NOS3

Reference Set (95 Compounds)

Nc1ccc2ccc(CNCCc3cccc(F)c3)cc2n1 ZINC000098209156

ZINC000098209156 (search)

N=C(Nc1cccc(CNCCc2cccc(F)c2)c1)c1cccs1 ZINC000098208518

ZINC000098208518 (search)

NC(=Nc1ccc(OC[C@H]2NCC[C@@H]2Oc2cccc(N=C(N)c3cccs3)c2)cc1)c1cccs1 ZINC001772647562

ZINC001772647562 (search)

NC(=Nc1cccc(COC[C@@H]2NCC[C@@H]2OCc2cccc(N=C(N)c3cccs3)c2)c1)c1cccs1 ZINC001772585642

ZINC001772585642 (search)

NC(=Nc1cccc(OC[C@@H]2NCC[C@H]2OCc2cccc(F)c2)c1)c1cccs1 ZINC001772630275

ZINC001772630275 (search)

N=C(Nc1cccc(CCNCc2cccc(NC(=N)c3cccs3)c2)c1)c1cccs1 ZINC000098208985

ZINC000098208985 (search)

NC(=Nc1cccc(COC[C@H]2NCC[C@@H]2OCc2cccc(N=C(N)c3cccs3)c2)c1)c1cccs1 ZINC001772590338

ZINC001772590338 (search)

NC(=Nc1ccc(CNCCc2cccc(N=C(N)c3cccs3)c2)cc1)c1cccs1 ZINC001772574494

ZINC001772574494 (search)

N=C(Nc1cccc(COC[C@@H]2C[C@H](OCc3cccc(NC(=N)c4cccs4)c3)CN2)c1)c1cccs1 ZINC000098208545

ZINC000098208545 (search)

NC(=Nc1cccc(OC[C@H]2NCC[C@@H]2Oc2cccc(N=C(N)c3cccs3)c2)c1)c1cccs1 ZINC001772610992

ZINC001772610992 (search)

Nc1ccc2ccc(CNCCCc3cccc(F)c3)cc2n1 ZINC000098209181

ZINC000098209181 (search)

N=C(Nc1cccc(OCCCOc2cccc(NC(=N)c3cccs3)c2)c1)c1cccs1 ZINC000103253480

ZINC000103253480 (search)

N=C(Nc1cccc(OC[C@@H](O)c2cccc(NC(=N)c3cccs3)c2)c1)c1cccs1 ZINC000103253473

ZINC000103253473 (search)

NC(=Nc1cccc(OC[C@H]2CCN[C@@H]2COCc2cccc(F)c2)c1)c1cccs1 ZINC001772603925

ZINC001772603925 (search)

Nc1ccc2ccc(CCNCCCc3cccc(F)c3)cc2n1 ZINC000098209148

ZINC000098209148 (search)

CN(C)c1cccc2c(S(=O)(=O)NCc3ccc(N=C(N)c4cccs4)cc3)cccc12 ZINC001772636642

ZINC001772636642 (search)

Nc1ccc2ccc(CCNCc3cccc(F)c3)cc2n1 ZINC000098209153

ZINC000098209153 (search)

Nc1ccc2ccc(CCNCCc3ccc(F)cc3)cc2n1 ZINC000103256846

ZINC000103256846 (search)

Nc1ccc2ccc(CCNCCc3ccc(Cl)cc3)cc2n1 ZINC000103256833

ZINC000103256833 (search)

CC(=N)Nc1cccc(CN)c1 ZINC000003826186

ZINC000003826186 (search)

C#CC/N=C(/N)NCCC[C@H](N)C(=O)O ZINC000013606628

ZINC000013606628 (search)

NN[C@@H](N)NCCC[C@@H](N)C(=O)O ZINC000029557849

ZINC000029557849 (search)

$N/C(=N\[N+](=O)[O-])NCCC[C@H](N)C(=O)O ZINC000019796052$

ZINC000019796052 (search)

$C=CCN/C(N)=N\CCC[C@H](N)C(C)=O ZINC000027300394$

ZINC000027300394 (search)

CC(C)(C)c1cc(CCCNCc2cccc(NC(=N)c3cccs3)c2)cc(C(C)(C)C)c1O ZINC000013487053

ZINC000013487053 (search)

Cc1ccc([N+](=O)[O-])c(NCCC[C@H](N)C(=O)O)c1 ZINC000003806186

ZINC000003806186 (search)

CNC(=N)NCCC[C@H](N)C(=O)O ZINC000001529776

ZINC000001529776 (search)

N=C(Nc1ccc(CCNCc2cccc(Cl)c2)cc1)c1cccs1 ZINC000001895591

ZINC000001895591 (search)

CC(C)c1cc(CCCNCc2cccc(/N=C(/N)c3cccs3)c2)cc(C(C)C)c1O ZINC000026248501

ZINC000026248501 (search)

CCCNC(=N)NCCC[C@H](N)C(=O)O ZINC000001546170

ZINC000001546170 (search)

Cc1ccc([N+](=O)[O-])c(SCCC[C@H](N)C(=O)O)c1 ZINC000013780220

ZINC000013780220 (search)

CCNC(=N)NCCC[C@H](N)C(=O)O ZINC000002560273

ZINC000002560273 (search)

Cc1ccc([N+](=O)[O-])c(OCCC[C@H](N)C(=O)O)c1 ZINC000013780219

ZINC000013780219 (search)

N=C(Nc1cccc(CN)c1)c1ccco1 ZINC000013780458

ZINC000013780458 (search)

N=C(N)n1cccn1 ZINC000004217344

ZINC000004217344 (search)

COC(=O)[C@@H](CCCN/C(N)=N/[N+](=O)[O-])NC(=O)[C@H](N)Cc1ccccc1 ZINC000013517954

ZINC000013517954 (search)

$CCC/N=C(\N)n1cccn1 ZINC000026672972$

ZINC000026672972 (search)

CCOc1cc([C@H]2Oc3cc(O)cc(O)c3C[C@H]2O)ccc1O ZINC000096273542

ZINC000096273542 (search)

Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2 ZINC000000119988

ZINC000000119988 (search)

Cc1cc(CCNCc2ccc3ccc(N)nc3c2)ccc1C#N ZINC001772631778

ZINC001772631778 (search)

N#Cc1ccc(CCNCc2ccc3ccc(N)nc3c2)cc1Cl ZINC001772652361

ZINC001772652361 (search)

N#Cc1cccc(CCNCc2ccc3ccc(N)nc3c2)c1 ZINC001772624076

ZINC001772624076 (search)

Cc1cc(CCNCc2ccc3c(C)cc(N)nc3c2)ccc1C#N ZINC001772598422

ZINC001772598422 (search)

Cc1ccncc1CCCNCc1ccc2ccc(N)nc2c1 ZINC001772641876

ZINC001772641876 (search)

N#Cc1ccc(CCNCc2ccc3ccc(N)nc3c2)cc1 ZINC001772580376

ZINC001772580376 (search)

C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(N)=O)C(=O)O ZINC000028645899

ZINC000028645899 (search)

Cc1cc(N)nc(CCCCCc2cc(C)cc(N)n2)c1 ZINC000095921097

ZINC000095921097 (search)

Nc1ccc2ccc(CNCCCc3cccnc3)cc2n1 ZINC000584905751

ZINC000584905751 (search)

N=C(Nc1cccc(O[C@H]2CN[C@H](COc3ccc(/N=C(/N)c4cccs4)cc3)C2)c1)c1cccs1 ZINC000098209317

ZINC000098209317 (search)

Cc1cc(N)nc2cc(CNCCc3ccc(C#N)cc3)ccc12 ZINC001772627294

ZINC001772627294 (search)

Cc1cc(N)nc(CCc2cccc(CCc3cc(C)cc(N)n3)c2)c1 ZINC000071316606

ZINC000071316606 (search)

Cc1cc(N)nc(CCc2ccc3ccc(CCc4cc(C)cc(N)n4)cc3c2)c1 ZINC000071318031

ZINC000071318031 (search)

Cc1cc(N)nc(CCc2cc(C#N)cc(NCCc3ccccn3)c2)c1 ZINC000222071365

ZINC000222071365 (search)

CN(C)c1ccc(CCNCc2ccc3ccc(N)nc3c2)cc1 ZINC001772625092

ZINC001772625092 (search)

Cc1cc(N)nc(CCc2ccc3cc(CCc4cc(C)cc(N)n4)ccc3c2)c1 ZINC000071329083

ZINC000071329083 (search)

COc1ccncc1CCCNCc1ccc2ccc(N)nc2c1 ZINC001772622553

ZINC001772622553 (search)

$N/C(=N\c1cccc(OC[C@@H]2C[C@@H](OCc3cccc(F)c3)CN2)c1)c1cccs1 ZINC000223075702$

ZINC000223075702 (search)

O=[N+]([O-])c1cccc2c(Br)n[nH]c12 ZINC000003870920

ZINC000003870920 (search)

Cc1cc(N)nc(CCCCCCCc2cc(C)cc(N)n2)c1 ZINC000096282516

ZINC000096282516 (search)

Cc1cc(N)nc(COC[C@@H]2C[C@@H](OCc3cc(C)cc(N)n3)CN2)c1 ZINC000095921101

ZINC000095921101 (search)

Cc1cc(N)nc(COC[C@@H]2C[C@H](OCc3cc(C)cc(N)n3)CN2)c1 ZINC000103256491

ZINC000103256491 (search)

Cc1cc(N)nc(CCc2ccc(CCc3cc(C)cc(N)n3)cc2)c1 ZINC000071329896

ZINC000071329896 (search)

$N/C(=N\c1cccc(COC[C@@H]2C[C@@H](OCc3cccc(/N=C(\N)c4cccs4)c3)CN2)c1)c1cccs1 ZINC000222227124$

ZINC000222227124 (search)

Cc1cc(N)nc(COC[C@H](N)[C@H](C)OCc2cc(C)cc(N)n2)c1 ZINC000095921099

ZINC000095921099 (search)

Cc1cc(N)nc(CCc2cncc(CCc3cc(C)cc(N)n3)c2)c1 ZINC000064744247

ZINC000064744247 (search)

N=C(Nc1ccc(CCNCc2cccc(NC(=N)c3cccs3)c2)cc1)c1cccs1 ZINC000098208984

ZINC000098208984 (search)

Cc1cc(N)nc(CCCCCCc2cc(C)cc(N)n2)c1 ZINC000096282517

ZINC000096282517 (search)

Cc1cc(N)nc(COC[C@@H](N)[C@@H](C)OCc2cc(C)cc(N)n2)c1 ZINC000096284704

ZINC000096284704 (search)

$N/C(=N\c1cccc(COC[C@H]2C[C@H](OCc3cccc(/N=C(\N)c4cccs4)c3)CN2)c1)c1cccs1 ZINC000222225291$

ZINC000222225291 (search)

CNCc1cncc(OCc2ccc3ccc(N)nc3c2)c1 ZINC000653751502

ZINC000653751502 (search)

$N/C(=N\c1cccc(OC[C@@H]2C[C@@H](Oc3cccc(/N=C(\N)c4cccs4)c3)CN2)c1)c1cccs1 ZINC000223072933$

ZINC000223072933 (search)

Cc1cc(N)nc(COC[C@H]2C[C@@H](OCc3cc(C)cc(N)n3)CN2)c1 ZINC000103256488

ZINC000103256488 (search)

Cc1cc(N)nc(CCc2cccc([C@@H](O)Cc3cc(C)cc(N)n3)c2)c1 ZINC000098209385

ZINC000098209385 (search)

$N/C(=N\c1cccc(COC[C@H]2C[C@@H](OCc3cccc(/N=C(\N)c4cccs4)c3)CN2)c1)c1cccs1 ZINC000223071339$

ZINC000223071339 (search)

Fc1cccc([C@@H]2C[C@H]2CNCCc2ccnc(-n3ccnc3)n2)c1 ZINC000263620465

ZINC000263620465 (search)

Fc1cccc(CCNCCc2ccnc(-n3ccnc3)n2)c1 ZINC000263621351

ZINC000263621351 (search)

Cc1cc(N)nc(CCc2cccc(CCc3cc(C)nc(N)c3)c2)c1 ZINC000064744246

ZINC000064744246 (search)

Cc1cc(N)nc(CCc2cccc([C@H](CN)Cc3cc(C)cc(N)n3)c2)c1 ZINC000098209387

ZINC000098209387 (search)

Cc1cc(N)nc(CCc2cc(N)cc(CCc3cc(C)cc(N)n3)c2)c1 ZINC000064744205

ZINC000064744205 (search)

Fc1cccc(CCCNCCc2ccnc(-n3ccnc3)n2)c1 ZINC000263620478

ZINC000263620478 (search)

Cc1cc(N)nc(COCCOCc2cc(C)cc(N)n2)c1 ZINC000096284706

ZINC000096284706 (search)

Cc1cc(N)nc(COCc2cccc(CNCCc3cccc(F)c3)n2)c1 ZINC000096282514

ZINC000096282514 (search)

$N/C(=N\c1cccc(O[C@H]2CN[C@H](COCc3cccc(F)c3)C2)c1)c1cccs1 ZINC000222958032$

ZINC000222958032 (search)

Cc1cc(N)nc(COCCOC[C@@H]2C[C@@H](OCc3cc(C)cc(N)n3)CN2)c1 ZINC000103256493

ZINC000103256493 (search)

CN(C)c1cccc(CNCc2ccc3ccc(N)nc3c2)c1 ZINC000584905571

ZINC000584905571 (search)

Cc1cc(N)nc(COC[C@H]2C[C@H](OCc3cc(C)cc(N)n3)CN2)c1 ZINC000098209329

ZINC000098209329 (search)

Nc1ccc2ccc(CCNCCc3cccc(Cl)c3)cc2n1 ZINC000098209150

ZINC000098209150 (search)

N#Cc1cccc(NCc2ccc3ccc(N)nc3c2)c1 ZINC001772597630

ZINC001772597630 (search)

Cc1cc(N)nc(CO[C@H]2CN[C@H](COCCOCc3cccc(F)c3)C2)c1 ZINC000103256497

ZINC000103256497 (search)

Cc1cc(N)nc(C[C@@H]2CNC[C@@H]2OCc2ccc(-c3ccc(F)c(C)c3)cc2)c1 ZINC000058583521

ZINC000058583521 (search)

Clc1cccc(CCCNCCc2ccnc(-n3ccnc3)n2)c1 ZINC000263621135

ZINC000263621135 (search)

Nc1cccc(C[C@@H]2CNC[C@@H]2Oc2cccc(Oc3ccc(Cl)c(F)c3)c2)n1 ZINC000058582925

ZINC000058582925 (search)

CN(C)c1ccc(CNCc2ccc3ccc(N)nc3c2)cc1 ZINC001772655149

ZINC001772655149 (search)

Cc1cc(N)nc(COCCOC[C@H]2C[C@@H](OCc3cc(C)cc(N)n3)CN2)c1 ZINC000103256495

ZINC000103256495 (search)

Cc1cc(N)nc(CCc2cccc(CCc3cc(C)cc(N)n3)n2)c1 ZINC000064744251

ZINC000064744251 (search)