VCAM1

Reference Set (61 Compounds)

NC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1 ZINC000000026008

ZINC000000026008 (search)

CNC(=O)c1cc2c(Oc3ccc(COCCOCCOC)cc3)cncc2s1 ZINC000013864453

ZINC000013864453 (search)

CNC(=O)c1cc2c(Oc3ccc(Cl)cc3)cncc2s1 ZINC000000024089

ZINC000000024089 (search)

CNC(=O)c1cc2c(Oc3ccc(-n4cccn4)cc3)cncc2s1 ZINC000013864416

ZINC000013864416 (search)

CNC(=O)c1cc2c(Oc3ccc(-c4cccs4)cc3)cncc2s1 ZINC000013864423

ZINC000013864423 (search)

NC(=O)c1cc2c(Oc3ccc(-n4ccnc4)cc3)cncc2s1 ZINC000013864414

ZINC000013864414 (search)

CNC(=O)c1cc2c(Oc3ccc(-n4ccnc4)cc3)cncc2s1 ZINC000013864415

ZINC000013864415 (search)

COCc1ccc(Oc2cncc3sc(C(N)=O)cc23)cc1 ZINC000013864444

ZINC000013864444 (search)

NC(=O)c1cc2c(Oc3ccc(N)cc3)cncc2s1 ZINC000013864408

ZINC000013864408 (search)

CNC(=O)c1cc2c(Oc3ccc(C4(CO)CC4)cc3)cncc2s1 ZINC000013864454

ZINC000013864454 (search)

CNC(=O)c1cc2c(Oc3ccc(-c4ccccc4)cc3)cncc2s1 ZINC000013864422

ZINC000013864422 (search)

N#Cc1ccc(Oc2cncc3sc(C(N)=O)cc23)cc1 ZINC000000026578

ZINC000000026578 (search)

CNC(=O)c1cc2c(Oc3ccc(C#N)cc3)cncc2s1 ZINC000013864404

ZINC000013864404 (search)

CN(C)C(=O)c1cc2c(Oc3ccc(Cl)cc3)cncc2s1 ZINC000000026576

ZINC000000026576 (search)

CCc1ccc(Oc2cncc3sc(C(N)=O)cc23)cc1 ZINC000013864398

ZINC000013864398 (search)

CCOCCOCCOCC(F)(F)c1ccc(Oc2cncc3sc(C(=O)NC)cc23)cc1 ZINC000013864456

ZINC000013864456 (search)

COc1ccc2sc(C(N)=O)c(OC(C)C)c2c1 ZINC000000005745

ZINC000000005745 (search)

NC(=O)c1cc2c(Oc3ccc(CO)cc3)cncc2s1 ZINC000013864446

ZINC000013864446 (search)

CNC(=O)c1cc2c(Oc3ccc(-n4cncn4)cc3)cncc2s1 ZINC000013864417

ZINC000013864417 (search)

NC(=O)c1cc2c(Oc3ccc(Cl)cc3Br)cncc2s1 ZINC000013864392

ZINC000013864392 (search)

CNC(=O)c1cc2c(Oc3ccc(OC(F)(F)F)cc3)cncc2s1 ZINC000013864406

ZINC000013864406 (search)

CCOCCOCCOCC1(c2ccc(Oc3cncc4sc(C(=O)NC)cc34)cc2)CC1 ZINC000003994725

ZINC000003994725 (search)

CNC(=O)c1cc2c(Oc3ccc(C(F)(F)CO)cc3)cncc2s1 ZINC000013864455

ZINC000013864455 (search)

Cc1ccc(Sc2cncc3sc(C(N)=O)cc23)c(C)c1 ZINC000013862347

ZINC000013862347 (search)

C=CCc1ccccc1Oc1cncc2sc(C(N)=O)cc12 ZINC000013864393

ZINC000013864393 (search)

NC(=O)c1cc2c(Oc3cccc(Cl)c3)cncc2s1 ZINC000013864383

ZINC000013864383 (search)

O=C(NCCO)c1cc2c(Oc3ccc(Cl)cc3)cncc2s1 ZINC000013864381

ZINC000013864381 (search)

NC(=O)c1cc2c(Oc3ccc([C@@H](O)CO)cc3)cncc2s1 ZINC000013864448

ZINC000013864448 (search)

NC(=O)c1cc2c(Cl)cncc2s1 ZINC000013862341

ZINC000013862341 (search)

Cc1ccc(Sc2cncc3sccc23)cc1 ZINC000013862319

ZINC000013862319 (search)

CCc1cc2c(Sc3ccc(C)cc3)cncc2s1 ZINC000013862320

ZINC000013862320 (search)

CCc1cc2c(Sc3nnc(N)s3)ncnc2s1 ZINC000003126534

ZINC000003126534 (search)

Cc1ccc(Sc2cncc3sc(C(=O)c4ccccc4)cc23)cc1 ZINC000013862324

ZINC000013862324 (search)

CCN(CC)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000003885245

ZINC000003885245 (search)

CCc1cc2c(Sc3nnc(C)s3)ncnc2s1 ZINC000013862312

ZINC000013862312 (search)

Cc1ccc(Sc2cncc3sc(/C=N/Oc4ccccc4)cc23)cc1 ZINC000013862336

ZINC000013862336 (search)

NC(=O)c1cc2c(Oc3ccc(Cl)cc3)cncc2s1 ZINC000000008924

ZINC000000008924 (search)

O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1Cl ZINC000003885257

ZINC000003885257 (search)

O=C(c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000001599890

ZINC000001599890 (search)

N#Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000001609559

ZINC000001609559 (search)

COC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000005336299

ZINC000005336299 (search)

COCCN(CCOC)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000029484542

ZINC000029484542 (search)

CC(C)(Sc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)Sc1cc(C(C)(C)C)c(OC(=O)CCC(=O)O)c(C(C)(C)C)c1 ZINC000003937467

ZINC000003937467 (search)

CN(CCCN(C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000029484794

ZINC000029484794 (search)

O=[N+]([O-])c1cc(S(=O)(=O)c2ccc(F)c([N+](=O)[O-])c2)ccc1F ZINC000001596706

ZINC000001596706 (search)

O=[N+]([O-])c1cc(S(=O)(=O)N(c2ccccc2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1Cl ZINC000029484797

ZINC000029484797 (search)

CCCCCN(CCCCC)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000029484839

ZINC000029484839 (search)

CC(C)(Sc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)Sc1cc(C(C)(C)C)c(OC(=O)C[C@@H](O)CO)c(C(C)(C)C)c1 ZINC000026572936

ZINC000026572936 (search)

CCOC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000004660627

ZINC000004660627 (search)

CN1CCN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000036021336

ZINC000036021336 (search)

CC(C)(Sc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)Sc1cc(C(C)(C)C)c(OC(=O)CCCC(=O)O)c(C(C)(C)C)c1 ZINC000026572283

ZINC000026572283 (search)

CCCN(CCC)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000004263354

ZINC000004263354 (search)

N#Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000001668454

ZINC000001668454 (search)

CN(C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000003885322

ZINC000003885322 (search)

CCCCN(CCCC)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000004670198

ZINC000004670198 (search)

Cc1ccc(Sc2cccc3sc(C(N)=O)cc23)cc1 ZINC000013862318

ZINC000013862318 (search)

Cc1nnc(Sc2cncc3sc(C(N)=O)cc23)s1 ZINC000013862355

ZINC000013862355 (search)

CCN(C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000029487406

ZINC000029487406 (search)

CC(C)N(C(C)C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000029488782

ZINC000029488782 (search)

O=C(O)CC1[C@H]2CCC[C@H]1CN(Cc1ccc3c(c1)Nc1nccnc1S3)C2 ZINC000139392126

ZINC000139392126 (search)

CN(C)S(=O)(=O)NC1CCN(Cc2ccc3c(c2)Nc2nccnc2S3)CC1 ZINC000000603770

ZINC000000603770 (search)