DBF4

Reference Set (132 Compounds)

O=c1cc(-c2c[nH]c3ncccc23)nc(NC2CCCCC2)[nH]1 ZINC000101473306

ZINC000101473306 (search)

O=c1cc(-c2c[nH]c3ncccc23)nc(NCc2ccccc2)[nH]1 ZINC000101473309

ZINC000101473309 (search)

CN(c1nc(-c2c[nH]c3ncccc23)cc(=O)[nH]1)C1CCCCC1 ZINC000101473283

ZINC000101473283 (search)

CN1CCC(Nc2nc(-c3c[nH]c4ncccc34)cc(=O)[nH]2)CC1 ZINC000101473293

ZINC000101473293 (search)

O=c1cc(-c2c[nH]c3ncccc23)nc(Nc2ccccc2)[nH]1 ZINC000101473287

ZINC000101473287 (search)

O=c1cc(-c2c[nH]c3ncccc23)nc(NC2CCOCC2)[nH]1 ZINC000101473291

ZINC000101473291 (search)

COCCN(CCOC)c1nc(-c2c[nH]c3ncccc23)cc(=O)[nH]1 ZINC000101473288

ZINC000101473288 (search)

O=c1cc(-c2c[nH]c3ncccc23)nc(N2CCOCC2)[nH]1 ZINC000101473290

ZINC000101473290 (search)

O=c1cc(-c2c[nH]c3ncccc23)nc(N2CCC(O)CC2)[nH]1 ZINC000101473298

ZINC000101473298 (search)

COC1CCN(c2nc(-c3c[nH]c4ncccc34)cc(=O)[nH]2)CC1 ZINC000101473300

ZINC000101473300 (search)

O=c1cc(-c2c[nH]c3ncccc23)nc(-c2ccccc2)[nH]1 ZINC000101473295

ZINC000101473295 (search)

O=c1nc(-c2c[nH]c3ncccc23)nc(NC2CCCCC2)[nH]1 ZINC000101473272

ZINC000101473272 (search)

O=c1cc(-c2ccc3[nH]ncc3c2)nc(NC2CCCCC2)[nH]1 ZINC000101473270

ZINC000101473270 (search)

O=c1cc(-c2c[nH]c3ncccc23)cc(NC2CCCCC2)[nH]1 ZINC000101473275

ZINC000101473275 (search)

Cc1nc2sc3c(N)ncnc3c2c2c1CCCC2 ZINC000040828984

ZINC000040828984 (search)

Cc1[nH]ncc1-c1cc2nc(CN3CCCC3)[nH]c(=O)c2s1 ZINC000145208822

ZINC000145208822 (search)

$COC(=O)C1=C(Nc2ccccc2Cl)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC001772587876$

ZINC001772587876 (search)

Fc1ncccc1[C@H](Nc1nnc(-c2c[nH]c3ncccc23)o1)C1CC1 ZINC000103247492

ZINC000103247492 (search)

Fc1ccccc1[C@H](Nc1nnc(-c2c[nH]c3ncccc23)o1)C1CC1 ZINC000103247490

ZINC000103247490 (search)

c1ccc([C@H](Nc2nnc(-c3c[nH]c4ncccc34)o2)C2CC2)cc1 ZINC000103245755

ZINC000103245755 (search)

CCc1c(C)nc2sc3c(N)ncnc3c2c1C ZINC000040829535

ZINC000040829535 (search)

Cc1[nH]ncc1-c1cc2nc(CN3CC[C@H](F)C3)[nH]c(=O)c2s1 ZINC000145157785

ZINC000145157785 (search)

Fc1cnc2[nH]cc(-c3nnc(N[C@@H](c4cccnc4F)C4CC4)o3)c2c1 ZINC000103247500

ZINC000103247500 (search)

O=c1cc(NC2CCCCC2)cc(-c2c[nH]c3ncccc23)[nH]1 ZINC000101473279

ZINC000101473279 (search)

Cc1[nH]ncc1-c1cc2nc(CN3CCC[C@@H]3C)[nH]c(=O)c2s1 ZINC000145249012

ZINC000145249012 (search)

O=c1[nH]c(CN2CCCC2)nc2cc(-c3cn[nH]c3)sc12 ZINC001772581201

ZINC001772581201 (search)

CNCc1nc2cc(-c3cn[nH]c3C)sc2c(=O)[nH]1 ZINC000143146590

ZINC000143146590 (search)

O=c1nc(-c2c[nH]c3ncccc23)cc(NC2CCCCC2)[nH]1 ZINC000101473273

ZINC000101473273 (search)

Cc1[nH]ncc1-c1cc2nc(CC3CCCC3)[nH]c(=O)c2s1 ZINC000143107320

ZINC000143107320 (search)

Cc1[nH]ncc1-c1cc2nc(CN(C)C)[nH]c(=O)c2s1 ZINC000145167904

ZINC000145167904 (search)

Fc1ccccc1[C@H](Nc1nnc(-c2c[nH]c3ncncc23)o1)C1CC1 ZINC000103247495

ZINC000103247495 (search)

Cc1[nH]ncc1-c1cc2nc(CN3CC[C@H](C)C3)[nH]c(=O)c2s1 ZINC000145231083

ZINC000145231083 (search)

Fc1cnccc1[C@H](Nc1nnc(-c2c[nH]c3ncccc23)o1)C1CC1 ZINC000103247494

ZINC000103247494 (search)

CC(C)[C@@H](Nc1nnc(-c2c[nH]c3ncccc23)o1)c1ccccc1 ZINC000103245752

ZINC000103245752 (search)

O=c1cc(-c2ccncc2)nc(NC2CCCCC2)[nH]1 ZINC000063298397

ZINC000063298397 (search)

C=CCc1c(C)nc2sc3c(N)ncnc3c2c1C ZINC000034563505

ZINC000034563505 (search)

Cc1c2c(nc3sc4c(N)ncnc4c13)CCCC2 ZINC000040866646

ZINC000040866646 (search)

Cc1[nH]ncc1-c1cc2nc(CN3CCCCC3)[nH]c(=O)c2s1 ZINC000145253775

ZINC000145253775 (search)

$COC(=O)C1=C(Nc2ccccc2F)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC001772580486$

ZINC001772580486 (search)

CCc1[nH]ncc1-c1cc2nc(CN3CCCC3)[nH]c(=O)c2s1 ZINC000145145267

ZINC000145145267 (search)

$COC(=O)C1=C(Nc2ccc(F)cc2F)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC000205452200$

ZINC000205452200 (search)

Cc1[nH]ncc1-c1cc2nc(C3CCCCC3)[nH]c(=O)c2s1 ZINC000143047675

ZINC000143047675 (search)

Cc1[nH]ncc1-c1cc2nc(CN3CC[C@@H](C)C3)[nH]c(=O)c2s1 ZINC000145139269

ZINC000145139269 (search)

Cc1[nH]ncc1-c1cc2nc([C@@H](C)N3CCCC3)[nH]c(=O)c2s1 ZINC000145235448

ZINC000145235448 (search)

O=c1[nH]c(CN2CCCC2)nc2cc(-c3ccncc3)sc12 ZINC001772590570

ZINC001772590570 (search)

Cc1nc2sc3c(N)ncnc3c2c2c1CCC2 ZINC000040835539

ZINC000040835539 (search)

$CCOC(=O)C1=C(Nc2ccccc2)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC000203747723$

ZINC000203747723 (search)

$COC(=O)C1=C(Nc2ccccc2)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC000205449051$

ZINC000205449051 (search)

NC(=O)c1sc(-c2ccnc(N)n2)nc1-c1ccc(Cl)cc1Cl ZINC000169342588

ZINC000169342588 (search)

$COC(=O)C1=C(Nc2ccccc2C)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC001772581286$

ZINC001772581286 (search)

Cc1[nH]ncc1-c1cc2nc(CN3CCC[C@@H]3CO)[nH]c(=O)c2s1 ZINC000145190928

ZINC000145190928 (search)

Fc1ccc2c(-c3nnc(N[C@@H](c4cccnc4F)C4CC4)o3)c[nH]c2n1 ZINC000103247497

ZINC000103247497 (search)

CC[C@@H](Nc1nnc(-c2c[nH]c3ncccc23)o1)c1ccccc1 ZINC000103245750

ZINC000103245750 (search)

Cc1nc2sc3c(N)ncnc3c2c(C)c1C ZINC000000084214

ZINC000000084214 (search)

Cc1[nH]ncc1-c1cc2nc(N3CCOCC3)[nH]c(=O)c2s1 ZINC000145181679

ZINC000145181679 (search)

$COC(=O)C1=C(Nc2ccc(F)cc2)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC000205451969$

ZINC000205451969 (search)

$COC(=O)C1=C(Nc2ccc(OC)cc2)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC001772577200$

ZINC001772577200 (search)

Nc1nccc(-c2cc(=O)[nH]c(NC3CCCCC3)n2)n1 ZINC000073310210

ZINC000073310210 (search)

Cc1c2c(nc3sc4c(N)ncnc4c13)CCC2 ZINC000040392965

ZINC000040392965 (search)

Cc1[nH]ncc1-c1cc2nc(CNCc3ccccc3)[nH]c(=O)c2s1 ZINC000145227509

ZINC000145227509 (search)

O=c1cc(NC2CCCCC2)[nH]c(-c2c[nH]c3ncccc23)c1 ZINC000101473281

ZINC000101473281 (search)

Cc1ccc(-c2nc(-c3ccnc(N)n3)sc2C(N)=O)c(Cl)c1 ZINC000169342590

ZINC000169342590 (search)

COc1ccc(-c2nc(-c3ccnc(N)n3)sc2C(N)=O)c(Cl)c1 ZINC000169342591

ZINC000169342591 (search)

Cc1[nH]ncc1-c1cc2nc(CN3CC[C@H](c4ccccc4)C3)[nH]c(=O)c2s1 ZINC000145150122

ZINC000145150122 (search)

$O=C(O)C1=C(Nc2ccccc2)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC000205440992$

ZINC000205440992 (search)

Fc1cccc(CNc2nnc(-c3c[nH]c4ncccc34)o2)c1 ZINC000068201435

ZINC000068201435 (search)

Fc1cc2cc(-c3nnc(NCc4ccccc4)o3)ccc2cn1 ZINC000103245710

ZINC000103245710 (search)

Nc1n[nH]c2ccc(-c3nnc(NCc4ccccc4)o3)cc12 ZINC000103245722

ZINC000103245722 (search)

$COC(=O)C1=C(Nc2ccccc2OC)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC001772578385$

ZINC001772578385 (search)

NC(=O)c1sc(-c2ccncc2)nc1-c1ccc(Cl)cc1Cl ZINC000169342567

ZINC000169342567 (search)

Cc1[nH]ncc1-c1cc2nc(-c3ccccc3)[nH]c(=O)c2s1 ZINC000145126012

ZINC000145126012 (search)

O=c1cc(-c2cn[nH]c2)nc(NC2CCCCC2)[nH]1 ZINC000101473266

ZINC000101473266 (search)

c1ccc(CNc2nnc(-c3ccc4cnccc4c3)o2)cc1 ZINC000103245708

ZINC000103245708 (search)

NC(=O)c1sc(-c2ccnc(N)n2)nc1-c1ccccc1F ZINC000169342578

ZINC000169342578 (search)

NC(=O)c1sc(-c2ccnc(N)n2)nc1-c1ccccc1C(F)(F)F ZINC000169342581

ZINC000169342581 (search)

c1ccc(CNc2nnc(-c3ccc4[nH]ncc4c3)o2)cc1 ZINC000103245716

ZINC000103245716 (search)

CN(C)c1nc(-c2ccnc(N)n2)sc1C(N)=O ZINC000169342592

ZINC000169342592 (search)

c1ccc(CNc2nnc(-c3c[nH]c4ncccc34)o2)cc1 ZINC000103245729

ZINC000103245729 (search)

Fc1ccc(CNc2nnc(-c3c[nH]c4ncccc34)o2)cc1 ZINC000103245733

ZINC000103245733 (search)

$COC(=O)C1=C(NCCc2ccccc2)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC001772570652$

ZINC001772570652 (search)

C[C@@H](Nc1nnc(-c2c[nH]c3ncccc23)o1)c1ccccc1 ZINC000103245746

ZINC000103245746 (search)

NC(=O)c1sc(-c2ccnc(N)n2)nc1-c1cc(F)ccc1F ZINC000169342585

ZINC000169342585 (search)

Fc1ccccc1CNc1nnc(-c2c[nH]c3ncccc23)o1 ZINC000103245731

ZINC000103245731 (search)

C[C@H](Nc1nnc(-c2c[nH]c3ncccc23)o1)c1ccccc1 ZINC000103245744

ZINC000103245744 (search)

$COC(=O)C1=C(Nc2ccc3ncccc3c2)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC001772577871$

ZINC001772577871 (search)

Cc1cc(C)c2c(n1)sc1c(N)ncnc12 ZINC000000069901

ZINC000000069901 (search)

CCOC(=O)c1sc(-c2ccnc(N)n2)nc1O ZINC000169342571

ZINC000169342571 (search)

$CCOC(=O)C1=C(Nc2ccccc2)O/C(=C\c2c[nH]c3ncc(Cl)cc23)C1=O ZINC000203747762$

ZINC000203747762 (search)

NC(=O)c1sc(-c2ccnc(N)n2)nc1-c1cc(Cl)cc(Cl)c1 ZINC000169342589

ZINC000169342589 (search)

Cc1nc2cc(-c3cn[nH]c3C)sc2c(=O)[nH]1 ZINC000143047910

ZINC000143047910 (search)

COc1nc(-c2ccncc2)sc1C(N)=O ZINC000169342565

ZINC000169342565 (search)

NC(=O)c1sc(-c2ccncc2)nc1-c1ccccc1 ZINC000169342554

ZINC000169342554 (search)

O=C1Nc2ccccc2Nc2nc(-c3ccncc3)sc21 ZINC000169342563

ZINC000169342563 (search)

c1cnc2[nH]cc(-c3nnc(NCc4ccncc4)o3)c2c1 ZINC000103245742

ZINC000103245742 (search)

NC(=O)c1sc(-c2ccncc2)nc1O ZINC000144108870

ZINC000144108870 (search)

CC(C)(Nc1nnc(-c2c[nH]c3ncccc23)o1)c1ccccc1 ZINC000103245748

ZINC000103245748 (search)

Cc1[nH]ncc1-c1cc2nc([C@H](c3ccccc3)N3CCCC3)[nH]c(=O)c2s1 ZINC000145190558

ZINC000145190558 (search)

Cc1[nH]ncc1-c1cc2nc(CCN3CCCC3)[nH]c(=O)c2s1 ZINC000145171944

ZINC000145171944 (search)

c1ccc(CNc2nnc(-c3c[nH]c4ncccc34)o2)nc1 ZINC000103245736

ZINC000103245736 (search)

O=C(O)c1sc(-c2ccncc2)nc1-c1ccccc1 ZINC000041581432

ZINC000041581432 (search)

c1cncc(CNc2nnc(-c3c[nH]c4ncccc34)o2)c1 ZINC000103245739

ZINC000103245739 (search)

Cc1nc2sc3c(N)ncnc3c2c(C)c1Cc1ccccc1 ZINC000040874185

ZINC000040874185 (search)

O=c1cc(-c2ccccc2)nc(NC2CCCCC2)[nH]1 ZINC000008844063

ZINC000008844063 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1O ZINC000165724888

ZINC000165724888 (search)

O=c1cc(-c2c[nH]c3ncccc23)nc(NC(c2ccccc2)c2ccccc2)[nH]1 ZINC000101473304

ZINC000101473304 (search)

Nc1ncnc2c1sc1nc(C3CC3)cc(C(F)(F)F)c12 ZINC000040379527

ZINC000040379527 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1-c1cccc(Cl)c1Cl ZINC000169338443

ZINC000169338443 (search)

c1ccc(-c2nc(-c3ccncc3)sc2-c2nn[nH]n2)cc1 ZINC000169342559

ZINC000169342559 (search)

NNC(=O)c1sc(-c2ccncc2)nc1-c1ccccc1 ZINC000169342558

ZINC000169342558 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1-c1ccccc1Cl ZINC000169338439

ZINC000169338439 (search)

O=c1[nH]c2ccc(-c3nnc(NCc4ccccc4)o3)cc2o1 ZINC000103245725

ZINC000103245725 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1N(C)C ZINC000169338434

ZINC000169338434 (search)

O=C1Cc2cc(-c3nnc(NCc4ccccc4)o3)ccc2N1 ZINC000103245727

ZINC000103245727 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1-c1ccc(OC)cc1Cl ZINC000169338446

ZINC000169338446 (search)

$O=C1C(C(=O)N2CCCCC2)=C(Nc2ccccc2)O/C1=C\c1c[nH]c2ncccc12 ZINC001772576930$

ZINC001772576930 (search)

Nc1ncnc2c1sc1ncc(-c3ccccc3)cc12 ZINC000040835729

ZINC000040835729 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1-c1ccc(Cl)cc1Cl ZINC000169338445

ZINC000169338445 (search)

CCOC(=O)c1cc2c(nc1C)sc1c(N)ncnc12 ZINC000040395616

ZINC000040395616 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1-c1ccc(F)cc1Cl ZINC000169338441

ZINC000169338441 (search)

$CCOC(=O)C1=C(Nc2ccccc2)O/C(=C\c2ccc(O)c(C)c2)C1=O ZINC001772590508$

ZINC001772590508 (search)

Nc1ncnc2c1sc1ncccc12 ZINC000040846634

ZINC000040846634 (search)

$CCNC(=O)C1=C(Nc2ccccc2)O/C(=C\c2c[nH]c3ncccc23)C1=O ZINC001772572205$

ZINC001772572205 (search)

O=C(NO)c1sc(-c2ccncc2)nc1-c1ccccc1 ZINC000114957741

ZINC000114957741 (search)

c1ccc(CNc2nnc(-c3nc4ccncc4s3)o2)cc1 ZINC000103245713

ZINC000103245713 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1-c1ccccc1O ZINC000169338437

ZINC000169338437 (search)

c1ccc(-c2nc(-c3ccncc3)sc2-c2nnco2)cc1 ZINC000169342561

ZINC000169342561 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1N ZINC000169338424

ZINC000169338424 (search)

O=C(O)c1sc(-c2ccncc2)nc1O ZINC000107853222

ZINC000107853222 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1NC ZINC000169338427

ZINC000169338427 (search)

CCOC(=O)c1sc(-c2ccnc(CC)c2)nc1O ZINC000169342569

ZINC000169342569 (search)

CCOC(=O)c1sc(-c2ccncc2)nc1-c1cccnc1 ZINC000169338448

ZINC000169338448 (search)

CNC(=O)c1sc(-c2ccncc2)nc1O ZINC000169342555

ZINC000169342555 (search)