276 SMILES Strings for Cell division cycle 7-related protein kinase/Protein DBF4 homolog A

Compound Name
SMILES String
CC[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1ccnc(F)c1 |r|
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1ccnc(Cl)c1 |r|
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)N1CCNCC1 |r|
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1cc[nH]n1 |r|
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1ccnc(C)c1 |r|
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1cc(F)ncc1F |r|
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1cnoc1 |r|
CC[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1ccncc1F |r|
C[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1ccncc1F |r|
N[C@@H](C1CC1)c1nc2cc(sc2c(=O)[nH]1)-c1ccncc1F |r|
CN[C@@H](C(C)C)c1nc2cc(sc2c(=O)[nH]1)-c1ccnc(F)c1 |r|
CC(C)(N)c1nc2cc(sc2c(=O)[nH]1)-c1ccnc(F)c1
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1c[nH]cn1 |r|
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1ccnnc1 |r|
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1ccncn1 |r|
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1cn[nH]n1 |r|
CC(C)[C@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1cc[nH]c1 |r|
CC(C)[C@@H](N)c1nc2cc(sc2c(=O)[nH]1)-c1ccncc1F |r|
CCOC(=O)c1sc(nc1O)-c1ccncc1
CCOC(=O)c1sc(nc1OC)-c1ccncc1
CCOC(=O)c1sc(nc1N)-c1ccncc1
CCOC(=O)c1sc(nc1NC)-c1ccncc1
CCOC(=O)c1sc(nc1NCc1ccccc1)-c1ccncc1
CCOC(=O)c1sc(nc1Nc1ccccc1)-c1ccncc1
CCOC(=O)c1sc(nc1N(C)C)-c1ccncc1
CCOC(=O)c1cnc(s1)-c1ccncc1
CCOC(=O)c1sc(nc1C)-c1ccncc1
CCOC(=O)c1sc(nc1-c1ccccc1)-c1ccncc1
CCOC(=O)c1sc(nc1-c1ccccc1O)-c1ccncc1
CCOC(=O)c1sc(nc1-c1ccccc1Cl)-c1ccncc1
CCOC(=O)c1sc(nc1-c1ccc(F)cc1Cl)-c1ccncc1
CCOC(=O)c1sc(nc1-c1cccc(Cl)c1Cl)-c1ccncc1
CCOC(=O)c1sc(nc1-c1ccc(Cl)cc1Cl)-c1ccncc1
CCOC(=O)c1sc(nc1-c1ccc(OC)cc1Cl)-c1ccncc1
CCOC(=O)c1sc(nc1-c1cccnc1)-c1ccncc1
CCOC(=O)c1sc(nc1-c1ccc2ccccc2c1)-c1ccncc1
Cl.OC(=O)c1sc(nc1O)-c1ccncc1
OC(=O)c1sc(nc1-c1ccccc1)-c1ccncc1
NC(=O)c1sc(nc1O)-c1ccncc1
NC(=O)c1sc(nc1-c1ccccc1)-c1ccncc1
CNC(=O)c1sc(nc1O)-c1ccncc1
Oc1nc(sc1C(=O)NCc1ccccc1)-c1ccncc1
CN(C)C(=O)c1sc(nc1O)-c1ccncc1
NNC(=O)c1sc(nc1-c1ccccc1)-c1ccncc1
ONC(=O)c1sc(nc1-c1ccccc1)-c1ccncc1
N#Cc1sc(nc1-c1ccccc1)-c1ccncc1
c1ccc(cc1)-c1nc(sc1-c1nn[nH]n1)-c1ccncc1
c1nnc(o1)-c1sc(nc1-c1ccccc1)-c1ccncc1
O=C1Nc2ccccc2Nc2nc(sc12)-c1ccncc1
COc1nc(sc1C(N)=O)-c1ccncc1
NC(=O)c1sc(nc1-c1ccc(Cl)cc1Cl)-c1ccncc1
OC(=O)C(F)(F)F.CCOC(=O)c1sc(nc1O)-c1cccnc1
CCOC(=O)c1sc(nc1O)-c1ccccn1
CCOC(=O)c1sc(nc1O)-c1ccnc(CC)c1
CCOC(=O)c1sc(nc1-c1ccccc1)-c1ccnc(N)c1
CCOC(=O)c1sc(nc1O)-c1ccnc(N)n1
CCOC(=O)c1sc(nc1-c1ccccc1)-c1cc(N)ncn1
CCOC(=O)c1sc(nc1O)-c1cnccn1
CCOC(=O)c1sc(nc1O)-c1ccccc1
CCOC(=O)c1sc(nc1O)-c1ccc(OC)cc1
CCOC(=O)c1sc(nc1O)-c1ccsc1
CCOC(=O)c1sc(nc1O)C(C)(C)C
NC(=O)c1sc(nc1-c1ccccc1F)-c1ccnc(N)n1
NC(=O)c1sc(nc1-c1ccccc1C(F)(F)F)-c1ccnc(N)n1
NC(=O)c1sc(nc1-c1cc(F)ccc1F)-c1ccnc(N)n1
NC(=O)c1sc(nc1-c1ccc(Cl)cc1Cl)-c1ccnc(N)n1
NC(=O)c1sc(nc1-c1cc(Cl)cc(Cl)c1)-c1ccnc(N)n1
Cc1ccc(-c2nc(sc2C(N)=O)-c2ccnc(N)n2)c(Cl)c1
COc1ccc(-c2nc(sc2C(N)=O)-c2ccnc(N)n2)c(Cl)c1
CN(C)c1nc(sc1C(N)=O)-c1ccnc(N)n1
CC(C)(C)CNC(=O)CC1CNC(=O)c2cc(cn12)-c1ccsc1
CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2cccc(Cl)c2)C2CCCCC2)CC1 |r|
CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2ncc3CCc4c(nn(CCO)c4-c3n2)C(N)=O)c1
c1c(cc(c2c1CN(C2=O)C3CCN(CC3)C4CCC(CC4)(F)F)C(=O)N)F
Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F
CN1CCN(CC1)c2ccc(c(c2)NC3CCOCC3)C(=O)Nc4c5cc(ccc5[nH]n4)Cc6cc(cc(c6)F)F
O=c1cc(nc(NC2CCCCC2)[nH]1)-c1ccccc1
O=c1cc(nc(NC2CCCCC2)[nH]1)-c1cccnc1
O=c1cc(nc(NC2CCCCC2)[nH]1)-c1ccncc1
Nc1nccc(n1)-c1cc(=O)[nH]c(NC2CCCCC2)n1
O=c1cc(nc(NC2CCCCC2)[nH]1)-c1cn[nH]c1
O=c1cc(nc(NC2CCCCC2)[nH]1)-c1ccc2[nH]ncc2c1
O=c1nc(nc(NC2CCCCC2)[nH]1)-c1c[nH]c2ncccc12
O=c1nc(cc(NC2CCCCC2)[nH]1)-c1c[nH]c2ncccc12
O=c1cc(cc(NC2CCCCC2)[nH]1)-c1c[nH]c2ncccc12
O=c1cc(NC2CCCCC2)cc([nH]1)-c1c[nH]c2ncccc12
Oc1cc(NC2CCCCC2)nc(c1)-c1c[nH]c2ncccc12
CN(C1CCCCC1)c1nc(cc(=O)[nH]1)-c1c[nH]c2ncccc12
O=c1cc(nc(Nc2ccccc2)[nH]1)-c1c[nH]c2ncccc12
COCCN(CCOC)c1nc(cc(=O)[nH]1)-c1c[nH]c2ncccc12
O=c1cc(nc([nH]1)N1CCOCC1)-c1c[nH]c2ncccc12
O=c1cc(nc(NC2CCOCC2)[nH]1)-c1c[nH]c2ncccc12
CN1CCC(CC1)Nc1nc(cc(=O)[nH]1)-c1c[nH]c2ncccc12
O=c1cc(nc([nH]1)-c1ccccc1)-c1c[nH]c2ncccc12
OC1CCN(CC1)c1nc(cc(=O)[nH]1)-c1c[nH]c2ncccc12
COC1CCN(CC1)c1nc(cc(=O)[nH]1)-c1c[nH]c2ncccc12
O=c1cc(nc(NC(c2ccccc2)c2ccccc2)[nH]1)-c1c[nH]c2ncccc12
O=c1cc(nc(NC2CCCCC2)[nH]1)-c1c[nH]c2ncccc12
O=c1cc(nc(NCc2ccccc2)[nH]1)-c1c[nH]c2ncccc12
CCOC(=O)C1=C(Nc2ccccc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:5|
COC(=O)C1=C(Nc2cncnc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2cc[nH]n2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccc3ncccc3c2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(NCc2ccccc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(NCCc2ccccc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
CCOC(=O)C1=C(Nc2ccccc2)S\C(=C/c2c[nH]c3ncccc23)C1=O |c:5|
CCOC(=O)C1=C(Nc2ccccc2)O\C(=C/c2ccc(O)c(C)c2)C1=O |c:5|
CCOC(=O)C1=C(Nc2ccccc2)O\C(=C/c2ccc3OCOc3c2)C1=O |c:5|
COC(=O)C1=C(Nc2ccccc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
NC(=O)C1=C(Nc2ccccc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:3|
CCNC(=O)C1=C(Nc2ccccc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:5|
O=C(N1CCCCC1)C1=C(Nc2ccccc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:9|
COC(=O)C1=C(Nc2ccc(Cl)cc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccccc2OC)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccc(OC)cc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccccc2F)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccc(F)cc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccc(C)cc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccc(F)cc2F)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccccn2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2cccnc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccncc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccccc2Cl)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
CCOC(=O)C1=C(Nc2ccccc2)O\C(=C/c2c[nH]c3ncc(Cl)cc23)C1=O |c:5|
OC(=O)C1=C(Nc2ccccc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:3|
COC(=O)C1=C(Nc2ccc3cn[nH]c3c2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2cccc(Cl)c2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2cccc(OC)c2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccccc2C)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
COC(=O)C1=C(Nc2ccc(C)cc2C)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:4|
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)C(N1CCCC1)c1ccccc1
O=c1[nH]c(CN2CCCC2)nc2cc(sc12)-c1cn[nH]c1
Cc1nc2cc(sc2c(=O)[nH]1)-c1ccncc1
CN(C)Cc1nc2cc(sc2c(=O)[nH]1)-c1c[nH]nc1C
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)-c1ccccc1
Cc1n[nH]cc1-c1cc2nc(CC3CCCC3)[nH]c(=O)c2s1
C[C@H]1CCN(Cc2nc3cc(sc3c(=O)[nH]2)-c2c[nH]nc2C)C1 |r|
Cc1n[nH]cc1-c1cc2nc(CN3CCCCC3)[nH]c(=O)c2s1
CNCc1nc2cc(sc2c(=O)[nH]1)-c1c[nH]nc1C
Cc1n[nH]cc1-c1cc2nc(CN3CCCC3)[nH]c(=O)c2s1
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)C1CCCCC1
O=c1[nH]c(CN2CCCC2)nc2cc(sc12)-c1ccncc1
C[C@@H]1CCN(Cc2nc3cc(sc3c(=O)[nH]2)-c2c[nH]nc2C)C1 |r|
CCc1n[nH]cc1-c1cc2nc(CN3CCCC3)[nH]c(=O)c2s1
CCOCc1nc2cc(sc2c(=O)[nH]1)-c1c[nH]nc1C
Cc1n[nH]cc1-c1cc2nc(Cn3cccc3)[nH]c(=O)c2s1
Cc1n[nH]cc1-c1cc2nc(C)[nH]c(=O)c2s1
Cc1n[nH]cc1-c1cc2nc(CN3CCC[C@@H]3CO)[nH]c(=O)c2s1
CC(N1CCCC1)c1nc2cc(sc2c(=O)[nH]1)-c1c[nH]nc1C
Cc1n[nH]cc1-c1cc2nc(CCN3CCCC3)[nH]c(=O)c2s1
C[C@H]1CCCN1Cc1nc2cc(sc2c(=O)[nH]1)-c1c[nH]nc1C
Cc1n[nH]cc1-c1cc2nc(CN3CC[C@H](F)C3)[nH]c(=O)c2s1 |r|
Cc1n[nH]cc1-c1cc2nc(CN3CCC(C3)c3ccccc3)[nH]c(=O)c2s1
Cc1n[nH]cc1-c1cc2nc(CNCc3ccccc3)[nH]c(=O)c2s1
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)N1CCOCC1
Nc1cc(ccn1)-c1cc2c(s1)C1(CCCCC1)CNC2=O
CC(=O)Nc1cc(ccn1)-c1cc2c(s1)C1(CCCCC1)CNC2=O
CC(=O)Nc1cccc(c1)-c1cc2c(s1)C1(CCCCC1)CNC2=O
CNC(=O)c1cc(ccn1)-c1cc2c(s1)C1(CCCCC1)CNC2=O
O=C1NCC2(CCCCC2)c2sc(cc12)-c1ncnc2nc[nH]c12
O=C1NCC2(CCCCC2)c2sc(cc12)-c1cn[nH]c1
Cn1cc(cn1)-c1cc2c(s1)C1(CCCCC1)CNC2=O
O=C1NCC2(CCCCC2)c2sc(cc12)-c1cc[nH]n1
O=C1NCCc2sc(cc12)-c1ccncc1
O=C1CCC2(CCCCC2)c2sc(cc12)-c1ccncc1
Nc1cc(ccn1)-c1cc2c(s1)C1(CCCCC1)CCC2=O
O=C1CCC2(CCCCC2)c2sc(cc12)-c1cn[nH]c1
Clc1cc2c(s1)C1(CCCCC1)CNC2=O
O=C1NCC2(CCCCC2)c2sc(cc12)-c1cccnc1
Fc1cnc2[nH]cc(-c3nnc(N[C@H](C4CC4)c4cccnc4F)o3)c2c1 |r|
Fc1ccc2c(c[nH]c2n1)-c1nnc(N[C@H](C2CC2)c2cccnc2F)o1 |r|
Fc1ccccc1[C@H](Nc1nnc(o1)-c1c[nH]c2ncncc12)C1CC1 |r|
Fc1cnccc1[C@H](Nc1nnc(o1)-c1c[nH]c2ncccc12)C1CC1 |r|
Fc1ncccc1[C@H](Nc1nnc(o1)-c1c[nH]c2ncccc12)C1CC1 |r|
Fc1ccccc1[C@H](Nc1nnc(o1)-c1c[nH]c2ncccc12)C1CC1 |r|
C1CC1[C@@H](Nc1nnc(o1)-c1c[nH]c2ncccc12)c1ccccc1 |r|
CC(C)[C@@H](Nc1nnc(o1)-c1c[nH]c2ncccc12)c1ccccc1 |r|
CC[C@@H](Nc1nnc(o1)-c1c[nH]c2ncccc12)c1ccccc1 |r|
CC(C)(Nc1nnc(o1)-c1c[nH]c2ncccc12)c1ccccc1
C[C@@H](Nc1nnc(o1)-c1c[nH]c2ncccc12)c1ccccc1 |r|
C[C@H](Nc1nnc(o1)-c1c[nH]c2ncccc12)c1ccccc1 |r|
C(Nc1nnc(o1)-c1c[nH]c2ncccc12)c1ccncc1
C(Nc1nnc(o1)-c1c[nH]c2ncccc12)c1cccnc1
C(Nc1nnc(o1)-c1c[nH]c2ncccc12)c1ccccn1
Fc1ccc(CNc2nnc(o2)-c2c[nH]c3ncccc23)cc1
Fc1cccc(CNc2nnc(o2)-c2c[nH]c3ncccc23)c1
Fc1ccccc1CNc1nnc(o1)-c1c[nH]c2ncccc12
C(Nc1nnc(o1)-c1c[nH]c2ncccc12)c1ccccc1
O=C1Cc2cc(ccc2N1)-c1nnc(NCc2ccccc2)o1
O=c1[nH]c2ccc(cc2o1)-c1nnc(NCc2ccccc2)o1
Nc1n[nH]c2ccc(cc12)-c1nnc(NCc2ccccc2)o1
C(Nc1nnc(o1)-c1ccc2[nH]ncc2c1)c1ccccc1
C(Nc1nnc(o1)-c1nc2ccncc2s1)c1ccccc1
Fc1cc2cc(ccc2cn1)-c1nnc(NCc2ccccc2)o1
C(Nc1nnc(o1)-c1ccc2cnccc2c1)c1ccccc1
CC1(C)Nc2cc(sc2C(=O)N1Cc1ccccc1)-c1ccncc1
O=C1NC2(CCCC2)Nc2cc(sc12)-c1ccncc1
Cc1n[nH]cc1-c1cc2N[C@]3(CC[C@@](O)(CC3)c3ccc(F)cc3)NC(=O)c2s1 |r,wU:10.11,wD:13.14,(20.26,-53.26,;19.79,-51.8,;18.32,-51.32,;18.32,-49.78,;19.79,-49.31,;20.69,-50.55,;22.23,-50.54,;23.14,-51.8,;24.62,-51.32,;25.95,-52.08,;27.27,-51.32,;27.26,-52.86,;28.58,-53.63,;29.92,-52.87,;30.69,-54.2,;29.93,-51.33,;28.6,-50.55,;31.46,-52.87,;32.23,-54.2,;33.77,-54.21,;34.54,-52.87,;36.08,-52.87,;33.76,-51.53,;32.22,-51.54,;27.28,-49.78,;25.95,-49,;25.95,-47.46,;24.62,-49.77,;23.14,-49.29,)|
CN1c2cc(sc2C(=O)NC1(C)CC(F)(F)F)-c1c[nH]nc1C
CN1c2c(Br)c(sc2C(=O)NC1(C)C)-c1cn[nH]c1
CN1c2c(C)c(sc2C(=O)NC1(C)C)-c1cn[nH]c1
Cc1n[nH]cc1-c1cc2N[C@]3(CC[C@](O)(CC3)C3CCCCC3)NC(=O)c2s1 |r,wU:10.11,wD:13.18,(72.5,-50.69,;72.02,-49.23,;70.56,-48.75,;70.56,-47.21,;72.02,-46.74,;72.93,-47.98,;74.47,-47.98,;75.38,-49.23,;76.85,-48.75,;78.18,-49.51,;79.5,-48.75,;79.5,-50.29,;80.82,-51.06,;82.16,-50.3,;83.7,-50.3,;82.16,-48.76,;80.83,-47.98,;82.93,-51.63,;82.15,-52.96,;82.92,-54.29,;84.46,-54.3,;85.23,-52.97,;84.47,-51.62,;79.51,-47.21,;78.18,-46.43,;78.18,-44.89,;76.85,-47.2,;75.38,-46.72,)|
Cc1n[nH]cc1-c1cc2N[C@]3(CC[C@@](O)(CC3)C3CCCCC3)NC(=O)c2s1 |r,wU:10.11,wD:13.14,(58.03,-53.56,;57.56,-52.1,;56.09,-51.62,;56.09,-50.08,;57.56,-49.61,;58.46,-50.85,;60,-50.85,;60.91,-52.1,;62.38,-51.62,;63.71,-52.38,;65.04,-51.62,;65.03,-53.16,;66.35,-53.93,;67.69,-53.17,;68.46,-54.5,;67.7,-51.63,;66.37,-50.85,;69.23,-53.17,;70,-54.51,;71.53,-54.51,;72.31,-53.18,;71.54,-51.84,;69.99,-51.83,;65.04,-50.08,;63.71,-49.3,;63.72,-47.76,;62.38,-50.07,;60.91,-49.59,)|
Cc1n[nH]cc1-c1cc2N[C@]3(CC[C@](O)(CC3)c3ccc(F)cc3)NC(=O)c2s1 |r,wU:10.11,wD:13.18,(40.37,-51.96,;39.89,-50.5,;38.42,-50.02,;38.42,-48.48,;39.89,-48.01,;40.79,-49.25,;42.33,-49.24,;43.25,-50.5,;44.72,-50.02,;46.04,-50.78,;47.37,-50.02,;47.36,-51.56,;48.68,-52.33,;50.02,-51.57,;51.56,-51.57,;50.03,-50.03,;48.7,-49.25,;50.79,-52.9,;50.02,-54.23,;50.79,-55.57,;52.33,-55.57,;53.1,-56.89,;53.1,-54.22,;52.33,-52.9,;47.37,-48.48,;46.04,-47.7,;46.05,-46.16,;44.72,-48.47,;43.25,-48,)|
Cc1n[nH]cc1-c1cc2NC3(CCCCC3)NC(=O)c2s1
CCc1n[nH]cc1-c1cc2N(C)C(C)(C)NC(=O)c2s1
CN1c2cc(sc2C(=O)NC1(C)C)-c1c(C)n[nH]c1C
CN1c2cc(sc2C(=O)NC1(C)C)-c1c[nH]nc1C
CN1c2cc(sc2C(=O)NC1(C)C)-c1cn[nH]c1
CN1C(=O)c2sc(cc2NC1(C)C)-c1ccncc1
O=C1NC2(CCCCCC2)Nc2cc(sc12)-c1ccncc1
O=C1NC2(CCCCC2)Nc2cc(sc12)-c1ccncc1
CC1(CC(F)(F)F)Nc2cc(sc2C(=O)N1)-c1ccncc1
CC(C)C1(C)Nc2cc(sc2C(=O)N1)-c1ccncc1
CCCC1(C)Nc2cc(sc2C(=O)N1)-c1ccncc1
CCC1(C)Nc2cc(sc2C(=O)N1)-c1ccncc1
CN1c2cc(sc2C(=O)NC1(C)C)-c1ccncc1
CC1(C)Nc2cc(sc2C(=O)N1)-c1ccncc1
CC1(C)Nc2sc(cc2C(=O)N1)-c1ccncc1
NC(=O)c1sc(cc1N)-c1ccncc1
O=c1[nH]c2cc(sc2c(=O)[nH]1)-c1ccncc1
OC(=O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@H]1CCCCN1
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)C12CC(C1)CN2
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@@H]1CCN1 |r|
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@@H]1CCCCN1
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@@H]1CC=CCN1
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@@H]1CCCCCN1 |r|
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@]1(C)CCCN1
C[C@H]1CCN[C@@H]1c1nc2cc(sc2c(=O)[nH]1)-c1c[nH]nc1C
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@@H]1CCC(C)(C)N1 |r|
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)C12CCC(CC1)N2
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@@H]1CC2CCN1CC2 |wD:16.18,(23.9,-5.5,;23.5,-6.99,;22.05,-7.46,;22.05,-9,;23.5,-9.47,;24.42,-8.23,;25.96,-8.23,;26.79,-6.94,;28.26,-7.33,;29.55,-6.49,;30.92,-7.17,;31.02,-8.7,;29.74,-9.56,;29.74,-11.1,;28.36,-8.87,;26.92,-9.42,;32.26,-6.4,;32.26,-4.86,;33.59,-4.09,;34.93,-4.86,;34.93,-6.4,;33.59,-7.17,;33.99,-5.69,;33.19,-5.58,)|
FC(F)(F)c1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@@H]1CCCCN1
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@@H]1CCCN1
CN1CCC[C@H]1c1nc2cc(sc2c(=O)[nH]1)-c1c[nH]nc1C
C[C@@H]1CN[C@@H](C1)c1nc2cc(sc2c(=O)[nH]1)-c1c[nH]nc1C
Cc1n[nH]cc1-c1cc2nc([nH]c(=O)c2s1)[C@H]1CC2CCN1CC2 |r,wU:16.18,(31.13,-24.46,;30.64,-23,;29.17,-22.53,;29.17,-20.98,;30.63,-20.5,;31.55,-21.74,;33.09,-21.72,;34,-22.97,;35.46,-22.48,;36.8,-23.25,;38.13,-22.48,;38.13,-20.94,;36.8,-20.16,;36.8,-18.62,;35.45,-20.94,;33.98,-20.47,;39.45,-23.25,;40.78,-22.49,;42.11,-23.26,;42.11,-24.8,;40.77,-25.56,;39.45,-24.79,;40.95,-24.54,;40.79,-23.43,)|
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
Brc1ccc(cc1)C(=O)CSc1ncnc2[nH]cnc12
Clc1ccc(cc1)C(=O)CSc1[nH]cnc2ncnc12
[O-][N+](=O)c1ccc(cc1)C(=O)CSc1[nH]cnc2ncnc12
Brc1ccc(CSc2[nH]cnc3ncnc23)cc1
Clc1ccc(CSc2[nH]cnc3ncnc23)cc1
[O-][N+](=O)c1ccc(CSc2ncnc3[nH]cnc23)cc1
C(Sc1ncnc2[nH]cnc12)c1ccccc1
Ic1ccc(CSc2ncnc3[nH]cnc23)cc1
FC(F)(F)c1ccc(CSc2ncnc3[nH]cnc23)cc1
N#Cc1ccc(CSc2ncnc3[nH]cnc23)cc1
CSc1ccc(CSc2ncnc3[nH]cnc23)cc1
CC(=O)Nc1ccc(CSc2ncnc3[nH]cnc23)cc1
OCc1ccc(CSc2ncnc3[nH]cnc23)cc1
Brc1cccc(CSc2ncnc3[nH]cnc23)c1
Clc1cccc(CSc2ncnc3[nH]cnc23)c1
[O-][N+](=O)c1cccc(CSc2ncnc3[nH]cnc23)c1
Ic1cccc(CSc2ncnc3[nH]cnc23)c1
FC(F)(F)c1cccc(CSc2ncnc3[nH]cnc23)c1
N#Cc1cccc(CSc2ncnc3[nH]cnc23)c1
COc1cccc(CSc2ncnc3[nH]cnc23)c1
c1cc(cc(c1)F)CSc2c3c([nH]cn3)ncn2
Brc1ccccc1CSc1ncnc2[nH]cnc12
Clc1ccccc1CSc1ncnc2[nH]cnc12
Ic1ccccc1CSc1ncnc2[nH]cnc12
FC(F)(F)c1ccccc1CSc1ncnc2[nH]cnc12
Clc1ccc(CCSc2ncnc3[nH]cnc23)cc1
Fc1ccc(CCSc2ncnc3[nH]cnc23)cc1
Clc1cccc(CCSc2ncnc3[nH]cnc23)c1
Clc1ccccc1CCSc1ncnc2[nH]cnc12
Brc1ccc(Sc2ncnc3[nH]cnc23)cc1
COc1ccc(Sc2ncnc3[nH]cnc23)cc1
Clc1cccc(CNc2ncnc3[nH]cnc23)c1
Clc1cccc(COc2ncnc3[nH]cnc23)c1
C(Oc1[nH]cnc2ncnc12)c1ccccc1
Brc1ccc(COc2ncnc3[nH]cnc23)cc1
C(Sc1ncnc2[nH]ccc12)c1ccccc1
Brc1cccc(CSc2ncnc3[nH]ccc23)c1