PYGM

Reference Set (96 Compounds)

CCN1C(C)=C(C(=O)OC(C)C)[C@@H](c2ccccc2)C(C(=O)O)=C1C(=O)O ZINC000013553477

ZINC000013553477 (search)

O=C(N[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC(O)CC1)c1cc2cc(Cl)ccc2[nH]1 ZINC000000602032

ZINC000000602032 (search)

O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cccc([N+](=O)[O-])c1 ZINC000012504111

ZINC000012504111 (search)

CN1CC[C@H](c2c(O)cc(O)c3c(=O)cc(-c4ccccc4Cl)oc23)[C@H](O)C1 ZINC000021288966

ZINC000021288966 (search)

O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1Cl ZINC000084704255

ZINC000084704255 (search)

O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1I ZINC000084671507

ZINC000084671507 (search)

O=C1NC(=O)[C@]2(C[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)N1 ZINC000027107824

ZINC000027107824 (search)

O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1Br ZINC000084671506

ZINC000084671506 (search)

O=C1NC(=O)[C@@]2(N1)O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O ZINC000012501147

ZINC000012501147 (search)

CC[C@H]1O[C@@H](NC(=S)N/N=C/c2ccc(F)cc2)[C@H](O)[C@@H](O)[C@@H]1O ZINC000064447309

ZINC000064447309 (search)

O=C1NC(=S)N[C@@]12O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O ZINC000003931735

ZINC000003931735 (search)

O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cccc(Cl)c1 ZINC000013580632

ZINC000013580632 (search)

O=C(Nc1cc2ccccc2cc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc([N+](=O)[O-])ccn1 ZINC000013587597

ZINC000013587597 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1ccc(Cl)cc1 ZINC000013553499

ZINC000013553499 (search)

CCN1C(C)=C(C(=O)NCC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C1C(=O)O ZINC000013553491

ZINC000013553491 (search)

O=C(Nc1c(F)cccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc([N+](=O)[O-])ccn1 ZINC000013587609

ZINC000013587609 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1cccc([N+](=O)[O-])c1 ZINC000013553501

ZINC000013553501 (search)

CCN1C(C)=C(C(=O)NCc2ccccc2)[C@@H](c2ccccc2Cl)C(C(=O)O)=C1C(=O)O ZINC000013553493

ZINC000013553493 (search)

COc1ccc(CN2C(C)=C(C(=O)OC(C)C)[C@@H](c3ccccc3Cl)C(C(=O)O)=C2C(=O)O)cc1OC ZINC000003926302

ZINC000003926302 (search)

O=C(Nc1cc2ccccc2cc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(Cl)ccn1 ZINC000013587598

ZINC000013587598 (search)

COc1ccnc(C(=O)Nc2cc3ccccc3cc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 ZINC000013587599

ZINC000013587599 (search)

CCN1C(C)=C(C(=O)NC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C1C(=O)O ZINC000013553487

ZINC000013553487 (search)

O=C(N[C@@H]1Cc2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1 ZINC000013587881

ZINC000013587881 (search)

CCNC(=O)C1=C(C)N(CC)C(C(=O)O)=C(C(=O)O)[C@@H]1c1ccccc1Cl ZINC000013553489

ZINC000013553489 (search)

O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc([N+](=O)[O-])ccn1 ZINC000013587603

ZINC000013587603 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1ccccc1 ZINC000013553485

ZINC000013553485 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1cccc(Cl)c1 ZINC000013553497

ZINC000013553497 (search)

CCc1ccnc(C(=O)Nc2cc3ccccc3cc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 ZINC000013587601

ZINC000013587601 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)Cc2ccccc21 ZINC000013587885

ZINC000013587885 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1cc(Cl)cc(Cl)c1 ZINC000027076810

ZINC000027076810 (search)

O=C(N[C@H]1Cc2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1 ZINC000013587882

ZINC000013587882 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1ccc(Cl)c(Cl)c1 ZINC000027075358

ZINC000027075358 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1CC(F)(F)F ZINC000013553483

ZINC000013553483 (search)

O=C(N[C@@H]1CCc2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1 ZINC000013587883

ZINC000013587883 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3cc(Cl)cc(F)c3[nH]2)Cc2ccccc21 ZINC000013587925

ZINC000013587925 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)Cc2ccccc21 ZINC000013587889

ZINC000013587889 (search)

Cc1ccnc(C(=O)Nc2cc3ccccc3cc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 ZINC000013587600

ZINC000013587600 (search)

CN1C(=O)[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)Cc2ccccc21 ZINC000013587886

ZINC000013587886 (search)

O=C(Nc1c(F)cccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(Cl)ccn1 ZINC000013587610

ZINC000013587610 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3ccc(Cl)cc3[nH]2)Cc2ccccc21 ZINC000013587911

ZINC000013587911 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3cc(Br)ccc3[nH]2)Cc2ccccc21 ZINC000013587893

ZINC000013587893 (search)

O=C(Nc1cc2ccccc2cc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(C(F)(F)F)ccn1 ZINC000013587602

ZINC000013587602 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3cccc(Cl)c3[nH]2)Cc2ccccc21 ZINC000013587915

ZINC000013587915 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3cc(F)ccc3[nH]2)Cc2ccccc21 ZINC000013587895

ZINC000013587895 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1cc(Cl)ccc1Cl ZINC000027092338

ZINC000027092338 (search)

Cc1ccc2[nH]c(C(=O)N[C@H]3Cc4ccccc4N(C)C3=O)cc2c1 ZINC000013587897

ZINC000013587897 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)CCc2ccccc21 ZINC000013587887

ZINC000013587887 (search)

O=C(Nc1cc(F)ccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc([N+](=O)[O-])ccn1 ZINC000013587612

ZINC000013587612 (search)

Cn1c(=O)c(Nc2ccc(C(=O)Nc3ccon3)cc2)nc2ccccc21 ZINC000013982624

ZINC000013982624 (search)

Cn1c(=O)c(Nc2ccc(C(=O)NCc3cccs3)cc2)nc2ccccc21 ZINC000013982625

ZINC000013982625 (search)

COc1ccnc(C(=O)Nc2c(F)cccc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 ZINC000013587611

ZINC000013587611 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3cc(C#N)ccc3[nH]2)Cc2ccccc21 ZINC000013587903

ZINC000013587903 (search)

Cn1c(=O)c(Nc2ccc(C(=O)NCc3ccco3)cc2)nc2ccccc21 ZINC000013982629

ZINC000013982629 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)Cc2ccccc21 ZINC000013587917

ZINC000013587917 (search)

CCN1C(C)=C(C(=O)OC(C)C)[C@H](c2ccccc2Cl)C(C(=O)O)=C1C(=O)O ZINC000003776693

ZINC000003776693 (search)

Cn1c(=O)c(Nc2ccc(C(=O)NCc3cccs3)cc2)nc2cc(F)ccc21 ZINC000028524112

ZINC000028524112 (search)

O=C(Nc1cc2ccccc2cc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cccc([N+](=O)[O-])c1 ZINC000013587595

ZINC000013587595 (search)

O=C(NCc1cccs1)c1ccc(Nc2nc3ccccc3[nH]c2=O)cc1 ZINC000028526122

ZINC000028526122 (search)

N#Cc1ccnc(C(=O)Nc2ccccc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 ZINC000013587607

ZINC000013587607 (search)

CC1=NC(C(=O)O)=C(C(=O)O)[C@H](c2ccccc2Cl)C1C(=O)OC(C)C ZINC000027083017

ZINC000027083017 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1ccccc1Cl ZINC000013553495

ZINC000013553495 (search)

O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(Cl)ccn1 ZINC000013587604

ZINC000013587604 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1ccc(Cl)cc1Cl ZINC000027080120

ZINC000027080120 (search)

CCn1c(=O)c(Nc2ccc(C(=O)NCc3cccs3)cc2)nc2ccccc21 ZINC000028526123

ZINC000028526123 (search)

Cn1c(=O)c(Nc2ccc(C(=O)NCc3cccs3)cc2)nc2cccnc21 ZINC000028526443

ZINC000028526443 (search)

Cn1c(=O)c(Nc2ccc(C(=O)Nc3cc[nH]n3)cc2)nc2ccccc21 ZINC000028525893

ZINC000028525893 (search)

COc1ccnc(C(=O)Nc2ccccc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 ZINC000013587605

ZINC000013587605 (search)

CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1cccc(Cl)c1Cl ZINC000027078731

ZINC000027078731 (search)

O=C(N[C@H]1CCc2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1 ZINC000013587884

ZINC000013587884 (search)

Cc1ccc2nc(Nc3ccc(C(=O)NCc4cccs4)cc3)c(=O)n(C)c2c1 ZINC000028526442

ZINC000028526442 (search)

O=C(NCc1cccs1)c1ccc(Nc2nc3ccccc3n(CCO)c2=O)cc1 ZINC000028525812

ZINC000028525812 (search)

O=C(NCc1cccs1)c1ccc(Nc2nc3ccccc3n(CCN3CCOCC3)c2=O)cc1 ZINC000028524686

ZINC000028524686 (search)

O=C(NCc1cccs1)c1ccc(Nc2nc3ccccc3n(CCN3CCCCC3)c2=O)cc1 ZINC000028526705

ZINC000028526705 (search)

O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(I)ccn1 ZINC000013587606

ZINC000013587606 (search)

Cn1c(=O)c(Nc2ccc(C(=O)Nc3nccs3)cc2)nc2ccccc21 ZINC000028525894

ZINC000028525894 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3cc(C(F)(F)F)ccc3[nH]2)Cc2ccccc21 ZINC000013587905

ZINC000013587905 (search)

O=C(NCc1cccs1)c1ccc(Nc2nc3ccccc3n(CCc3ccccn3)c2=O)cc1 ZINC000028526602

ZINC000028526602 (search)

O=C(Nc1cc(F)ccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(Cl)ccn1 ZINC000013587613

ZINC000013587613 (search)

Cn1c(=O)c(Nc2ccc(NC(=O)c3ccno3)cc2)nc2ccccc21 ZINC000028525112

ZINC000028525112 (search)

CN(C)CCn1c(=O)c(Nc2ccc(C(=O)NCc3cccs3)cc2)nc2ccccc21 ZINC000028525943

ZINC000028525943 (search)

Cn1c(=O)c(Nc2ccc(NC(=O)c3ccon3)cc2)nc2ccccc21 ZINC000028525111

ZINC000028525111 (search)

O=C(Nc1cc2ccccc2cc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1ccccn1 ZINC000013587596

ZINC000013587596 (search)

CCc1ccc2[nH]c(C(=O)N[C@@H]3Cc4ccccc4N(C)C3=O)cc2c1 ZINC000013587899

ZINC000013587899 (search)

COc1ccc2[nH]c(C(=O)N[C@@H]3Cc4ccccc4N(C)C3=O)cc2c1 ZINC000013587901

ZINC000013587901 (search)

O=C(Nc1c(F)cccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cccc([N+](=O)[O-])c1 ZINC000013587608

ZINC000013587608 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3c(Cl)cccc3[nH]2)Cc2ccccc21 ZINC000013587891

ZINC000013587891 (search)

O=C(N[C@@H]1Cc2ccccc2NC1=O)c1ccc(Cl)c(Cl)c1 ZINC000013587877

ZINC000013587877 (search)

O=C(N[C@H]1CCc2ccccc2NC1=O)c1cc2ccccc2[nH]1 ZINC000013587875

ZINC000013587875 (search)

O=c1[nH]c2ccccc2nc1Nc1ccccc1 ZINC000021364693

ZINC000021364693 (search)

Cn1c(=O)c(Nc2ccc(-c3ccc[nH]3)cc2)nc2ccccc21 ZINC000028522720

ZINC000028522720 (search)

Cn1c(=O)c(Nc2ccc(NC(=O)c3ccco3)cc2)nc2ccccc21 ZINC000028522996

ZINC000028522996 (search)

COC(=O)c1ccc2[nH]c(C(=O)N[C@@H]3Cc4ccccc4N(C)C3=O)cc2c1 ZINC000013587909

ZINC000013587909 (search)

Cn1c(=O)c(Nc2ccc(-c3ccoc3)cc2)nc2ccccc21 ZINC000028522722

ZINC000028522722 (search)

O=C(O)Cn1c(=O)c(Nc2ccc(C(=O)NCc3cccs3)cc2)nc2ccccc21 ZINC000028526796

ZINC000028526796 (search)

CN1C(=O)[C@@H](NC(=O)c2cc3cccc(N)c3[nH]2)Cc2ccccc21 ZINC000013587919

ZINC000013587919 (search)

O=C(O)C1=C(C(=O)O)NC=CC1 ZINC000141101071

ZINC000141101071 (search)