.69,;2,1.92,;2,.38,;.67,-.38,;.67,-1.92,;2.01,-2.7,;2.01,-4.24,;3.34,-1.92,;3.33,-.39,;4.67,.38,;6,1.15,;-.67,-2.69,;-2,-1.92,;-2,-.38,;-3.33,-2.69,;-3.33,-4.23,;-2,-5,;-.67,-4.23,;.67,-5,;-4.67,-5,;-4.67,-6.54,;-6,-4.23,;-6,-5.77,)|

BDBM50173932

CN(C)C(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1ccccn1 |r|

BDBM50173930

CN([C@H]1CCC[C@H](C1)n1c(nc2cc(ccc12)C(N)=O)-c1ccccn1)C(=O)c1ccc(Br)s1 |r|

BDBM50122753

CNC(=O)c1ccc(cc1OC1CCN(C1)C(=O)c1cc(Br)ccc1N)-c1cccc(c1)C(O)=O

BDBM50122754

CNC(=O)c1ccc(cc1OC1CCN(C1)C(=O)c1cc(Br)ccc1NC(=O)OC(C)(C)C)-c1cccc(c1)C(O)=O

BDBM50122752

CNC(=O)c1ccc(cc1OC1CCN(C1)C(=O)c1ccc(Br)s1)-c1cccc(c1)C(O)=O

BDBM50122750

CNC(=O)c1ccc(cc1OC1CCN(C1)C(=O)c1ccc(Br)s1)-c1ccccc1NS(C)(=O)=O

BDBM50122745

CNC(=O)c1ccc(cc1O[C@@H]1CCN(C1)C(=O)c1ccc(Br)s1)-c1ccccc1 |r|

BDBM50122746

CNC(=O)c1ccc(cc1O[C@@H]1CCN(C1)C(=O)c1ccc(Br)s1)-c1ccccc1C |r|

BDBM50122749

CNC(=O)c1ccc(cc1O[C@@H]1CCN(C1)C(=O)c1ccc(Br)s1)-c1ccccc1NS(C)(=O)=O |r|

BDBM50122748

CNC(=O)c1ccc(cc1O[C@@H]1CCN(C1)C(=O)c1ccc(Cl)s1)-c1ccccc1NS(C)(=O)=O |r|

BDBM50122747

CNC(=O)c1ccc(cc1O[C@@H]1CCN(C1)C(=O)c1ccc(s1)C#N)-c1ccccc1NS(C)(=O)=O |r|

BDBM50173940

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3cc(Br)c[nH]3)c(nc2c1)-c1ccccn1 |r|

BDBM50173934

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3cc(Cl)no3)c(nc2c1)-c1ccccn1 |r|

BDBM50173938

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)n3C)c(nc2c1)-c1ccccn1 |r|

BDBM50173919

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1cc[nH]n1 |r|

BDBM50173928

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1ccccc1 |r|

BDBM50173939

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1ccccc1SC |r|

BDBM50173927

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1ccccn1 |r|

BDBM50173923

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1cccs1 |r|

BDBM50173922

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1ccsc1 |r|

BDBM50173921

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1csc(C)n1 |r|

BDBM50173920

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1nccs1 |r|

BDBM50173988

CNC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3cnc(Br)s3)c(nc2c1)-c1ccccn1 |r|

BDBM50122744

CNC(=O)c1ccccc1OC1CCN(C1)C(=O)c1ccc(Br)s1

BDBM50118621

COCc1cc(=O)n2nc(NCc3ccc(Cl)cc3)c(C#N)c2[nH]1

BDBM50607294

COc1cc(C#N)c(Oc2ccccc2C)cc1-n1c(=O)cc([nH]c1=O)C(F)(F)F |(3.34,-4.24,;2.01,-3.47,;2.01,-1.93,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;2,1.15,;2,2.69,;3.33,3.46,;4.67,2.69,;6,3.47,;6,5,;4.66,5.77,;3.33,5,;2,5.77,;.67,.39,;.67,-1.15,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607310

COc1cc(Cl)c(Oc2ccccc2C)cc1-n1c(=O)cc([nH]c1=O)C(F)(F)F |(3.34,-4.24,;2.01,-3.47,;2.01,-1.93,;3.34,-1.15,;3.34,.38,;4.67,1.15,;2,1.15,;2,2.69,;3.34,3.46,;4.68,2.69,;6,3.47,;6,5,;4.67,5.77,;3.34,5,;2,5.77,;.67,.39,;.67,-1.15,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.66,-4.23,;-4.66,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607287

COc1cc(OC)c(cc1Cl)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(5.33,4.23,;5.33,2.69,;4,1.92,;4,.39,;2.67,-.39,;2.67,-1.93,;4.01,-2.7,;1.33,.39,;1.34,1.93,;2.67,2.69,;2.67,4.23,;0,-.38,;-1.33,.39,;-1.33,1.93,;-2.67,-.38,;-2.67,-1.92,;-1.33,-2.69,;0,-1.92,;1.33,-2.69,;-4,-2.69,;-4,-4.23,;-5.33,-1.92,;-5.33,-3.46,)|

BDBM50607309

COc1ccc(Oc2ccccc2C)cc1-n1c(=O)cc([nH]c1=O)C(F)(F)F |(3.34,-4.24,;2.01,-3.47,;2.01,-1.93,;3.34,-1.15,;3.34,.38,;2,1.15,;2,2.69,;3.34,3.46,;4.68,2.69,;6,3.47,;6,5,;4.67,5.77,;3.34,5,;2,5.77,;.67,.39,;.67,-1.15,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.66,-4.23,;-4.66,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50162302

CS(=O)(=O)c1ccccc1C(=O)Nc1ccccc1

BDBM50162460

Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc1ccc(C)cc1

BDBM50162468

Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc1cccc(C)c1

BDBM50162318

Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc1ccccc1CC(O)=O

BDBM50162306

Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc1ccccc1CO

BDBM50162304

Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc1ccccc1S(C)(=O)=O

BDBM50162305

Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc1ccccc1S(N)(=O)=O

BDBM50162456

Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc1cccnc1

BDBM50162343

Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc1cccs1

BDBM50162455

Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc1ccon1

BDBM50162342

Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc1nncs1

BDBM50162485

Cc1c(sc2nc[nH]c(=O)c12)C(O)=O

BDBM50162480

Cc1c(sc2ncn(C)c(=O)c12)C(=O)N1CCCCC1

BDBM50162481

Cc1c(sc2ncn(C)c(=O)c12)C(=O)NC1CCCC1

BDBM50162484

Cc1c(sc2ncn(C)c(=O)c12)C(=O)Nc1ccccc1

BDBM50162498

Cc1c(sc2ncn(C)c(=O)c12)C(O)=O

BDBM50162483

Cc1c(sc2ncnc(O)c12)C(=O)Nc1ccccc1

BDBM50162478

Cc1c(sc2ncnc(O)c12)C(=O)Nc1ccccc1C

BDBM50162491

Cc1cc2cc(C)c(SCC(O)=O)nc2cc1C

BDBM50173915

Cc1ccc(s1)C(=O)N[C@H]1CCC[C@H](C1)n1c(nc2cc(ccc12)C(N)=O)-c1ccccn1 |r|

BDBM50607283

Cc1cccc(C)c1Oc1cc(c(F)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;.66,5,;-.67,5.77,;-2,5,;-2,3.47,;-.67,2.69,;-.67,1.15,;.67,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;2.01,-1.93,;2.01,-3.47,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607284

Cc1cccc(Cl)c1Oc1cc(c(F)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(-.67,1.15,;-.67,2.69,;-2,3.47,;-2,5,;-.67,5.77,;.66,5,;2,5.77,;.67,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;2.01,-1.93,;2.01,-3.47,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607319

Cc1ccccc1Oc1cc(-n2c(=O)cc([nH]c2=O)C(F)(F)F)c2ccccc2c1 |(19.33,-28.25,;18.05,-27.4,;18.14,-25.87,;16.85,-25.03,;15.47,-25.73,;15.39,-27.26,;16.67,-28.1,;16.58,-29.64,;15.21,-30.34,;13.92,-29.5,;12.55,-30.2,;11.27,-29.36,;11.35,-27.82,;12.73,-27.12,;10.07,-26.97,;8.69,-27.67,;8.61,-29.21,;9.89,-30.05,;9.8,-31.59,;7.23,-27.19,;6.09,-28.22,;5.95,-26.35,;7.32,-25.66,;12.46,-31.74,;11.08,-32.44,;11,-33.97,;12.28,-34.82,;13.65,-34.12,;13.74,-32.58,;15.12,-31.89,)|

BDBM50607314

Cc1ccccc1Oc1cc(-n2c(=O)cc([nH]c2=O)C(F)(F)F)c2ccccc2c1C#N |(2,5.77,;3.34,5,;4.67,5.77,;6,5,;6,3.47,;4.68,2.69,;3.34,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.66,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,;2.01,-1.93,;2.02,-3.47,;3.36,-4.23,;4.68,-3.45,;4.67,-1.91,;3.34,-1.15,;3.34,.38,;4.67,1.15,;6,1.92,)|

BDBM50607315

Cc1ccccc1Oc1cc(-n2c(=O)cc([nH]c2=O)C(F)(F)F)c2ccccc2c1Cl |(20.53,-12.27,;19.26,-11.42,;19.36,-9.88,;18.08,-9.03,;16.7,-9.71,;16.59,-11.25,;17.87,-12.1,;17.76,-13.64,;16.38,-14.32,;15.11,-13.47,;13.73,-14.15,;12.45,-13.3,;12.56,-11.76,;13.94,-11.08,;11.28,-10.9,;9.9,-11.59,;9.79,-13.13,;11.07,-13.98,;10.96,-15.52,;8.45,-11.09,;8.55,-9.56,;7.17,-10.24,;7.29,-12.11,;13.62,-15.7,;12.24,-16.38,;12.13,-17.91,;13.41,-18.77,;14.79,-18.09,;14.9,-16.55,;16.28,-15.87,;17.55,-16.72,)|

BDBM50607316

Cc1ccccc1Oc1cc(-n2c(=O)cc([nH]c2=O)C(F)(F)c2ccccc2)c2ccccc2c1Cl |(3.33,5.67,;4.67,4.9,;6,5.67,;7.33,4.9,;7.34,3.36,;6.01,2.59,;4.67,3.36,;3.33,2.59,;3.33,1.05,;2,.28,;2,-1.26,;.67,-2.03,;-.67,-1.26,;-.67,.28,;-2,-2.03,;-2,-3.57,;-.67,-4.34,;.67,-3.57,;2,-4.34,;-3.33,-4.34,;-4.1,-5.67,;-2.56,-5.67,;-4.67,-3.56,;-6.01,-4.33,;-7.34,-3.56,;-7.34,-2.02,;-6.01,-1.26,;-4.67,-2.02,;3.34,-2.03,;3.35,-3.58,;4.69,-4.33,;6.01,-3.55,;6,-2.01,;4.67,-1.25,;4.67,.28,;6,1.05,)|

BDBM50607291

Cc1ccccc1Oc1cc(c(Br)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;3.33,5,;4.66,5.77,;6,5,;6,3.47,;4.67,2.69,;3.33,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;2.01,-1.93,;2.01,-3.47,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607290

Cc1ccccc1Oc1cc(c(C)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;3.33,5,;4.66,5.77,;6,5,;6,3.47,;4.67,2.69,;3.33,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;2.01,-1.93,;2.01,-3.47,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;-.67,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.67,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607311

Cc1ccccc1Oc1cc(c(Cl)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;3.34,5,;4.67,5.77,;6,5,;6,3.47,;4.68,2.69,;3.34,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;2.01,-1.93,;2.01,-3.47,;3.34,-1.15,;3.34,.38,;4.67,1.15,;6,1.92,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.66,-4.23,;-4.66,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607288

Cc1ccccc1Oc1cc(c(F)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;3.33,5,;4.66,5.77,;6,5,;6,3.47,;4.67,2.69,;3.33,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;2.01,-1.93,;2.01,-3.47,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;-.67,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.67,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607292

Cc1ccccc1Oc1cc(c(I)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;3.33,5,;4.66,5.77,;6,5,;6,3.47,;4.67,2.69,;3.33,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;2.01,-1.93,;2.01,-3.47,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;-.67,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.67,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607293

Cc1ccccc1Oc1cc(c(O)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;3.33,5,;4.66,5.77,;6,5,;6,3.47,;4.67,2.69,;3.33,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;2.01,-1.93,;2.01,-3.47,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607295

Cc1ccccc1Oc1cc(c(OC(F)(F)F)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;3.33,5,;4.66,5.77,;6,5,;6,3.47,;4.67,2.69,;3.33,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;2.01,-1.92,;2.01,-3.46,;3.34,-4.23,;3.34,-5.77,;4.67,-3.46,;4.67,-5,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607289

Cc1ccccc1Oc1cc(ccc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F

BDBM50607312

Cc1ccccc1Oc1ccc(Cl)c(c1)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;3.34,5,;4.67,5.77,;6,5,;6,3.47,;4.68,2.69,;3.34,3.46,;2,2.69,;2,1.15,;3.34,.38,;3.34,-1.15,;2.01,-1.93,;2.01,-3.47,;.67,-1.15,;.67,.39,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.66,-4.23,;-4.66,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607307

Cc1ccccc1Oc1ccc(F)c(c1)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;3.34,5,;4.67,5.77,;6,5,;6,3.47,;4.68,2.69,;3.34,3.46,;2,2.69,;2,1.15,;3.34,.38,;3.34,-1.15,;2.01,-1.93,;2.01,-3.47,;.67,-1.15,;.67,.39,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.66,-4.23,;-4.66,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50118589

Clc1ccc(CNc2nn3c([nH]c(Cc4ccccc4)cc3=O)c2C#N)cc1

BDBM50118610

Clc1ccc(CNc2nn3c([nH]c(Cc4ccoc4)cc3=O)c2C#N)cc1

BDBM50172933

FC(F)(F)c1ccccc1S(=O)(=O)NNC(=O)c1cc2cc(Cl)ccc2[nH]1

BDBM50607285

Fc1cc(C#N)c(Oc2ccccc2)cc1-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2.01,-3.46,;2.01,-1.92,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;2,1.15,;2,2.69,;3.33,3.47,;3.33,5.01,;4.66,5.77,;6,5,;6,3.47,;4.67,2.69,;.67,.39,;.67,-1.15,;-.67,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.67,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607286

Fc1cc(C#N)c(Oc2ccccc2Cl)cc1-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2.01,-3.47,;2.01,-1.93,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;2,1.15,;2,2.69,;3.33,3.46,;4.67,2.69,;6,3.47,;6,5,;4.66,5.77,;3.33,5,;2,5.77,;.67,.39,;.67,-1.15,;-.67,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.67,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50607281

Fc1cccc(F)c1Oc1cc(c(F)cc1C#N)-n1c(=O)cc([nH]c1=O)C(F)(F)F |(2,5.77,;.66,5,;-.67,5.77,;-2,5,;-2,3.47,;-.67,2.69,;-.67,1.15,;.67,3.46,;2,2.69,;2,1.15,;.67,.39,;.67,-1.15,;2.01,-1.93,;2.01,-3.47,;3.34,-1.15,;3.33,.38,;4.67,1.15,;6,1.92,;-.66,-1.92,;-2,-1.15,;-2,.39,;-3.33,-1.92,;-3.33,-3.46,;-2,-4.23,;-.66,-3.46,;.67,-4.23,;-4.67,-4.23,;-4.67,-5.77,;-6,-3.46,;-6,-5,)|

BDBM50162493

NC(=O)NCC(O)c1ccccc1

BDBM50162300

NC(=O)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1

BDBM50162297

NC(=O)c1ccc(NC(=O)c2ccccc2)cc1

BDBM50162296

NC(=O)c1ccc(cc1)N1CCc2ccccc2C1=O

BDBM50173926

NC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1ccccn1 |r|

BDBM50173925

NC(=O)c1ccc2n([C@@H]3CCC[C@@H](C3)NC(=O)c3ccc(Br)s3)c(nc2c1)-c1cccnc1 |r|