5883 SMILES Strings for Adenosine receptor A2b

Compound Name
SMILES String
Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1ccccn1
Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1cccc(C)n1
Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1cccn1C
Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1ccc[nH]1
Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1ncc[nH]1
CCn1ccnc1CNC(=O)c1cc(nc(N)n1)-c1ccc(C)o1
CC(C)n1ccnc1CNC(=O)c1cc(nc(N)n1)-c1ccc(C)o1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCCN)ncnc12 |r|
[#6]-[#6]-[#7]-[#6](=O)-[#6@H]-1-[#8]-[#6@H](-[#6@H](-[#8])-[#6@@H]-1-[#8])-n1cnc2c(\[#7]=[#6](/[#7])-[#7])ncnc12
NNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
NCCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
NCCCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
NCCCCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
NCCCCCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NCCO |r|
Cc1ccccc1CNc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NN |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccccc3C)ncnc12 |r|
Cc1ccccc1CNc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NCCN |r|
Cc1ccccc1CNc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NCCO |r|
CNc1nc(N)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CNc1nc(CN)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
CNc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(N)=N |r|
Nc1nc(Cl)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
c1cc(oc1)c2nc3c4cc(ccc4nc(n3n2)N)Cl
Nc1nc2n(CCc3ccccc3)ncc2c2nc(nn12)-c1ccco1
Nc1nc(NCCc2ccc(O)cc2)nc2nc(nn12)-c1ccco1
Nc1nc(Cl)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@H](O)C1O
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)nc(Cl)nc12 |r|
CCNC(=O)C(=O)Nc1nc(Nc2ccccc2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(C=CC(O)=O)cc1 |w:21.22|
CCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2nc(nc3N)NCCc4ccc(cc4)CCC(=O)O)O)O
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)ncnc12
CCCn1c2nc[nH]c2c(=O)n(CCC)c1=O
CCn1c2nc([nH]c2c(=O)n(CC)c1=O)-c1ccccc1
CCCN1c2c([nH]cn2)C(=O)NC1=O
CCCn1c(=O)n(Cc2ccc(N)c(I)c2)c2nc([nH]c2c1=O)-c1ccc(OCC(O)=O)cc1
Nc1ccc(CCNc2nc(N)c3ncn(C4OC(CO)C(O)C4O)c3n2)cc1I
CNC(=O)C1OC(C(O)C1O)n1cnc2c(NCc3cccc(I)c3)ncnc12
CC(Cc1ccccc1)Nc1ncnc2n(cnc12)C1OC(CO)C(O)C1O
CC(C)(Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccccc1
Cn1c2nc[nH]c2c(=O)n(C)c1=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NCCN)cc1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(OC)cc1)n1nc(nc21)-c1ccco1
CNCC[C@@H](c1cccs1)Oc2cccc3c2cccc3
COc1ccc(cc1)C(CN(C)C)C1(O)CCCCC1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C1CCCC1
CNCCC(Oc1ccccc1C)c1ccccc1
CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1
COC(=O)COc1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COC(=O)COc1cccc(c1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COC(=O)COc1ccc(cc1OC)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COC(=O)COc1cc(ccc1OC)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
CN(C)CCNC(=O)COc1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCN(CC)CCNC(=O)COc1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCCC2)cc1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCCCC2)cc1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCCCCC2)cc1
CN1C2N=C(NC2C(=O)N(C)C1=O)c1ccc(OCC(=O)N2CCOCC2)cc1 |c:3|
CN1CCN(CC1)C(=O)COc1ccc(cc1)C1=NC2C(N1)C(=O)N(C)C(=O)N2C |t:19|
CN1C2N=C(NC2C(=O)N(C)C1=O)c1ccc(OCC(=O)n2ccnc2)cc1 |c:3|
COc1ccc(CCNC(=O)COc2ccc(cc2)C2=NC3C(N2)C(=O)N(C)C(=O)N3C)cc1OC |t:20|
CN(C)CCNC(=O)COc1cccc(c1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCN(CC)CCNC(=O)COc1cccc(c1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1cccc(OCC(=O)N2CCCC2)c1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1cccc(OCC(=O)N2CCCCC2)c1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1cccc(OCC(=O)N2CCCCCC2)c1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1cccc(OCC(=O)N2CCOCC2)c1
CN1CCN(CC1)C(=O)COc1cccc(c1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1cccc(OCC(=O)n2ccnc2)c1
COc1ccc(CCNC(=O)COc2cccc(c2)-c2nc3n(C)c(=O)n(C)c(=O)c3[nH]2)cc1OC
COc1cc(ccc1OCC(=O)NCCN(C)C)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCN(CC)CCNC(=O)COc1ccc(cc1OC)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1cc(ccc1OCC(=O)N1CCCC1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1cc(ccc1OCC(=O)N1CCCCC1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1cc(ccc1OCC(=O)N1CCCCCC1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1cc(ccc1OCC(=O)N1CCOCC1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1cc(ccc1OCC(=O)N1CCN(C)CC1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1cc(ccc1OCC(=O)n1ccnc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1ccc(CCNC(=O)COc2ccc(cc2OC)-c2nc3n(C)c(=O)n(C)c(=O)c3[nH]2)cc1OC
COc1ccc(cc1OCC(=O)NCCN(C)C)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCN(CC)CCNC(=O)COc1cc(ccc1OC)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1ccc(cc1OCC(=O)N1CCCC1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1ccc(cc1OCC(=O)N1CCCCC1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1ccc(cc1OCC(=O)N1CCCCCC1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1ccc(cc1OCC(=O)N1CCOCC1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1ccc(cc1OCC(=O)N1CCN(C)CC1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1ccc(cc1OCC(=O)N1CCN=C1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1 |c:16|
COc1ccc(CCNC(=O)COc2cc(ccc2OC)-c2nc3n(C)c(=O)n(C)c(=O)c3[nH]2)cc1OC
CNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1
CN(C)c1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1
CCNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1
Nc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1
C=Cc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1
CCc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1
O=C(c1cccs1)c1nc(NCc2cccnc2)nc2cc(NCc3cccnc3)sc12
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(F)cc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(OC)cc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(F)c(F)c3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc4OCCOc4c3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(OCC(C)(C)O)cc3)c2C#N)ccn1
Nc1nc(SCc2ccnc(c2)C(=O)NC2CC2)c(C#N)c(-c2ccccc2)c1C#N
Nc1nc(SCc2cccc(c2)C(O)=O)c(C#N)c(-c2ccc(F)cc2)c1C#N
OC(=O)c1cccc(CSc2ncc(C#N)c(-c3ccccc3)c2C#N)c1
CNC(=O)c1cc(COc2nc(N)c(C#N)c(-c3ccc(F)cc3)c2C#N)ccn1
CCOc1ccc(cc1)-c1c(C#N)c(N)nc(SCc2ccnc(c2)C(=O)NC)c1C#N
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(F)c(OC)c3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(NC)cc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3cccc(OCCO)c3)c2C#N)ccn1
CNC(=O)c1cc(CSc2ncc(C#N)c(-c3ccc(OCCO)cc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2ncc(C#N)c(-c3ccc(OC)cc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2ncc(C#N)c(-c3ccccc3)c2C#N)ccn1
NC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3ccccc3)c2C#N)c1
CS(=O)(=O)Nc1cccc(CSc2nc(N)c(C#N)c(-c3ccc(F)cc3)c2C#N)c1
CS(=O)(=O)Nc1cccc(CSc2nc(N)c(C#N)c(-c3ccc(F)c(F)c3)c2C#N)c1
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(OC)cc3OC)c2C#N)ccn1 |(7.34,-5.39,;7.34,-3.85,;6,-3.08,;6,-1.54,;4.67,-3.85,;3.33,-3.08,;2,-3.85,;.67,-3.08,;-.67,-3.85,;-2,-3.08,;-3.33,-3.85,;-4.67,-3.08,;-6,-3.85,;-4.67,-1.54,;-6,-.77,;-7.34,,;-3.33,-.77,;-3.33,.77,;-4.67,1.54,;-4.67,3.08,;-3.33,3.85,;-3.33,5.39,;-2,6.16,;-2,3.08,;-2,1.54,;-.67,.77,;.67,1.54,;-2,-1.54,;-.67,-.77,;.67,,;2,-5.39,;3.33,-6.16,;4.67,-5.39,)|
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(OS(=O)(=O)N(C)C)cc3)c2C#N)ccn1
CCCOc1cccc(c1)-c1c(C#N)c(N)nc(SCc2ccnc(c2)C(=O)NC)c1C#N
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(F)c(c3)C(F)(F)F)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3cc(F)cc(F)c3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(OCCN)cc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N)c(C#N)c(-c3ccc(OCCNC(=O)[C@H](C)N)cc3)c2C#N)ccn1 |r|
CNC(=O)c1cc(ccn1)C(C)Sc1nc(N)c(C#N)c(-c2ccc(OCC(F)(F)F)cc2)c1C#N |w:10.11|
CC(Sc1nc(N)c(C#N)c(-c2ccc(OCCO)cc2)c1C#N)c1cccc(c1)C(N)=O |w:1.0|
CNC(=O)c1cccc(c1)C(C)Sc1nc(N)c(C#N)c(-c2ccc(OCCO)cc2)c1C#N |w:10.11|
NC(=O)c1cccc(CSc2ncc(C#N)c(-c3ccccc3)c2C#N)c1
OCCNC(=O)c1cccc(CSc2ncc(C#N)c(-c3ccccc3)c2C#N)c1
Nc1nc(OCc2ccnc(c2)C(=O)NC2CC2)c(C#N)c(-c2ccccc2)c1C#N
CNC(=O)c1cc(CSc2nc(N3CC(O)C3)c(C#N)c(-c3ccccc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N3CC(O)C3)c(C#N)c(-c3ccc(OC)cc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N3CC(O)C3)c(C#N)c(-c3ccc(F)c(F)c3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N(C)CCO)c(C#N)c(-c3ccccc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(NCCO)c(C#N)c(-c3ccc(OCCO)nc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(N3CC[C@@H](O)C3)c(C#N)c(-c3ccc4OCCOc4c3)c2C#N)ccn1 |r|
CNC(=O)c1cc(CSc2nc(NC[C@H](O)CO)c(C#N)c(-c3ccccc3)c2C#N)ccn1 |r|
CNC(=O)c1cc(CSc2nc(NCCO)c(C#N)c(-c3ccc(OC)cc3)c2C#N)ccn1
O=C(NC1CC1)c1cc(CSc2nc(N3CCCC3)c(C#N)c(-c3ccccc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(NCC(O)C(F)(F)F)c(C#N)c(-c3ccccc3)c2C#N)ccn1
CNC(=O)c1cc(CSc2nc(NCCO)c(C#N)c(-c3ccccn3)c2C#N)ccn1
CNC(=O)c1cc(COc2nc(N3CC(O)C3)c(C#N)c(-c3ccccc3)c2C#N)ccn1
CNC(=O)c1cccc(CSc2nc(N3CC[C@@H](O)C3)c(C#N)c(-c3ccc(OCCO)cc3)c2C#N)c1 |r|
Nc1nc(SCc2cccc(c2)C(=O)NC[C@@H](O)CO)c(C#N)c(-c2ccc(F)cc2)c1C#N |r|
CCNC(=O)c1cccc(CSc2nc(N3CCCC3)c(C#N)c(-c3ccc(OCCO)cc3)c2C#N)c1
NC(=O)c1cccc(CSc2nc(NC[C@@H](O)CO)c(C#N)c(-c3ccccc3)c2C#N)c1 |r|
NCCNC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3ccccc3)c2C#N)c1
Cc1ncnc2ccc(-c3sc(NC(=O)N4CC[C@](C)(C#N)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC5(CC4)COCCN5)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCNCC4CC4CC4)nc3-c3cccc(C#N)c3)cc12
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)cc2[nH]ncc12
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)cc2[nH]nnc12
N#Cc1cccc(-c2nc(NC(=O)N3CC4(COC4)C3)sc2-c2ccnc3[nH]ccc23)c1
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)c2cn[nH]c2n1
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC(N5CCNCC5)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC5(CC4)CNCCO5)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC5(CNCCO5)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC5(CNCCO5)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC5(CNCCO5)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC5(CNCCO5)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CC[C@H](C(C)(C)O)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC(C)(C#N)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CC[C@@H](C(C)(C)O)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CC[C@@](C)(C#N)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCN(C(C)(C)C#N)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CC5CN(C)CC54)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CC5(CN(C)C5)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCN(C(C)C#N)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC(N(C)C)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCOC(C(C)(C)O)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCO[C@@H](C(C)(C)O)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCO[C@@H](C(C)(C)O)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCOC(CN(C)C)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC(OCCN5CCCC5)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC5(CC4)CN(C)CCO5)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CC5CCCN(C)C5C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC(N5CCN(C)CC5)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCN(C5CCN(C)CC5)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC(N5CCOCC5)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCN(CC#N)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCN[C@H](C(C)(C)O)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC5(CC4)CNC(=O)C5)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCCNCC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CC5(CCO5)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4C[C@@H]5OCCN(C)[C@@H]5C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCNCC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCN(C)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC5(CCC(=O)N5)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CC5(C4)CC(C)(O)C5)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC(C)(C#N)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCC5(CC4)CN(C)C(=O)O5)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCN(CCO)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CCN(C5COC5)CC4)nc3-c3cccc(C#N)c3)cc12
Cc1ncnc2ccc(-c3sc(NC(=O)N4CC5(COC5)C4)nc3-c3cccc(C#N)c3)cc12
Cc1ncc2cc(-c3sc(NC(=O)N4CC5(COC5)C4)nc3-c3cccc(C#N)c3)ccc2n1
Cc1nc(C)c2cc(-c3sc(NC(=O)N4CC5(COC5)C4)nc3-c3cccc(C#N)c3)ccc2n1
N#Cc1cccc(-c2nc(NC(=O)N3CC4(COC4)C3)sc2-c2ccc3ncncc3c2)c1
Cc5ccnc6ccc(c3sc(NC(=O)N2CC1(COC1)C2)nc3c4cccc(C#N)c4)cc56
COc5ncnc6ccc(c3sc(NC(=O)N2CC1(COC1)C2)nc3c4cccc(C#N)c4)cc56
CCc1ncnc2ccc(-c3sc(NC(=O)N4CC5(COC5)C4)nc3-c3cccc(C#N)c3)cc12
Cc1nc(C)c(-c2sc(NC(=O)N3CCC(C)(C#N)CC3)nc2-c2cccc(C#N)c2)o1
Cc1nc(C)c(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)o1
Cn6cc(c3sc(NC(=O)N2CC1(COC1)C2)nc3c4cccc(C#N)c4)c5cccnc56
N#Cc1cccc(-c2nc(NC(=O)N3CC4(COC4)C3)sc2-c2c[nH]c3ncccc23)c1
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)cn2c(C)cnc12
Cc1cc(-c2sc(NC(=O)N3CCC(C)(C#N)CC3)nc2-c2cccc(C#N)c2)c2[nH]ncc2n1
Cc1ncnc2c(C)cc(-c3sc(NC(=O)N4CC5(COC5)C4)nc3-c3cccc(C#N)c3)cc12
Cn1ccc2c(-c3sc(NC(=O)N4CC5(COC5)C4)nc3-c3cccc(C#N)c3)ccnc21
Cc1cnc2ccc(-c3sc(NC(=O)N4CC5(COC5)C4)nc3-c3cccc(C#N)c3)cn12
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)c2[nH]ncc2n1
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)c2ccn(C)c2n1
Cn1cnc2ccc(-c3sc(NC(=O)N4CC5(COC5)C4)nc3-c3cccc(C#N)c3)cc21
N#Cc1cccc(-c2nc(NC(=O)N3CC4(COC4)C3)sc2-c2ccc3nccn3c2)c1
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)cc2cn[nH]c12
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)cc2cn(C)nc12
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)cn2ccnc12
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)cc2cnn(C)c12
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)cnn1
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)cnc1-n1nccn1
N#Cc1cccc(-c2nc(NC(=O)N3CCOCC3)sc2-c2ccn3nccc3c2)c1
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(C#N)c2)c2cc[nH]c2n1
N#Cc1cccc(-c2nc(NC(=O)N3CC4(COC4)C3)sc2-c2ccc3ncoc3c2)c1
Fc1cnccc1-c1nnc(Nc2cccnc2)nc1-c1cccnc1
Fc1cccc(Nc2nnc(-c3ccncc3F)c(-c3cccnc3)n2)c1
Fc1cnccc1-c1nnc(Nc2nccs2)nc1-c1cccnc1
Fc1cnccc1-c1nnc(Nc2nc(Cl)cs2)nc1-c1cccnc1
Cc1nsc(Nc2nnc(-c3ccncc3F)c(-c3cccnc3)n2)n1
Cc1nnc(Nc2nnc(-c3ccncc3F)c(-c3cccnc3)n2)s1
CNC(=O)Nc1nnc(-c2ccncc2F)c(-c2cccnc2)n1
Fc1ccccc1-c1nc(Nc2cccnc2)nnc1-c1ccnc(C(F)(F)F)c1
Fc1cccc(Nc2nnc(-c3ccnc(C(F)(F)F)c3)c(-c3ccccc3F)n2)c1
Fc1ccccc1-c1nc(Nc2nc(Cl)cs2)nnc1-c1ccnc(C(F)(F)F)c1
Cc1nsc(Nc2nnc(-c3ccnc(C(F)(F)F)c3)c(-c3ccccc3F)n2)n1
Fc1cccc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)c1
Cc1nsc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)n1
Cc1cc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)[nH]n1
Cc1n[nH]c(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)n1
CNC(=O)Nc1nnc(-c2ccncc2F)c(-c2ccccc2F)n1
Cc1cnc(-c2nc(Nc3cccc(F)c3)nnc2-c2ccncc2F)o1
CCc1n[nH]c(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)n1
Cc1ccc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cn1
OCc1ccc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cn1
COc1ccc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cn1
Fc1cnccc1-c1nnc(Nc2ccc(C(F)(F)F)nc2)nc1-c1ccccc1F
COc1ccc(NC(=O)Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cc1
Fc1cnccc1-c1nnc(Nc2nc(C3CC3)n[nH]2)nc1-c1ccccc1F
O=C(Nc1nnc(-c2ccncc2F)c(-c2ccccc2F)n1)NC1CC1
Fc1cnccc1-c1nnc(Nc2ccc(OCC(F)F)nc2)nc1-c1ccccc1F
OCc1ccc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cc1F
CC(C)(O)c1ccc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cn1
OCc1ncc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cn1
CC(O)c1ccc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cn1
Fc1cnccc1-c1nnc(Nc2ccc(C3CC3)nc2)nc1-c1ccccc1F
CC(C)(C)c1n[nH]c(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)n1
Nc1ccc(-c2ccnc(F)c2)c(n1)-c1ccncc1
Nc1cc(Cl)c(-c2ccncc2)c(n1)-c1cccnc1
Nc1cc(Br)c(-c2ccncc2)c(n1)-c1cccnc1
Nc1cc(Cl)c(-c2ccnc(F)c2)c(n1)-c1cccnc1
Nc1cc(Br)c(-c2ccnc(F)c2)c(n1)-c1cccnc1
Nc1cc(Cl)c(-c2ccnc(F)c2)c(n1)-c1cncc(F)c1
Nc1cc(Cl)c(-c2ccnc(F)c2)c(n1)-c1ccncc1
Nc1cc(Br)c(-c2ccnc(F)c2)c(n1)-c1ccncc1
COc1ccc(cn1)-c1nc(N)cc(Cl)c1-c1ccnc(F)c1
CCn1c(=O)n(CCOC)c2sc(CN3CCNC3=O)c(C)c2c1=O
CCn1c(=O)n(CC2CCO2)c2sc(CN3CCNC3=O)c(C)c2c1=O
COCCn1c2sc(CN3CCNC3=O)c(C)c2c(=O)n(C(C)C)c1=O
CCn1c(=O)n(CCOC)c2sc(Cn3cc[nH]c3=O)c(C)c2c1=O
CCn1c(=O)n(CCC(F)(F)F)c2sc(Cn3nc[nH]c3=O)c(C)c2c1=O
CCn1c(=O)n(CCC(F)(F)F)c2sc(Cn3cn[nH]c3=O)c(C)c2c1=O
COC(=O)C1CCN(CC1)c1ccc(cn1)C(=O)Nc1nc(c(s1)C#N)-c1ccccc1
COc1cccc(c1)-c1nc(NC(=O)c2ccc(nc2)N2CCC(CC2)C(O)=O)sc1C#N
COc1ccc(cc1)-c1nc(NC(=O)c2ccc(nc2)N2CCC(CC2)C(O)=O)sc1C#N
OC(=O)C1CCN(CC1)c1ccc(cn1)C(=O)Nc1nc(c(s1)C#N)-c1ccccc1F
OC(=O)C1CCN(CC1)c1ccc(cn1)C(=O)Nc1nc(c(s1)C#N)-c1cccc(F)c1
OC(=O)C1CCN(CC1)c1ccc(cn1)C(=O)Nc1nc(-c2cccs2)c(s1)C#N
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
CN(C)c1cc(ccn1)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ccc(F)cc1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3OC(F)F)nc12)-c1ccc(F)cc1
CCn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
CC(C)n1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
Cc1cc(ccn1)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
Nc1nc(-c2ccc(F)cc2)c(-c2ccnc(Cl)c2)c2nc(Cc3ncccc3F)nn12
Nc1nc(-c2ccc(F)cc2)c(-c2ccnc(c2)C(F)(F)F)c2nc(Cc3c(F)cccc3F)nn12
Nc1nc(-c2ccc(F)cc2)c(-c2ccnnc2)c2nc(Cc3c(F)cccc3F)nn12
Cc1cc(ccn1)-c1c(nc(N)n2nc(Cc3cscn3)nc12)-c1ccc(F)cc1
Cc1cc(ccn1)-c1c(nc(N)n2nc(Cc3cccc(Cl)c3)nc12)-c1ccc(F)cc1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ccc(F)cc1
Cc1cc(ccn1)-c1c(nc(N)n2nc(Cc3nccs3)nc12)-c1ccc(F)cc1
CC(c1nc2c(-c3ccnc(C)c3)c(nc(N)n2n1)-c1ccc(F)cc1)c1c(F)cccc1F
Cc1cc(c(C)cn1)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ccc(F)cc1 |(-3.49,4.62,;-2.16,3.85,;-2.16,2.31,;-.83,1.54,;.51,2.31,;1.84,1.54,;.51,3.85,;-.83,4.62,;-.83,,;-2.16,-.77,;-2.16,-2.31,;-.83,-3.08,;-.83,-4.62,;.51,-2.31,;1.97,-2.79,;2.88,-1.54,;4.42,-1.54,;5.19,-.21,;4.42,1.13,;2.88,1.13,;5.19,2.46,;6.73,2.46,;7.5,1.13,;6.73,-.21,;7.5,-1.54,;1.97,-.29,;.51,-.77,;-3.49,,;-4.83,-.77,;-6.16,,;-6.16,1.54,;-7.5,2.31,;-4.83,2.31,;-3.49,1.54,)|
Cc1cc(cc(C)n1)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
Cc1cc(ccn1)-c1c(nc(N)n2nc(Cc3cccc(Cl)n3)nc12)-c1ccc(F)cc1
Cc1nccc(c1C)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ccc(F)cc1 |(1.84,4.62,;.51,3.85,;-.83,4.62,;-2.16,3.85,;-2.16,2.31,;-.83,1.54,;.51,2.31,;1.84,1.54,;-.83,,;-2.16,-.77,;-2.16,-2.31,;-.83,-3.08,;-.83,-4.62,;.51,-2.31,;1.97,-2.79,;2.88,-1.54,;4.42,-1.54,;5.19,-.21,;4.42,1.13,;2.88,1.13,;5.19,2.46,;6.73,2.46,;7.5,1.13,;6.73,-.21,;7.5,-1.54,;1.97,-.29,;.51,-.77,;-3.49,,;-4.83,-.77,;-6.16,,;-6.16,1.54,;-7.5,2.31,;-4.83,2.31,;-3.49,1.54,)|
CN(C)c1cccc(Cc2nc3c(-c4ccnc(C)c4)c(nc(N)n3n2)-c2ccc(F)cc2)n1
Cc1cc(cc(Cl)n1)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
Cc1cc(ccn1)-c1c(nc(N)n2nc(Cc3cccc(n3)C#N)nc12)-c1ccc(F)cc1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ncco1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ncco1
Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)n(c2)C2CCOC2)c2nc(Cc3c(F)cccc3F)nn12
Cc1ccc(cn1)-c1nc(N)n2nc(Cc3c(F)cccc3F)nc2c1-c1ccc(=O)n(C)c1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-n1nccn1
Cc1cnc(o1)-c1nc(N)n2nc(Cc3c(F)cccc3F)nc2c1-c1ccc(=O)n(C)c1
Cc1coc(n1)-c1nc(N)n2nc(Cc3c(F)cccc3F)nc2c1-c1ccc(=O)n(C)c1
Cn1cc(ccc1=O)-c1c(Cl)nc(N)n2nc(Cc3c(F)cccc3F)nc12
Cc1cc(cn(C)c1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
Cn1nc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
Nc1nc(-c2ncco2)c(-c2ccc3nccn3c2)c2nc(Cc3ncccc3F)nn12
Nc1nc(-c2ccc(F)cc2)c(-c2ccc3nccn3c2)c2nc(Cc3ncccc3F)nn12
Cc1cc(cc(C)n1)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ncco1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3cccc(N)n3)nc12)-c1ccc(F)cc1
Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)n(c2)C2CC2)c2nc(Cc3ncccc3F)nn12
Nc1cccc(Cc2nc3c(-c4ccc5nccn5c4)c(nc(N)n3n2)-c2ccc(F)cc2)n1
Nc1cc(ccn1)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)c(F)c1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1cccc(F)c1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(cc1)C(F)F
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3nccs3)nc12)-c1ccc(F)cc1
CNc1cc(ccn1)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1nccs1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(Cl)cc1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(cc1)C#N
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3cscn3)nc12)-c1ccc(F)cc1
Cn1cc(cn1)-c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc(=O)n(C)c1
Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)n(c2)C2CS(=O)(=O)C2)c2nc(Cc3c(F)cccc3F)nn12
COc1ccc(cc1)-c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc(=O)n(C)c1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(cc1)C(F)(F)F
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-n1cccn1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1F
Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)n(CCO)c2)c2nc(Cc3c(F)cccc3F)nn12
Cc1c(ccc(=O)n1C)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1 |(1.84,.77,;.51,1.54,;-.83,.77,;-2.16,1.54,;-2.16,3.08,;-.83,3.85,;-.83,5.39,;.51,3.08,;1.84,3.85,;-.83,-.77,;-2.16,-1.54,;-2.16,-3.08,;-.83,-3.85,;-.83,-5.39,;.51,-3.08,;1.97,-3.56,;2.88,-2.31,;4.42,-2.31,;5.19,-.98,;4.42,.36,;5.19,1.69,;6.73,1.69,;7.5,.36,;6.73,-.98,;7.5,-2.31,;1.97,-1.06,;.51,-1.54,;-3.49,-.77,;-3.49,.77,;-4.83,1.54,;-6.16,.77,;-7.5,1.54,;-6.16,-.77,;-4.83,-1.54,)|
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncc(F)cc3F)nc12)-c1ccc(F)cc1
Cc1nc(Cc2nc3c(-c4ccc5nccn5c4)c(nc(N)n3n2)-c2ccc(F)cc2)cs1
Cn1cnc2ccc(cc12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1cccc(Cl)c1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3OC(F)F)nc12)-c1ncco1
Nc1nc(-c2ccc(F)cc2)c(-c2ccc3nncn3c2)c2nc(Cc3ncccc3F)nn12
Nc1nc(-c2ccc(F)cc2)c(-c2ccc3nncn3c2)c2nc(Cc3ncccc3OC(F)F)nn12
Nc1nc(-c2ncco2)c(-c2ccc3nncn3c2)c2nc(Cc3ncccc3OC(F)F)nn12
Nc1nc(-c2ccc(F)cc2)c(-c2ccc3nc[nH]c3c2)c2nc(Cc3ncccc3F)nn12
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1cc(F)cc(F)c1
COc1cccc(c1)-c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc(=O)n(C)c1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccccc1Cl
CC(C)n1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ncco1
CC(C)n1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ncco1
Cc1cc(cc(N)n1)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ncco1
Cc1cc(cc(Cl)n1)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ncco1
Cc1cc(cc(n1)C#N)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ncco1
Cc1cc(cc(n1)C1CC1)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ncco1
Nc1nc(-c2ncco2)c(-c2ccnc(OC(F)F)c2)c2nc(Cc3c(F)cccc3F)nn12
Nc1nc(-c2ncco2)c(-c2ccnc(OC(F)F)c2)c2nc(Cc3ncccc3F)nn12
Cc1cc(cc(OC(F)F)n1)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ncco1
Nc1nc(-c2ccc(F)cc2)c(-c2ccc3ncsc3c2)c2nc(Cc3ncccc3F)nn12
Nc1nc(-c2ccc(F)cc2)c(-c2ccc3ncccc3c2)c2nc(Cc3ncccc3F)nn12
Cn1cnc2ccc(cc12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ncco1
Cn1cnc2ccc(cc12)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ncco1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ccccn1
Nc1nc(c(-c2ccc3nccn3c2)c2nc(Cc3ncccc3F)nn12)-n1ccnn1
Nc1nc(c(-c2ccc3nccn3c2)c2nc(Cc3ncccc3F)nn12)-n1nccn1
Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)n(CCO)c2)c2nc(Cc3ncccc3F)nn12
Nc1nc(-c2ccc(F)cc2)c(-c2ccc3nccnc3c2)c2nc(Cc3ncccc3F)nn12
Cn1ccc2cc(ccc12)-c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc(=O)n(C)c1
COc1ccccc1-c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc(=O)n(C)c1
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ncco1
CN(C)c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc2ncc(C)n2c1
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)N1CCCC1
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)N1CCOCC1
CN1CCC[C@H]1Cc1nc2c(-c3ccc4ncn(C)c4c3)c(nc(N)n2n1)-c1ccc(F)cc1 |r|
CN1CCC[C@@H]1Cc1nc2c(-c3ccc4ncn(C)c4c3)c(nc(N)n2n1)-c1ccc(F)cc1 |r|
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(CC3CCOC3)nc12)-c1ccc(F)cc1
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(C[C@H]3CCOC3)nc12)-c1ccc(F)cc1 |r|
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(C[C@@H]3CCOC3)nc12)-c1ncco1 |r|
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(C[C@H]3CCOC3)nc12)-c1ncco1 |r|
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)N1CCC2(COC2)C1
COCCc1nc2c(-c3ccc4ncc(C)n4c3)c(nc(N)n2n1)-c1ccc(F)cc1
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-n1ccc(F)n1
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-n1cc(F)cn1
CN(C)CCc1nc2c(-c3ccc4ncc(C)n4c3)c(nc(N)n2n1)-c1ccc(F)cc1
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)N1CCOCC1
CN1CCC[C@H]1Cc1nc2c(-c3ccc4ncc(C)n4c3)c(nc(N)n2n1)-c1ccc(F)cc1 |r|
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)N1CCCC1
Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)N1CCC1
Cn1cc(ccc1=O)-c1nc(C(=O)NCc2c(F)cccc2F)c(N)nc1-c1ncco1
CNc1cccc(CNC(=O)c2nc(-c3ccc(=O)n(C)c3)c(nc2N)-c2ncco2)n1
Cc1cc(cc(C)n1)-c1nc(C(=O)NCc2ccccc2OC(F)(F)F)c(N)nc1-c1ccc(F)cc1
Cc1c(-c2ncco2)nc(N)c2nc(CCN3CCn4c(cnc4C(C)C)C3)nn12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCn4c(cnc4C(C)C)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCn4c(cnc4C4CCC4)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCn4c(cnc4C4CC4)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4c(cnn4C4CCC4)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4nn(C5CCC5)cc4C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4c(nnn4C(C)C)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4c(nnn4C4CC4)C3)nc12
Cc4c(c1ncco1)nc(N)n5nc(CCN2CCc3c(C2)nnn3CC(F)(F)F)nc45
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4c(nnn4CC(C)(C)O)C3)nc12
CC(C)c1ncc2n1CCN(CCc1nc3cc(-c4ncco4)nc(N)n3n1)C2
Cc1c(-c2cccc(F)c2)nc(N)c2nc(CCN3CCn4c(cnc4C(C)C)C3)nn12
COc1c(F)cc(F)cc1-c1cc2nc(CCN3CCn4c(cnc4C(C)C)C3)nn2c(N)n1
CC(C)c1ncc2n1CCN(CCc1nc3cc(-c4cc(F)ccc4O)nc(N)n3n1)C2
CC(C)c1ncc2n1CCN(CCc1nc3cc(-c4cc(F)ccc4F)nc(N)n3n1)C2
CC(C)c1ncc2n1CCN(CCc1nc3cc(-c4cc(F)ccc4Cl)nc(N)n3n1)C2
CC(C)c1ncc2n1CCN(CCc1nc3cc(-c4cccc(F)c4)nc(N)n3n1)C2
CC(C)c1ncc2n1CCN(CCc1nc3cc(-c4cc(F)cc(F)c4)nc(N)n3n1)C2
Cc1c(-c2cccc(F)c2)nc(N)n2nc(CCN3CCn4c(cnc4C(C)C)C3)nc12
Cc1c(-c2cccc(F)c2)nc(N)n2nc(CCN3CCc4c(nnn4C(C)C)C3)nc12
CC(C)n1nnc2c1CCN(CCc1nc3cc(-c4cccc(C#N)c4F)nc(N)n3n1)C2
Cc1c(-c2cncc(C(F)(F)F)c2)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2cccc(Cl)c2)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2cc(Cl)ccc2F)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2cc(F)cc(F)c2)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2cc(F)cc(F)c2F)nc(N)c2nc(Cc3ccccc3)nn12
COc1ncc(-c2nc(N)c3nc(Cc4ccccc4)nn3c2C)cc1Cl
Cc1c(-c2cc(F)cc(Cl)c2)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2cccc(F)c2F)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2cccc(Cl)c2F)nc(N)c2nc(Cc3ccccc3)nn12
COc1cc(F)cc(-c2nc(N)c3nc(Cc4ccccc4)nn3c2C)c1
Cc1c(-c2cncc(Cl)c2)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2ccc(F)c(Cl)c2)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2cc(F)c(F)cc2F)nc(N)c2nc(Cc3ccccc3)nn12
Cc1ccc(F)cc1-c1nc(N)c2nc(Cc3ccccc3)nn2c1C
Cc1c(-c2cc(F)c(F)c(F)c2)nc(N)c2nc(Cc3ccccc3)nn12
Cc1ccc(-c2nc(N)c3nc(Cc4ccccc4)nn3c2C)cc1F
Cc1c(-c2cc(F)ccc2Cl)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(F)cccc1-c1nc(N)c2nc(Cc3ccccc3)nn2c1C
Cc1c(-c2ccc(F)c(F)c2F)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2cccc(F)c2Cl)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2ccc(C#N)c(F)c2)nc(N)c2nc(Cc3ccccc3)nn12
COc1ccc(F)cc1-c1nc(N)c2nc(Cc3ccccc3)nn2c1C
Cc1c(-c2ccn(C)n2)nc(N)c2nc(Cc3ccccc3)nn12
Cc1c(-c2cc(F)ccc2F)nc(N)c2nc(Cc3ccc(F)cn3)nn12
Cc1c(-c2cc(F)ccc2F)nc(N)c2nc(Cc3cccc4c3ncn4CC(F)F)nn12
Cc1c(-c2ncco2)nc(N)n2nc(Cc3ccc4ncn(CC(F)F)c4c3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(Cc3ccc4c(c3)ncn4CC(F)F)nc12
Cc1c(-c2cc(F)ccc2F)nc(N)c2nc(Cc3ncccc3F)nn12
Cc1c(-c2ncco2)nc(N)c2nc(Cc3cccc4c3ncn4CC(C)(C)O)nn12
Cc1c(-c2ncco2)nc(N)c2nc(Cc3cccc4c3ncn4CC(F)F)nn12
Cc1c(-c2ncco2)nc(N)c2nc(Cc3ccc(C(C)(C)O)cn3)nn12
Cc1c(-c2ncco2)nc(N)c2nc(Cc3ccc(CC(C)(C)O)cc3)nn12
COC5(c4ccc(Cc3nc2c(C)c(c1ncco1)nc(N)n2n3)cc4)CCC5
Cc1c(-c2ncco2)nc(N)n2nc(Cc3ccc(C(C)(C)O)cc3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(Cc3cccc(C(C)(C)O)c3)nc12
Cc1c(-c2ncco2)nc(N)c2nc(Cc3ccc(C(C)(C)O)cc3)nn12
Cc1c(-c2ncco2)nc(N)c2nc(Cc3cccc(C(C)(C)O)c3)nn12
Cc1c(-c2ncco2)nc(N)n2nc(Cc3ccn(C)n3)nc12
Cc1c(-c2ncco2)nc(N)c2nc(Cc3ncccc3F)nn12
Cc1c(-c2ncco2)nc(N)n2nc(CN3CCc4cccnc43)nc12
Cc3c(c1ncco1)nc(N)n4nc(CNCc2ccc(C(F)(F)F)cn2)nc34
Cc3c(c1cccc(F)c1)nc(N)n4nc(CNCc2ccc(C(F)(F)F)cc2)nc34
Cc1c(-c2ncco2)nc(N)n2nc(CNCc3ccc(C(C)(C)O)cn3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CNCc3ccc(C(C)(C)O)nc3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CNCc3cnn(CC(C)(C)O)c3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCn4c(cnc4C4CCCC4)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3Cc4cn(CC(C)(C)O)nc4C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3Cc4cnn(C)c4C3)nc12
Cc1cc2n(n1)CCN(CCc1nc3c(C)c(-c4ncco4)nc(N)n3n1)C2
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCn4c(cnc4C45CC(C4)C5)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3Cc4nnn(C(C)C)c4C(C)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3Cc4nnn(C(C)C)c4C(C)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4nn(C5CC(F)(F)C5)cc4C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4c(cnn4C4CC(F)(F)C4)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4nn(C5CCCC5)cc4C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4c(cnn4C4CCCC4)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4c(nnn4C4CCCC4)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4c(nnn4C4CC(F)(F)C4)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4c(nnn4C45CC(C4)C5)C3)nc12
Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCCC(F)(F)C3)nc12
CCOC(=O)c4cnn(CCc3nc2c(C)c(c1ncco1)nc(N)n2n3)c4
Nc1nc(-c2cc(F)ccc2F)c(C2CC2)n2nc(Cc3ccccc3)nc12
C[C@H](NC(=O)c1nc(N[C@@H](C)c2cccnc2)nc2ccsc12)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCC(C)(C)C2)c2sccc2n1)c1cccnc1 |r|
O=C(NCc1cncnc1)c1nc(NCc2cncnc2)nc2ccsc12
O=C(N1CCCC1)c1nc(NCc2cncnc2)nc2ccsc12
C[C@H](Nc1nc(C(=O)NCc2cncnc2)c2sccc2n1)c1cccnc1 |r|
CC1(C)CCN(C1)C(=O)c1nc(NCc2cncnc2)nc2ccsc12
C[C@H](Nc1nc(C(=O)N2CC[C@@H](F)C2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](F)C2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CCOCC2)c2sccc2n1)c1cccnc1 |r|
COc1ccc(CNC(=O)c2nc(NCc3ccc(OC)nc3)nc3ccsc23)cn1
C[C@H](Nc1nc(C(=O)N2CCC(F)(F)C2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC3(COC3)C2)c2sccc2n1)c1cccnc1 |r|
Fc1cncc(CNC(=O)c2nc(NCc3cncc(F)c3)nc3ccsc23)c1
COc1ccc(CNC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3ccsc23)cn1 |r|
COc1ccc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)cn1
CO[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cccnc2)nc2ccsc12 |r|
CO[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cccnc2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NCc2cncc(F)c2)c2sccc2n1)c1cccnc1 |r|
Fc1cncc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)c1
CN(C1CCC(C)(C)C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12
CCC(NC(=O)c1nc(NC(CC)c2cccnc2)nc2ccsc12)c1cccnc1
CCC(NC(=O)c1nc(N[C@@H](C)c2cccnc2)nc2ccsc12)c1cccnc1 |r|
CCC(Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1
CCC(Nc1nc(C(=O)N2CC[C@H](C2)OC)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCN(Cc3ccccc3)CC2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sccc2n1)c1cccnc1 |r|
C[C@@H](NC(=O)c1nc(N[C@@H](C)c2cccnc2)nc2ccsc12)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCCCC2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC(F)(F)C2)c2sccc2n1)c1cccnc1 |r|
COc1ccc(CNC(=O)c2nc(N[C@@H](C)c3cccnc3)nc3ccsc23)cc1OC |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C)C2)c2sccc2n1)c1cccnc1 |r|
O=C(NCc1cccnn1)c1nc(NCc2cccnn2)nc2ccsc12
C[C@H](Nc1nc(C(=O)N2CCC[C@@H]2C)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCC[C@H]2C)c2sccc2n1)c1cccnc1 |r|
COc1ccc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)cc1OC
O=C(N1CCCC1)c1nc(NCc2ccccc2)nc2ccsc12
O[C@H]1CCN(C1)C(=O)c1nc(NCc2ccccc2)nc2ccsc12 |r|
CCN(CC)C(=O)c1nc(N[C@@H](C)c2cccnc2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NCc2ccccc2)c2sccc2n1)c1cccnc1 |r|
O=C(N1CCCC1)c1nc(NCc2cccnn2)nc2ccsc12
CC(NC(=O)c1nc(NC(C)c2cccnc2)nc2ccsc12)c1cccnc1
Cc1cncc(CNC(=O)c2nc(NCc3cncc(C)c3)nc3ccsc23)c1
C[C@H](Nc1nc(C(=O)N2CCC[C@@H]2CO)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCC[C@H]2CO)c2sccc2n1)c1cccnc1 |r|
CC(Nc1nc(C(=O)N2CC[C@@H](F)C2)c2sccc2n1)c1cccnc1 |r|
COc1ccc(CNC(=O)c2nc(NC(C)c3ccccn3)nc3ccsc23)cn1
Cc1cncc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)c1
O=C(NCc1ccccc1)c1nc(NCc2ccccc2)nc2ccsc12
C[C@H](Nc1nc(C(=O)N2CC[C@@H](F)C2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](F)C2)c2sccc2n1)c1ccccn1 |r|
C[C@H](NC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12)c1ccccn1 |r|
Cc1cncc(CNc2nc(C(=O)N3CCC3)c3sccc3n2)c1
Cc1cncc(CNc2nc(C(=O)N3CC[C@H](O)C3)c3sccc3n2)c1 |r|
COc1ccc(CNC(=O)c2nc(NCc3cncc(C)c3)nc3ccsc23)cn1
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sccc2n1)c1ccccn1 |r|
F[C@@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
Fc1cncc(CNc2nc(C(=O)N3CCC3)c3sccc3n2)c1
O[C@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C)C2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCc2ccc(nc2)C#N)c2sccc2n1)c1ccccn1 |r|
COc1ccc(NC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3ccsc23)cn1 |r|
O[C@@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
COc1ccc(CNC(=O)c2nc(NCc3cncc(F)c3)nc3ccsc23)cn1
Fc1cncc(CNc2nc(C(=O)NCC3CCN(Cc4ccccc4)CC3)c3sccc3n2)c1
C[C@H](Nc1nc(C(=O)N2CCN(CCCc3ccccc3)CC2)c2sccc2n1)c1cccnc1 |r|
Oc1cccc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)n1
Fc1cccc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)n1
FC(F)(F)c1ccc(CNC(=O)c2nc(NCc3ccc(nc3)C(F)(F)F)nc3ccsc23)cn1
COc1cccc(CNC(=O)c2nc(N[C@@H](C)c3cccnc3)nc3ccsc23)n1 |r|
Fc1cccc(CNC(=O)c2nc(NCc3cccc(F)c3)nc3ccsc23)c1
O[C@H]1CCN(C1)C(=O)c1nc(NCc2ccc(nc2)C(F)(F)F)nc2ccsc12 |r|
FC(F)(F)c1ccc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)cn1
CC(CNC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12)Oc1cccnc1 |r|
O=C(NCc1ccccn1)c1nc(NCc2ccccn2)nc2ccsc12
C[C@H](Nc1nc(C(=O)NCc2ccc(nc2)C(F)(F)F)c2sccc2n1)c1ccccn1 |r|
Fc1cccc(CNc2nc(C(=O)N3CCN(CCCc4ccccc4)CC3)c3sccc3n2)c1
O[C@@H]1CCN(C1)C(=O)c1nc(NCc2cccc(F)c2)nc2ccsc12 |r|
COc1ccc(CNC(=O)c2nc(NCc3cccc(F)c3)nc3ccsc23)cn1
CCC(Nc1nc(C(=O)NCc2ccc(OC)nc2)c2sccc2n1)c1cccnc1
Fc1cccc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)c1
Fc1cncc(CNc2nc(C(=O)NCCn3ccnc3)c3sccc3n2)c1
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C)C2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C)C2)c2sccc2n1)c1ccccn1 |r|
Cc1ncccc1CNC(=O)c1nc(NCc2cccnc2C)nc2ccsc12
C[C@H](Nc1nc(C(=O)NCc2ccccn2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2)c2sccc2n1)c1ccccn1 |r|
Cc1ncccc1CNc1nc(C(=O)N2CCCC2)c2sccc2n1
C[C@H](Nc1nc(C(=O)N2CC(F)(F)C2)c2sccc2n1)c1ccccn1 |r|
Clc1cncc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)c1
COc1ccc(CNC(=O)c2nc(NCc3cccnc3C)nc3ccsc23)cn1
O=C(N1CCCC1)c1nc(NCc2ccccn2)nc2ccsc12
C[C@H](Nc1nc(C(=O)N2CCC(F)(F)C2)c2sccc2n1)c1ccccn1 |r|
Fc1cncc(CNc2nc(C(=O)N3CC(F)(F)C3)c3sccc3n2)c1
CC1(O)CN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12
F[C@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(O)C2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C)(O)C2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCc2cncc(c2)C#N)c2sccc2n1)c1ccccn1 |r|
O[C@@H]1CCN(C1)C(=O)c1nc(NCc2cccnc2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NCc2cncc(c2)C#N)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCOC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCO)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCc2ccc(OCC3CC3)nc2)c2sccc2n1)c1ccccn1 |r|
COC1CN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
OC1CN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12
COc1cncc(CNC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3ccsc23)c1 |r|
CCNC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
CC(C)(Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1
COCCN1CCC(CNC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3ccsc23)CC1 |r|
COc1cncc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)c1
COC1CN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12
COc1cncc(CNc2nc(C(=O)N3CCC3)c3sccc3n2)c1
COc1cncc(CNc2nc(C(=O)N3CC(C)C3)c3sccc3n2)c1
O[C@@H]1CCN(C1)C(=O)c1nc(NCc2cccc(Cl)c2)nc2ccsc12 |r|
COc1cncc(CNc2nc(C(=O)N3CC(O)C3)c3sccc3n2)c1
Clc1cccc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)c1
Clc1cccc(CNc2nc(C(=O)N3CCC3)c3sccc3n2)c1
OC1CN(C1)C(=O)c1nc(NCc2cccc(Cl)c2)nc2ccsc12
OCCNC(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12
COCC(Nc1nc(C(=O)N2CC[C@H](O)C2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccc(F)c1 |r|
COCC(Nc1nc(C(=O)N2CCC2)c2sccc2n1)c1cccnc1
COCC(Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1
C[C@H](Nc1nc(C(=O)N2CCC2)c2sccc2n1)c1cccc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sccc2n1)c1cccc(F)c1 |r|
Fc1ccc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)nc1
O[C@H]1CCN(C1)C(=O)c1nc(NCc2ccc(F)cn2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sccc2n1)c1cccc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2C)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cncc(F)c1 |r|
CC(C)(C)OC(=O)N1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12
COc1cc(F)cc(CNc2nc(C(=O)N3CC(C)(O)C3)c3sccc3n2)c1
COc1cc(F)cc(CNc2nc(C(=O)N3CC(O)C3)c3sccc3n2)c1
C[C@H](Nc1nc(C(=O)N2CC(O)C2)c2sccc2n1)c1cccnc1 |r|
COC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cccnc2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CCN(C2)C(=O)OC(C)(C)C)c2sccc2n1)c1cccnc1 |r|
O=C(N1CCCC1)c1nc(NCc2cncc(c2)C#N)nc2ccsc12
NC(=O)c1cncc(CNc2nc(C(=O)N3CCCC3)c3sccc3n2)c1
C[C@H](Nc1nc(C(=O)NC2CCN(C2)C(=O)OC(C)(C)C)c2sccc2n1)c1ccccn1 |r|
COCCNC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NCCO)c2sccc2n1)c1cccnc1 |r|
COCCNC(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12
C[C@H](Nc1nc(C(=O)NC2CCC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CCNC2)c2sccc2n1)c1cccnc1 |r|
Fc1cncc(CNc2nc(C(=O)N3CCNC3)c3sccc3n2)c1
C[C@H](Nc1nc(C(=O)NC2CCNC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCN(Cc3ccccc3)CC2)c2sccc2n1)c1ccccn1 |r|
CNc1cc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CCCC3)c2s1 |r|
CNc1cc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CCC3)c2s1 |r|
O=C(NC1CCC1)c1nc(NCc2cnccn2)nc2ccsc12
O=C(N1CCC1)c1nc(NCc2cnccn2)nc2ccsc12
O[C@H]1CCN(C1)C(=O)c1nc(NCc2cnccn2)nc2ccsc12 |r|
COCCNC(=O)c1nc(NCc2cnccn2)nc2ccsc12
C[C@H](Nc1nc(C(=O)NC2C[C@H](O)C2)c2sccc2n1)c1ccccn1 |r,wU:1.0,11.11,(1.85,.23,;1.85,-1.31,;.52,-2.08,;-.82,-1.31,;-.82,.23,;-2.15,1,;-2.15,2.54,;-3.48,3.31,;-.82,3.31,;.72,3.31,;1.81,2.22,;2.9,3.31,;4.44,3.31,;1.81,4.39,;-3.48,.23,;-4.95,.7,;-5.85,-.54,;-4.95,-1.79,;-3.48,-1.31,;-2.15,-2.08,;3.19,-2.08,;3.19,-3.62,;4.52,-4.39,;5.85,-3.62,;5.85,-2.08,;4.52,-1.31,)|
C[C@H](Nc1nc(C(=O)NC2C[C@H](O)C2)c2sccc2n1)c1ccccn1 |r,wU:1.0,wD:11.11,(1.85,.23,;1.85,-1.31,;.52,-2.08,;-.82,-1.31,;-.82,.23,;-2.15,1,;-2.15,2.54,;-3.48,3.31,;-.82,3.31,;.72,3.31,;1.81,4.39,;2.9,3.31,;4.44,3.31,;1.81,2.22,;-3.48,.23,;-4.95,.7,;-5.85,-.54,;-4.95,-1.79,;-3.48,-1.31,;-2.15,-2.08,;3.19,-2.08,;3.19,-3.62,;4.52,-4.39,;5.85,-3.62,;5.85,-2.08,;4.52,-1.31,)|
CNc1cc2nc(NCc3ccccn3)nc(C(=O)N3CCCC3)c2s1
CNc1cc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CC[C@@H](F)C3)c2s1 |r|
C[C@@H](O)CNC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
C[C@H](O)CNC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CCC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sccc2n1)c1cncc(F)c1 |r|
CC(C)(C)OC(=O)N[C@@H]1CCN(C1)C(=O)c1nc(NCc2cc(F)cc(F)c2)nc2ccsc12 |r|
Fc1cc(F)cc(CNc2nc(C(=O)N3CCC3)c3sccc3n2)c1
OCCNC(=O)c1nc(NCc2cc(F)cc(F)c2)nc2ccsc12
CCOc1ccc(CNC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3ccsc23)cn1 |r|
Fc1cncc(CNc2nc(C(=O)NC3CCC3)c3sccc3n2)c1
CNc1cc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CCC(O)C3)c2s1 |r|
CNc1cc2nc(N[C@@H](C)c3ccccn3)nc(C(=O)N3CCC3)c2s1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](F)C2)c2sc(N)cc2n1)c1ccccn1 |r|
CNc1cc2nc(N[C@@H](C)c3ccccn3)nc(C(=O)N3CC[C@@H](F)C3)c2s1 |r|
CNc1cc2nc(N[C@@H](C)c3ccccn3)nc(C(=O)N3CC[C@@H](O)C3)c2s1 |r|
Fc1cc(F)cc(CNc2nc(C(=O)NC3CCC3)c3sccc3n2)c1
CC(C)(C)OC(=O)N1CC(C1)NC(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12
C[C@H](Nc1nc(C(=O)NC2CN(C2)C(=O)OC(C)(C)C)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NC2CCCC2)c2sccc2n1)c1ccccn1 |r|
C[C@@H](CO)NC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
C[C@H](CO)NC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
O[C@H]1CC(C1)NC(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r,wU:1.0,(4.44,4.08,;2.9,4.08,;1.81,2.99,;.72,4.08,;1.81,5.16,;-.82,4.08,;-2.15,3.31,;-3.48,4.08,;-2.15,1.77,;-.82,1,;-.82,-.54,;.52,-1.31,;1.85,-.54,;3.19,-1.31,;4.52,-.54,;5.85,-1.31,;5.85,-2.85,;4.52,-3.62,;4.52,-5.16,;3.19,-2.85,;-2.15,-1.31,;-3.48,-.54,;-4.95,-1.02,;-5.85,.23,;-4.95,1.47,;-3.48,1,)|
O[C@H]1CC(C1)NC(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r,wD:1.0,(4.44,4.08,;2.9,4.08,;1.81,5.16,;.72,4.08,;1.81,2.99,;-.82,4.08,;-2.15,3.31,;-3.48,4.08,;-2.15,1.77,;-.82,1,;-.82,-.54,;.52,-1.31,;1.85,-.54,;3.19,-1.31,;4.52,-.54,;5.85,-1.31,;5.85,-2.85,;4.52,-3.62,;4.52,-5.16,;3.19,-2.85,;-2.15,-1.31,;-3.48,-.54,;-4.95,-1.02,;-5.85,.23,;-4.95,1.47,;-3.48,1,)|
COC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
Nc1cc2nc(NCc3cccnc3)nc(C(=O)N3CCCC3)c2s1
CNc1cc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CC[C@H](F)C3)c2s1 |r|
CNc1cc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CC[C@H](O)C3)c2s1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2)c2sc(N)cc2n1)c1ccccn1 |r|
C[C@@H](O)CNC(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](O)CNC(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NC2CC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NC2COC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](F)C2)c2sc(N)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sc(N)cc2n1)c1cccnc1 |r|
CNc1cc2nc(N[C@@H](C)c3cncc(F)c3)nc(C(=O)N3CC[C@H](O)C3)c2s1 |r|
C[C@H](Nc1nc(C(=O)N2CC(O)C2)c2sccc2n1)c1cncc(F)c1 |r|
CC(C)NC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NCc2cncc(c2)C(F)(F)F)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NC(C)(C)C)c2sccc2n1)c1ccccn1 |r|
COCC(Nc1nc(C(=O)NC2CC2)c2sccc2n1)c1cccnc1
C[C@H](Nc1nc(C(=O)N2CCC2)c2sc(N)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](F)C2)c2sc(N)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC(O)C2)c2sc(N)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C)C2)c2sc(N)cc2n1)c1ccccn1 |r|
CNc1cc2nc(N[C@@H](C)c3ccccn3)nc(C(=O)N3CC[C@@H](C)C3)c2s1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sc(N)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCO)c2sc(N)cc2n1)c1ccccn1 |r|
CNc1cc2nc(N[C@@H](C)c3cncc(F)c3)nc(C(=O)N3CCCC3)c2s1 |r|
CNc1cc2nc(N[C@@H](C)c3cncc(F)c3)nc(C(=O)N3CCC3)c2s1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sc(C)cc2n1)c1cccnc1 |r|
CCc1cc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CCCC3)c2s1 |r|
C[C@H](Nc1nc(C(=O)NCCS(C)(=O)=O)c2sccc2n1)c1ccccn1 |r|
COCC(Nc1nc(C(=O)NC2COC2)c2sccc2n1)c1cccnc1
COCC(Nc1nc(C(=O)N2CC(C2)OC)c2sccc2n1)c1cccnc1
COCC(Nc1nc(C(=O)NC2C[C@H](O)C2)c2sccc2n1)c1cccnc1 |r,wU:13.13,(.52,2.54,;.52,1,;1.85,.23,;1.85,-1.31,;.52,-2.08,;-.82,-1.31,;-.82,.23,;-2.15,1,;-2.15,2.54,;-3.48,3.31,;-.82,3.31,;.72,3.31,;1.81,2.22,;2.9,3.31,;4.44,3.31,;1.81,4.39,;-3.48,.23,;-4.95,.7,;-5.85,-.54,;-4.95,-1.79,;-3.48,-1.31,;-2.15,-2.08,;3.19,-2.08,;3.19,-3.62,;4.52,-4.39,;5.85,-3.62,;5.85,-2.08,;4.52,-1.31,)|
C[C@H](Nc1nc(C(=O)NCC2CCOCC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sc(N)cc2n1)c1cccnc1 |r|
CNc1cc2nc(N[C@@H](C)c3ccccn3)nc(C(=O)N3CC(O)C3)c2s1 |r|
CNc1cc2nc(N[C@@H](C)c3ccccn3)nc(C(=O)NCCO)c2s1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sc(N)cc2n1)c1cncc(F)c1 |r|
CNc1cc2nc(N[C@@H](C)c3cncc(F)c3)nc(C(=O)N3CC[C@@H](O)C3)c2s1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](F)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCC(F)(F)F)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCOCC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCCN2C(=O)OC(C)(C)C)c2sccc2n1)c1ccccn1 |r|
CC(C)(C)OC(=O)N1CCCC1CNC(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12
C[C@H](Nc1nc(C(=O)NCC(C)(C)O)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cncc(Cl)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2)c2sccc2n1)c1cncc(Cl)c1 |r|
COC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(Cl)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](F)C2)c2sccc2n1)c1cncc(F)c1 |r|
CN(C1CN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12)C(=O)OC(C)(C)C
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sccc2n1)c1cncc(Cl)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sccc2n1)c1cncc(Cl)c1 |r|
C[C@H](Nc1nc(C(=O)NCC(C)(C)O)c2sccc2n1)c1cncc(F)c1 |r|
CC(C)(C)OC(=O)N[C@@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
CNc1cc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CC(O)C3)c2s1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2)c2sc(N)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sc(N)cc2n1)c1cncc(F)c1 |r|
CNc1cc2nc(N[C@@H](C)c3cncc(F)c3)nc(C(=O)N3CC(C3)OC)c2s1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sc(C)cc2n1)c1ccccn1 |r|
CC(C)(C)OC(=O)N[C@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C2)NC(=O)OC(C)(C)C)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC(O)C2)c2sc(N)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
CO[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
CO[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
CO[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(Cl)c2)nc2ccsc12 |r|
CO[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(Cl)c2)nc2ccsc12 |r|
CO[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C2)S(C)(=O)=O)c2sccc2n1)c1ccccn1 |r|
FC(F)(F)c1cncc(CNc2nc(C(=O)N3CCC3)c3sccc3n2)c1
O=C(N1CCCC1)c1nc(NCCc2ccccc2)nc2ccsc12
C[C@H](Nc1nc(C(=O)N2CC[C@H](CO)C2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](CO)C2)c2sccc2n1)c1cccnc1 |r|
CS(=O)(=O)[C@@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C2)S(C)(=O)=O)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCC(F)(F)F)c2sccc2n1)c1cncc(F)c1 |r|
O[C@H]1CCN(C1)C(=O)c1nc(NCc2cncc(c2)C(F)(F)F)nc2ccsc12 |r|
C[C@H](O)CNC(=O)c1nc(NCc2cncc(c2)C(F)(F)F)nc2ccsc12 |r|
C[C@@H](O)CNC(=O)c1nc(NCc2cncc(c2)C(F)(F)F)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(O)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
COC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)NC(CO)c2cccnc2)c2sccc2n1)c1ccccn1 |r|
OCC(Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1
C[C@H](Nc1nc(C(=O)N2CCC[C@@H]2C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCC[C@H]2C)c2sccc2n1)c1cncc(F)c1 |r|
O=C(N1CCCC1)c1nc(NCCn2ccnc2)nc2ccsc12
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C2)S(C)(=O)=O)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCO)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](O)CNC(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@@H](O)CNC(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCC(F)(F)F)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC(O)C2)c2sc(C)cc2n1)c1ccccn1 |r|
COC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cccnc2)nc2cc(C)sc12 |r|
C[C@H](O)CNC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2cc(C)sc12 |r|
C[C@@H](O)CNC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CCCOC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCc2nccn2C)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCO)c2sccc2n1)c1cncc(Cl)c1 |r|
C[C@H](O)CNC(=O)c1nc(N[C@@H](C)c2cncc(Cl)c2)nc2ccsc12 |r|
C[C@@H](O)CNC(=O)c1nc(N[C@@H](C)c2cncc(Cl)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](CO)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](CO)C2)c2sccc2n1)c1cncc(F)c1 |r|
CO[C@H]1CC(C1)NC(=O)c1nc(N[C@@H](C)c2cccnc2)nc2ccsc12 |r,wU:13.14,2.1,(5.24,4.52,;4.47,3.18,;2.93,3.18,;1.81,2.09,;.72,3.18,;1.81,4.27,;-.82,3.18,;-2.15,2.41,;-3.48,3.18,;-2.15,.87,;-.82,.1,;-.82,-1.44,;.52,-2.21,;1.85,-1.44,;1.85,.1,;3.19,-2.21,;3.19,-3.75,;4.52,-4.52,;5.85,-3.75,;5.85,-2.21,;4.52,-1.44,;-2.15,-2.21,;-3.48,-1.44,;-4.95,-1.91,;-5.85,-.67,;-4.95,.58,;-3.48,.1,)|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC(O)C2)c2sc(C)cc2n1)c1cccnc1 |r|
COC1CN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2cc(C)sc12 |r|
CO[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
CO[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)Nc2ccccc2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCc2ncc[nH]2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NC2C[C@H](O)C2)c2sccc2n1)c1cncc(Cl)c1 |r,wU:1.0,11.11,(1.85,1,;1.85,-.54,;.52,-1.31,;-.82,-.54,;-.82,1,;-2.15,1.77,;-2.15,3.31,;-3.48,4.08,;-.82,4.08,;.72,4.08,;1.81,2.99,;2.9,4.08,;4.44,4.08,;1.81,5.16,;-3.48,1,;-4.95,1.47,;-5.85,.23,;-4.95,-1.02,;-3.48,-.54,;-2.15,-1.31,;3.19,-1.31,;4.52,-.54,;5.85,-1.31,;5.85,-2.85,;4.52,-3.62,;4.52,-5.16,;3.19,-2.85,)|
C[C@H](Nc1nc(C(=O)NC2C[C@H](O)C2)c2sccc2n1)c1cncc(Cl)c1 |r,wU:1.0,wD:11.11,(1.85,1,;1.85,-.54,;.52,-1.31,;-.82,-.54,;-.82,1,;-2.15,1.77,;-2.15,3.31,;-3.48,4.08,;-.82,4.08,;.72,4.08,;1.81,5.16,;2.9,4.08,;4.44,4.08,;1.81,2.99,;-3.48,1,;-4.95,1.47,;-5.85,.23,;-4.95,-1.02,;-3.48,-.54,;-2.15,-1.31,;3.19,-1.31,;4.52,-.54,;5.85,-1.31,;5.85,-2.85,;4.52,-3.62,;4.52,-5.16,;3.19,-2.85,)|
COc1cncc(NC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3ccsc23)c1 |r|
C[C@H](Nc1nc(C(=O)NCC(C)(C)O)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](CO)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](CO)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
CO[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2cc(C)sc12 |r|
CO[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C2)NC(=O)OC(C)(C)C)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C2)NC(=O)OC(C)(C)C)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C2)NC(=O)OC(C)(C)C)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C2)NC(C)=O)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C2)NC(C)=O)c2sccc2n1)c1ccccn1 |r|
CC(=O)N[C@@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C2)NC(C)=O)c2sccc2n1)c1cncc(F)c1 |r|
COC[C@@H](Nc1nc(C(=O)NC[C@H](C)O)c2sccc2n1)c1cccnc1 |r|
COC[C@@H](Nc1nc(C(=O)NC[C@@H](C)O)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C2)NC(C)=O)c2sccc2n1)c1cccnc1 |r|
COC[C@H](Nc1nc(C(=O)NC[C@H](C)O)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C2)NC(C)=O)c2sccc2n1)c1ccccn1 |r|
COC[C@H](Nc1nc(C(=O)NC[C@@H](C)O)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sc(cc2n1)C(F)(F)F)c1cccnc1 |r|
C[C@H](O)CNC(=O)c1nc(N[C@@H](C)c2cccnc2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)NC2CC[C@@H](O)C2)c2sccc2n1)c1cncc(F)c1 |r|
CC(=O)N[C@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C2)NC(C)=O)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NC2CC[C@@H](O)C2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sc(cc2n1)C(F)(F)F)c1cccnc1 |r|
C[C@@H](O)CNC(=O)c1nc(N[C@@H](C)c2cccnc2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](CO)C2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](CO)C2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sc(cc2n1)C(F)(F)F)c1cccnc1 |r|
C[C@H](NC(=O)c1nc(N[C@@H](C)c2ccncc2)nc2ccsc12)c1ccncc1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(O)cc2)c2sccc2n1)c1cncc(F)c1 |r|
COC[C@@H](Nc1nc(C(=O)N2CCC2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CCN(CC2)C(=O)OC(C)(C)C)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CCN(CC2)C(=O)OC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1ccncc1 |r|
COc1ccc(CNC(=O)c2nc(N[C@@H](C)c3ccncc3)nc3ccsc23)cn1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sc(cc2n1)C(F)(F)F)c1cncc(F)c1 |r|
CC(O)CNC(=O)c1nc(N[C@@H](C)c2cccnc2)nc2cc(sc12)C(F)(F)F |r|
C[C@@H](O)CNC(=O)c1nc(N[C@@H](C)c2cccnc2)nc2cc(sc12)C(F)(F)F |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sc(cc2n1)C(F)(F)F)c1ccccn1 |r|
CO[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cccnc2)nc2cc(C)sc12 |r|
CO[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cccnc2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)NC2CCC2)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCO)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CCC(C2)C(=O)OC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCC(C2)C(=O)OC(C)(C)C)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCN2CCCC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCN2CCCC2)c2sccc2n1)c1cncc(F)c1 |r|
CNC1CN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12
Oc1ccc(CCNc2nc(C(=O)N3CCCC3)c3sccc3n2)cc1
N[C@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
N[C@@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](N)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)C2CC[C@H](N)C2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](N)C2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CCN(C2)C(=O)OC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](N)C2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](N)C2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCCO)c2sc(C)cc2n1)c1cccnc1 |r|
Fc1cncc(CNc2nc(C(=O)NCC3CCCN3)c3sccc3n2)c1
O=C(NCC1CCCN1)c1nc(NCc2ccccn2)nc2ccsc12
N[C@H]1CCN(C1)C(=O)c1nc(NCc2cc(F)cc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NCCN2CCOCC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(O)cc2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
COc1cccc(CNC(=O)c2nc(N[C@@H](C)c3cncc(F)c3)nc3cc(C)sc23)n1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCOCC2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCOCC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCNCC2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCCN2CCOCC2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCC(C2)C(O)=O)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCC(C2)C(O)=O)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CCNC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccncc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C2)NC(C)=O)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(CO)cc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(Cl)cc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CCNC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCOC2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCOC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sc(cc2n1)C(F)(F)F)c1cncc(F)c1 |r|
C[C@H](O)CNC(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(sc12)C(F)(F)F |r|
C[C@@H](O)CNC(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(sc12)C(F)(F)F |r|
C[C@H](NC(=O)c1nc(N[C@@H](C)c2ccccc2)nc2ccsc12)c1ccccc1 |r|
C[C@H](Nc1nc(C(=O)N[C@@H]2CC[C@@H](O)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N(C)CCc2ccc(O)cc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NC2CNC2)c2sccc2n1)c1cncc(F)c1 |r|
COc1ccc(Oc2cc(CNC(=O)c3nc(N[C@@H](C)c4cncc(F)c4)nc4ccsc34)ccn2)cc1 |r|
CO[C@@H](C)CNC(=O)c1nc(N[C@@H](C)c2cccnc2)nc2cc(C)sc12 |r|
CO[C@H](C)CNC(=O)c1nc(N[C@@H](C)c2cccnc2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(N)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N[C@@H]2CC[C@H](O)C2)c2sccc2n1)c1cncc(F)c1 |r|
COC[C@@H](Nc1nc(C(=O)NCCc2ccc(O)cc2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(=O)OC(C)(C)C)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(O)cc2)c2sccc2n1)c1ccnc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1ccnc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2sccc2n1)c1ccnc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](O)C2)c2sccc2n1)c1ccnc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2cccc(O)c2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(O)cc2)c2sccc2n1)c1ccccn1 |r|
COc1cccc(CCNC(=O)c2nc(N[C@@H](C)c3cncc(F)c3)nc3ccsc23)n1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](N)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](N)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2scc(C)c2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2)c2scc(C)c2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](O)C2)c2scc(C)c2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2cccc(Oc3ccccc3)c2)c2sccc2n1)c1cncc(F)c1 |r|
CNC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(CN)C2)c2sccc2n1)c1cncc(F)c1 |r|
COc1ccc(CCNC(=O)c2nc(N[C@@H](C)c3cncc(F)c3)nc3ccsc23)cc1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(NC(C)=O)cc2)c2sccc2n1)c1cncc(F)c1 |r|
COc1ccc(CCCNC(=O)c2nc(N[C@@H](C)c3cncc(F)c3)nc3ccsc23)cc1 |r|
COC(=O)c1ccc(CCNC(=O)c2nc(N[C@@H](C)c3cncc(F)c3)nc3ccsc23)cc1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CCCC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CCN(C2)C(=O)OC(C)(C)C)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CC(C2)C(=O)OC(C)(C)C)c2sccc2n1)c1ccccn1 |r,wU:1.0,(-.43,.77,;-.43,-.77,;-1.76,-1.54,;-3.09,-.77,;-3.09,.77,;-4.43,1.54,;-4.43,3.08,;-5.76,3.85,;-3.09,3.85,;-1.76,3.08,;-.43,3.85,;.91,3.08,;1.31,1.59,;2.79,1.99,;2.4,3.48,;4.13,1.22,;4.13,-.32,;5.46,1.99,;6.8,1.22,;8.13,1.99,;6.8,-.32,;8.13,.45,;-5.76,.77,;-7.22,1.25,;-8.13,,;-7.22,-1.25,;-5.76,-.77,;-4.43,-1.54,;.91,-1.54,;.91,-3.08,;2.24,-3.85,;3.58,-3.08,;3.58,-1.54,;2.24,-.77,)|
C[C@H](Nc1nc(C(=O)NCCc2cccc(O)c2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCCc2cccc(O)c2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)OC(C)(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(N)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CCNC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CNC2)c2sccc2n1)c1ccccn1 |r|
COc1ccc(cc1)[C@H](C)Nc1nc(C(=O)N2CCC2)c2sccc2n1 |r|
COc1ccc(CNc2nc(C(=O)NC3CCC3)c3sccc3n2)cn1
COc1ccc(cc1)[C@H](C)Nc1nc(C(=O)NCc2cccnc2)c2sccc2n1 |r|
COc1ccc(CNc2nc(C(=O)NCc3cccnc3)c3sccc3n2)cn1
COc1cccc(CCNC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3ccsc23)c1 |r|
CCO[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
CCOc1ccc(CNc2nc(C(=O)NCCc3cccc(O)c3)c3sccc3n2)cn1
CO[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2c(C)csc12 |r|
CO[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2c(C)csc12 |r|
CCO[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NCc2ccccc2)c2scc(C)c2n1)c1ccccn1 |r|
COc1cccc(CCNC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3c(C)csc23)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2cccc(c2)C#N)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCN(CCc3ccccc3)CC2)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCc2cccc(O)c2)c2scc(C)c2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccccc2O)c2sccc2n1)c1cncc(F)c1 |r|
COc1ncccc1CNC(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
COc1cccc(CNC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3c(C)csc23)n1 |r|
C[C@H](Nc1nc(C(=O)NCc2ccccn2)c2scc(C)c2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(cc2)C(O)=O)c2sccc2n1)c1cncc(F)c1 |r|
CCOc1ccc(CNc2nc(C(=O)N3CCC3)c3sccc3n2)cn1
C[C@H](Nc1nc(C(=O)NCCc2ccc(cc2)S(N)(=O)=O)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(cc2)S(C)(=O)=O)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NC2CCC2)c2scc(C)c2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCc2ccccn2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCc2cccnc2)c2scc(C)c2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2scc(C)c2n1)c1ccccn1 |r|
CCNC(=O)c1nc(NCCc2ccc(O)cc2)nc2ccsc12
C[C@H](Nc1nc(C(=O)NCc2ccccn2)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCc2cccnc2)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCC[C@H]2CCNC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
COc1cccc(CNC(=O)c2nc(N[C@@H](C)c3cccnc3)nc3cc(C)sc23)n1 |r|
COc1ccc(cc1)[C@@H](C)Nc1nc(C(=O)NCc2ccc(OC)nc2)c2sccc2n1 |r|
COc1ccc(cc1)[C@H](C)Nc1nc(C(=O)NCc2ccccn2)c2sccc2n1 |r|
COC[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2cc(C)sc12 |r|
COC[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2cc(C)sc12 |r|
COc1ccc(CNC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3cc(C)sc23)cn1 |r|
COC[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
COC[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C2)NC(=O)OCc2ccccc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](C2)NC(=O)OCc2ccccc2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
COc1ccc(CNC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3ccsc23)cc1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(=O)OC(C)(C)C)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(=O)OC(C)(C)C)C2)c2sc(C)cc2n1)c1ccccn1 |r|
COc1ccc(CNC(=O)c2nc(N[C@@H](C)c3ccccn3)nc3cc(C)sc23)cc1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CN)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CN)C2)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(N)=O)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)N(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(NC(=O)OC(C)(C)C)cc2)c2sccc2n1)c1cncc(F)c1 |r|
COC1(C)CN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)N(C)C(=O)OC(C)(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CN(C2)C(=O)OC(C)(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
COC1(C)CN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NCCC2CCN(CC2)C(=O)OC(C)(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(NC(C)=O)cc2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCC[C@@H]2CCNC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(=O)C(C)(C)C)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C2)NC(=O)OCc2ccccc2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCc2nccs2)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(N)cc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CO)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
CCNC(=O)CC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)NCCC2CCNCC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCc2ccc(NC(C)=O)cc2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(=O)OC(C)(C)C)C2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CN)C2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCC[C@@H]2CCNC2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)NCC[C@H]2CCNC2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CN(C)C)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NC2C[C@H](O)C2)c2sc(C)cc2n1)c1cccnc1 |r,wU:1.0,11.11,(2.62,.23,;2.62,-1.31,;1.29,-2.08,;-.05,-1.31,;-.05,.23,;-1.38,1,;-1.38,2.54,;-2.71,3.31,;-.05,3.31,;1.49,3.31,;2.58,2.22,;3.67,3.31,;5.21,3.31,;2.58,4.39,;-2.71,.23,;-4.18,.7,;-5.08,-.54,;-6.62,-.54,;-4.18,-1.79,;-2.71,-1.31,;-1.38,-2.08,;3.96,-2.08,;3.96,-3.62,;5.29,-4.39,;6.62,-3.62,;6.62,-2.08,;5.29,-1.31,)|
C[C@H](Nc1nc(C(=O)N2CC(C2)C(N)=O)c2sc(C)cc2n1)c1cncc(F)c1 |r|
CCNC(=O)c1ccc(CCNC(=O)c2nc(N[C@@H](C)c3cncc(F)c3)nc3cc(C)sc23)cc1 |r|
CCOC(=O)N(C)C1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)N(C)C(=O)CC(C)(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)N(C)C(C)=O)c2sc(C)cc2n1)c1cncc(F)c1 |r|
CC(C)OC(=O)NC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
CC(C)OC(=O)NC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)CNC(=O)c2ccccc2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C(C)(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
COCC1CN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(CO)C2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CN(C)C)C2)c2sc(C)cc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CC2)c2sccc2n1)c1cncc(F)c1 |r|
COCCC(=O)NC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CCOC2)c2sccc2n1)c1cncc(F)c1 |r|
CCNC(=O)C1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NCCC2CN(C2)C(=O)C(F)(F)F)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CCOC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCC2C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CN(C)C(=O)OC(C)(C)C)C2)c2sccc2n1)c1cncc(F)c1 |r|
CC(C)(C)C(=O)N[C@H]1CCN(C1)C(=O)c1nc(NCc2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(=O)C(C)(C)C)C2)c2sc(C)cc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(C)=O)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(=O)C(C)(C)C)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(C)=O)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNS(C)(=O)=O)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C2)NC(C)=O)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(C)=O)c2sccc2n1)c1ccccn1 |r|
C[C@H](Nc1nc(C(=O)NCC2CCNCC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CN(C)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCN)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCNC(=O)C(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCNS(C)(=O)=O)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)NCCC2CN(C2)C(C)=O)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)N2CCCC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CCCO2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CCC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
CNCC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)NC2CN(C2)C(=O)C(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2ccoc2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)C(=O)NCCO)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCC(C2)C(=O)NC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCC(C2)C(=O)NCC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CN(C)C(=O)CC(C)(C)C)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CN(C)C(=O)C(C)(C)C)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)C(=O)OC(C)(C)C)c2sc(C)cc2n1)c1ccccn1 |r|
COCC1CN(C1)C(=O)c1nc(N[C@@H](C)c2ccccn2)nc2c(C)csc12 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](CN)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
COc1ccc(cc1)[C@H](C)Nc1nc(C(=O)N2CC(C2)NC(=O)OC(C)C)c2sc(C)cc2n1 |r|
COc1ccc(cc1)[C@H](C)Nc1nc(C(=O)N2CC(C2)NC(C)=O)c2sc(C)cc2n1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)CC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
CC(C)C(=O)NC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C(C)(C)C)c2sccc2n1)c1ccccn1 |r|
CN[C@@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
CN[C@H]1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)NCCC2CCN(C)CC2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)C(N)=O)c2sccc2n1)c1cncc(F)c1 |r|
CC(C)C(=O)N1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CCN(C2)C(=O)C(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCN(C2)C(=O)OCC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
COC[C@@H]1CCN1C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
COC[C@H]1CCN1C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
COC[C@@H]1CCN1C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
COC[C@H]1CCN1C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(CC(=O)NC(C)(C)C)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)C(=O)OC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)C(=O)OC(C)(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
CCNC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(CS(C)(=O)=O)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
CNC(=O)NCC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(=O)N(C)C)C2)c2sccc2n1)c1cncc(F)c1 |r|
CC(C)C(=O)NCC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)C(=O)NOC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CC(=O)OC(C)(C)C)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(=O)OCC(C)(C)C)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)OC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCN(C2)C(=O)OC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
CNC(=O)N1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(CNC(=O)CC(C)(C)C)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
CC(C)NC(=O)N1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
CC(C)C(=O)NC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
COCCC(=O)N1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CCN(C2)C(=O)N(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)OCC(C)(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)C(=O)NOC(C)(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
CC(C)NC(=O)N1CCN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2cc(C)sc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H]2C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H]2C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@@H](CN)C2)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2ccoc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2ccccc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CCN(C2)C(=O)NOC(C)(C)C)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2(C)CC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C23CC(C2)C3)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CCCC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C(C)(C)C(F)(F)F)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2COC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2(C)CCOC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2(CC2)C(F)(F)F)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CCCCC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)NC(C)(C)C)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)CCC2CCOCC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2cccc(F)c2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2ccccc2F)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2cccc(Cl)c2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2ccc(F)c(F)c2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2ccc(Cl)cc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)OC2CCCC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2ccncc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2cccnc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C)(C2)NC(=O)C2CC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CCOCC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)NC2CCC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C(C)(C)C)c2scc(C)c2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2cccc(Cl)c2)c2scc(C)c2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2cccc(C)c2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2(C)CCC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC[C@H](C2)C(=O)NOC2CCCC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2ccc(o2)C(F)(F)F)c2sccc2n1)c1cncc(F)c1 |r|
CCC(CC)NC(=O)NC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C23CC4CC(CC(C4)C2)C3)c2sccc2n1)c1cncc(F)c1 |r,TLB:18:19:23:17.22.16,22:17:24:23.21.20,22:21:24:18.17.16,THB:18:17:23:24.19.20|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2ccc(o2)C(F)(F)F)c2sc(C)cc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2cccc(c2)C(F)(F)F)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)Nc2ccccc2)c2sccc2n1)c1cncc(F)c1 |r|
COc1cccc(c1)C(=O)NC1CN(C1)C(=O)c1nc(N[C@@H](C)c2cncc(F)c2)nc2ccsc12 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2(CC2)C#N)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C23CCC(CC2)CC3)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CC(C)(C)C2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CC[C@H](C)CC2)c2sccc2n1)c1cncc(F)c1 |r,wU:1.0,wD:18.19,(.24,-.54,;.24,-2.08,;-1.09,-2.85,;-2.43,-2.08,;-2.43,-.54,;-3.76,.23,;-3.76,1.77,;-5.09,2.54,;-2.43,2.54,;-.94,2.14,;-.54,3.62,;-2.03,4.02,;.79,4.39,;2.13,3.62,;2.13,2.08,;3.46,4.39,;3.46,5.93,;4.8,6.7,;6.13,5.93,;7.46,6.7,;6.13,4.39,;4.8,3.62,;-5.09,-.54,;-6.56,-.07,;-7.46,-1.31,;-6.56,-2.56,;-5.09,-2.08,;-3.76,-2.85,;1.58,-2.85,;2.91,-2.08,;4.24,-2.85,;4.24,-4.39,;2.91,-5.16,;2.91,-6.7,;1.58,-4.39,)|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2CCC(F)(F)CC2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2(C)CC2)c2sccc2n1)c1cncc(Cl)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C(C)(C)C)c2sccc2n1)c1cncc(Cl)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2(CCC2)C(F)(F)F)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)C2(C)CCC2)c2sccc2n1)c1cncc(Cl)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2ccc(cc2)-c2ccccc2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2cc(C)cc(C)c2)c2sccc2n1)c1cncc(F)c1 |r|
C[C@H](Nc1nc(C(=O)N2CC(C2)NC(=O)c2cc(C)oc2C)c2sccc2n1)c1cncc(F)c1 |r|
Cc1cc(cc(n1)C(F)(F)F)-c1c(nc(N)n2cnnc12)-c1ccccc1
Cc1cc(cc(Cl)n1)-c1c(nc(N)n2cnnc12)-c1ccccc1
Cc1ccc(o1)-c1nc(N)n2cnnc2c1-c1cc(C)nc(c1)C(F)(F)F
Nc1nc(-c2ccccc2)c(-c2ccc3[nH]ncc3c2)c2nncn12
Cc1cc(cc(Cl)n1)-c1c(nc(N)n2cnnc12)-c1ccc(F)cc1
Cc1cc(cc(n1)C(F)(F)F)-c1c(nc(N)n2cnnc12)-c1ccc(F)cc1
Cc1cc(cc(n1)C(F)(F)F)-c1c(nc(N)n2cnnc12)-c1ccc(F)cc1F
Cc1cc(cc(C)n1)-c1c(nc(N)n2cnnc12)-c1ccccc1F
Cc1cc(cc(n1)C(F)F)-c1c(nc(N)n2cnnc12)-c1ccc(F)cc1F
Cc1cc(cc(n1)C(F)(F)F)-c1c(nc(N)n2cnnc12)-c1cccc(F)c1
Cc1cc(cc(n1)C1CC1)-c1c(nc(N)n2cnnc12)-c1ccccc1
Cc1cc(cc(n1)C(F)(F)F)-c1c(nc(N)n2cnnc12)-c1ccccc1F
Cc1cc(cc(Cl)n1)-c1c(nc(N)n2cnnc12)-c1ccc(F)cc1F
Cc1cc(cc(Cl)n1)-c1c(nc(N)n2cnnc12)-c1ccc(Cl)cc1F
Cc1cc(cc(CF)n1)-c1c(nc(N)n2cnnc12)-c1ccc(F)cc1
Cc1cc(cc(n1)C(F)F)-c1c(nc(N)n2cnnc12)-c1ccccc1F
Cc1cc(cc(CF)n1)-c1c(nc(N)n2cnnc12)-c1ccccc1F
Cc1cc(cc(n1)C(F)F)-c1c(nc(N)n2cnnc12)-c1ccc(Cl)cc1F
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1ncn(CC(C)(C)O)n1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(C)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C(C)(C)C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C(C)C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(CC(F)(F)F)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(CC(C)(C)O)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(CC(C)(C)O)c1C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cn(CC(C)(C)O)nc1C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(CC2(O)CCC2)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cn(nc1C)C(C)(C)CO |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C(C)C(C)(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)[C@H]1C[C@@](C)(O)C1 |r,wU:30.35,wD:17.19,28.32,30.36,(7.84,-5.43,;6.5,-6.2,;5.17,-5.43,;5.17,-3.89,;3.84,-3.12,;3.84,-1.58,;2.5,-.81,;2.5,.73,;1.17,-1.58,;-.3,-1.1,;-1.2,-2.35,;-.3,-3.6,;1.17,-3.12,;2.5,-3.89,;2.5,-5.43,;3.84,-6.2,;3.84,-7.74,;-2.74,-2.35,;-3.51,-3.68,;-5.05,-3.68,;-5.82,-2.35,;-5.05,-1.02,;-3.51,-1.02,;-5.82,.32,;-7.36,.32,;-7.84,1.78,;-6.59,2.69,;-5.35,1.78,;-6.59,4.23,;-5.5,5.32,;-6.59,6.41,;-7.36,7.74,;-5.82,7.74,;-7.68,5.32,)|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(CC2(C)COC2)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(C2CCOCC2)c1C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cn(nc1C)C1CCOCC1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(C2CCOCC2)c1C(F)F |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cn(nc1C(F)F)C1CCOCC1 |r|
CCn1cc(N2CCC[C@H](C2)c2nc3c4cc(F)c(OC)cc4nc(N)n3n2)c(CO)n1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cn(CC(C)(C)O)nc1C1CC1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1ccc(OC(F)F)nc1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1ccc(OC(C)C)nc1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnc(OC(F)F)c(C)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cc(C)c(=O)n(c1)C(F)F |r|
COc1ccc(cn1)N1CCC[C@H](C1)c1nc2c3cc(F)c(OC)cc3nc(N)n2n1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1nc(C)n(CC(C)(C)O)n1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1cnn(CC(C)(C)O)c1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1cnn(CC(C)(C)O)c1C |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1cn(CC(C)(C)O)nc1C |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1cnn(CC2(O)CCC2)c1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1cnn(c1)C(C)(C)CO |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1ccc(OC(F)F)nc1 |r|
COc1ccc(cn1)N1CCC[C@H](C1)c1nc2c3cc(F)cc(OC)c3nc(N)n2n1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1ccc(OC(C)C)nc1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1ncn(CC(C)(C)O)n1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1nc(C)n(CC(C)(C)O)n1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCN(C1)c1cnn(CC2(O)CCC2)c1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CCCCN(C1)c1cnn(CC(C)(C)O)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(CC2(O)CCC2)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(CC(C)(C)O)c1C
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cn(CC(C)(C)O)nc1C
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(c1)C(C)(C)C(C)(C)O
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(c1)C1CCOCC1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(C2CCOCC2)c1C
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cn(nc1C)C1CCOCC1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(CC2(CF)COC2)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(c1)C(C)C(C)(C)O
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CC[C@H](C)N(C1)c1cnn(c1)C(C)C(C)(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1CC[C@@H](C)N(C1)c1cn(CC2(O)CCC2)nc1C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CC[C@H](C)N(C1)c1cn(CC2(O)CCC2)nc1C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CC(F)CN(C1)c1cnn(CC2(O)CCC2)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CC(F)CN(C1)c1cnn(CC(C)(C)O)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CC(F)CN(C1)c1cnn(c1)C1CCOCC1
COc1cc2nc(N)n3nc(nc3c2cc1F)C12CC1CN(C2)c1cnn(CC2(O)CCC2)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)C12CC1CN(C2)c1cnn(CC(C)(C)O)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1CCCCN(C1)c1cnn(CC(C)(C)O)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCCN(C1)c1cnn(CC(C)(C)O)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)C1(F)CCN(C1)c1cnn(CC(C)(C)O)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1ncn(n1)C(C)C(C)(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CN(CCC1C)c1cnn(CC(C)(C)O)c1
COc1ccc(CNc2nc3c(OC)cc(F)cc3c3nc(nn23)[C@@H]2C[C@H](F)CN(C2)c2cnn(CC(C)(C)O)c2)c(OC)c1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CC(F)CN(C1)c1cn(CC(C)(C)O)nc1C
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CC(F)CN(C1)c1cnn(CC2(O)CCC2)c1
COc1ccc(CNc2nc3c(OC)cc(F)cc3c3nc(nn23)[C@@H]2C[C@@H](F)CN(C2)c2cnn(CC(C)(C)O)c2)c(OC)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1C[C@@H](F)CN(C1)c1cnn(CC(C)(C)O)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1C[C@H](F)CN(C1)c1cnn(CC(C)(C)O)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C1CCC[C@]1(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C1CCC[C@@]1(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C1CCCC1O |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1cn(nc1C)C(C)C(C)(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CC[C@H](C)N(C1)c1cnn(c1)C1CCCC1O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1CC[C@@H](C)N(C1)c1cnn(c1)C1CCCC1O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1C[C@@H](C)CN(C1)C1=NC(CC(C)(C)O)N=C1 |r,c:36,t:28|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1C[C@H](C)CN(C1)C1=NC(CC(C)(C)O)N=C1 |r,c:36,t:28|
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CC(C)CN(C1)C1=NC(CC(C)(C)O)N=C1 |c:36,t:28|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(CCCC(C)=O)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(CCC[C@H](C)O)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(CCC[C@@H](C)O)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1CC[C@@H](C)N(C1)c1cnn(c1)C1CCC(C)(O)CC1 |r,wU:17.19,20.23,(10.86,-26.5,;9.52,-27.27,;8.19,-26.5,;8.19,-24.96,;6.86,-24.19,;6.86,-22.65,;5.52,-21.88,;5.52,-20.34,;4.19,-22.65,;2.72,-22.17,;1.82,-23.42,;2.72,-24.66,;4.19,-24.19,;5.52,-24.96,;5.52,-26.5,;6.86,-27.27,;6.86,-28.81,;.28,-23.42,;-.49,-24.75,;-2.03,-24.75,;-2.8,-23.42,;-4.34,-23.42,;-2.03,-22.08,;-.49,-22.08,;-2.8,-20.75,;-2.18,-19.34,;-3.32,-18.31,;-4.65,-19.08,;-4.33,-20.59,;-6.06,-18.46,;-6.22,-16.93,;-7.63,-16.3,;-8.87,-17.2,;-9.64,-15.87,;-10.41,-17.2,;-8.71,-18.74,;-7.31,-19.36,)|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CC[C@H](C)N(C1)c1cnn(c1)C1CCC(C)(O)CC1 |r,wD:17.19,20.23,(10.86,-26.5,;9.52,-27.27,;8.19,-26.5,;8.19,-24.96,;6.86,-24.19,;6.86,-22.65,;5.52,-21.88,;5.52,-20.34,;4.19,-22.65,;2.72,-22.17,;1.82,-23.42,;2.72,-24.66,;4.19,-24.19,;5.52,-24.96,;5.52,-26.5,;6.86,-27.27,;6.86,-28.81,;.28,-23.42,;-.49,-24.75,;-2.03,-24.75,;-2.8,-23.42,;-4.34,-23.42,;-2.03,-22.08,;-.49,-22.08,;-2.8,-20.75,;-2.18,-19.34,;-3.32,-18.31,;-4.65,-19.08,;-4.33,-20.59,;-6.06,-18.46,;-6.22,-16.93,;-7.63,-16.3,;-8.87,-17.2,;-9.64,-15.87,;-10.41,-17.2,;-8.71,-18.74,;-7.31,-19.36,)|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C1CC[C@]1(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C1CC[C@@]1(C)O |r|
COc1cc(F)cc2c(NNC(=O)C3CCCN(C3)c3cnn(C)c3)nc(N)nc12
Cn1cc(cn1)N1CCCC(C1)c1nc2c3cc(F)c(F)cc3nc(N)n2n1
Cn1cc(cn1)N1CCCC(C1)c1nc2c3cc(F)ccc3nc(N)n2n1
Cn1cc(cn1)N1CCCC(C1)c1nc2c3cc(F)cc(F)c3nc(N)n2n1
COc1cc(Cl)cc2c3nc(nn3c(N)nc12)C1CCCN(C1)c1cnn(C)c1
Cc1cc(Cl)cc2c3nc(nn3c(N)nc12)C1CCCN(C1)c1cnn(C)c1
Cn1cc(cn1)N1CCCC(C1)c1nc2c3cc(Cl)ccc3nc(N)n2n1
Cn1cc(cn1)N1CCCC(C1)c1nc2c3c(F)c(F)ccc3nc(N)n2n1
COc1ccc2nc(N)n3nc(nc3c2c1)C1CCCN(C1)c1cnn(C)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CC[C@H](C)N(C1)c1cnn(CC(C)(C)O)c1 |r|
C[C@H]1CC[C@H](CN1c1cnn(CC(C)(C)O)c1)c1nc2c3cc(F)c(Cl)cc3nc(N)n2n1 |r|
C[C@H]1CC[C@H](CN1c1cnn(CC(C)(C)O)c1)c1nc2c3cc(F)cc(F)c3nc(N)n2n1 |r|
C[C@H]1CC[C@H](CN1c1cnn(CC(C)(C)O)c1)c1nc2c3cc(F)c(C)cc3nc(N)n2n1 |r|
Cn1cc(cn1)N1CCC[C@H](C1)c1nc2c3cc(Cl)cc(Cl)c3nc(N)n2n1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CCC(C)N(C1)c1cn(CC(C)(C)O)nc1C
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CC[C@@H](C)N(C1)c1cn(CC(C)(C)O)nc1C |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CC[C@H](C)N(C1)c1cn(CC(C)(C)O)nc1C |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CCC(C)N(C1)c1cnn(CC(C)(C)O)c1
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CCC(C)N(C1)c1cnn(c1)C(C)(C)CO
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(c1)C(C)(C)CO
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cn(CS(C)(=O)=O)nc1C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1CCCN(C1)c1cn(CS(C)(=O)=O)nc1C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(CS(C)(=O)=O)c1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cn(CS(C)(=O)=O)nc1C(F)F |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1(F)CCCN(C1)c1cnn(CC(C)(C)O)c1
CCC1CCC(CN1c1cnn(CC(C)(C)O)c1)c1nc2c3cc(F)c(OC)cc3nc(N)n2n1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCCN(c2cnn(CC(C)(C)O)c2)C1=O
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1CN(CCO1)c1cn(CC(C)(C)O)nc1C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CN(CCO1)c1cn(CC(C)(C)O)nc1C |r|
COc1cc2nc(F)n3nc(nc3c2cc1F)[C@@H]1CN(CCS1(=O)=O)c1cn(CC(C)(C)O)nc1C |r|
COc1cc2nc(F)n3nc(nc3c2cc1F)[C@H]1CN(CCS1(=O)=O)c1cn(CC(C)(C)O)nc1C |r|
COc1cc2nc(F)n3nc(nc3c2cc1F)[C@@H]1CN(CCS1(=O)=O)c1cnn(CC(C)(C)O)c1C |r|
COc1cc2nc(F)n3nc(nc3c2cc1F)[C@H]1CN(CCS1(=O)=O)c1cnn(CC(C)(C)O)c1C |r|
CCn1cc(cn1)[C@@]1(O)CCCC(C1)c1nc2c3cc(F)c(OC)cc3nc(N)n2n1 |r|
CCn1cc(cn1)[C@]1(O)CCCC(C1)c1nc2c3cc(F)c(OC)cc3nc(N)n2n1 |r|
COc1cccc2c3nc(nn3c(N)nc12)C1CCCC(O)(C1)c1cnn(CC(C)(C)O)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C(C)(C)CO |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(CCC(C)(C)O)c1 |r|
CC(C)(O)Cn1cc(cn1)N1CCC[C@H](C1)c1nc2c3cc(F)c(OC(F)F)cc3nc(N)n2n1 |r|
Cc1nn(CC(C)(C)O)cc1N1CCC[C@H](C1)c1nc2c3cc(F)c(OC(F)F)cc3nc(N)n2n1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CC(C)CN(C1)c1cn(nc1C)C(C)(C)CO
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CC(C)CN(C1)c1cnn(c1)C(C)(C)CO
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1C[C@@H](C)CN(C1)c1cn(CC(C)(C)O)nc1C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1C[C@H](C)CN(C1)c1cn(CC(C)(C)O)nc1C |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CC(C)CN(C1)c1cnn(CC(C)(C)O)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CC(C)CN(C1)c1cn(CC(C)(C)O)nc1C
CC1CC(CN(C1)c1cnn(CC(C)(C)O)c1)c1nc2c3cc(F)cc(F)c3nc(N)n2n1
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CC(C)CN(C1)c1cnn(c1)C(C)(C)CO
CC1CC(CN(C1)c1cn(CC(C)(C)O)nc1C)c1nc2c3cc(F)cc(F)c3nc(N)n2n1
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CC(C)CN(C1)c1cnn(CC(C)(C)O)c1C
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CC(C)CN(C1)c1cn(nc1C)C(C)(C)CO
CC1CC(CN(C1)c1cn(nc1C)C(C)(C)CO)c1nc2c3cc(F)cc(F)c3nc(N)n2n1
CC1CC(CN(C1)c1cnn(c1)C(C)(C)CO)c1nc2c3cc(F)cc(F)c3nc(N)n2n1
CCC(C)(O)Cn1cc(cn1)N1CCC[C@H](C1)c1nc2c3cc(F)c(OC)cc3nc(N)n2n1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1cnn(c1)C(C)C(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C(C)C(C)O |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1cn(nc1C)C(C)C(C)O |r|
CC(O)C(C)n1cc(N2CCC[C@H](C2)c2nc3c4cc(F)cc(F)c4nc(N)n3n2)c(C)n1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1cnn(C(C)C(C)O)c1C |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(C(C)C(C)O)c1C |r|
CC(O)C(C)n1cc(cn1)N1CCC[C@H](C1)c1nc2c3cc(F)cc(F)c3nc(N)n2n1 |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CC(C)CN(C1)c1cn(nc1C)C(C)(C)C(C)O
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CC(C)CN(C1)c1cnn(c1)C(C)C(C)O
CC(O)C(C)n1cc(N2CC(C)CC(C2)c2nc3c4cc(F)cc(F)c4nc(N)n3n2)c(C)n1
CC(O)C(C)n1ncc(N2CC(C)CC(C2)c2nc3c4cc(F)cc(F)c4nc(N)n3n2)c1C
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CC(C)CN(C1)c1cnn(C(C)C(C)O)c1C
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CC(C)CN(C1)c1cn(nc1C)C(C)C(C)O
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1CC[C@@H](C)N(C1)c1cnn(c1)C(C)C(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CC[C@@H](C)N(C1)c1cnn(c1)C(C)C(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1CC[C@H](C)N(C1)c1cnn(c1)C(C)C(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CC[C@H](C)N(C1)c1cnn(c1)C(C)C(C)O |r|
CC(O)C(C)n1cc(cn1)N1CC(CCC1C)c1nc2c3cc(F)cc(F)c3nc(N)n2n1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(c1)C(C)C(C)O
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(CC(C)O)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(c1)C(C)(C)C(C)O |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)[C@H]1CCCN(C1)c1cnn(c1)C(C)(C)C(C)O |r|
COc1cc(F)cc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1cnn(c1)C(C)(C)C(C)O |r|
CC(O)C(C)(C)n1cc(cn1)N1CCC[C@H](C1)c1nc2c3cc(F)cc(F)c3nc(N)n2n1 |r|
C[C@@H]1CC[C@@H](CN1c1cnn(c1)C(C)(CO)CO)c1nc2c3cc(F)cc(F)c3nc(N)n2n1 |r|
C[C@H]1CC[C@H](CN1c1cnn(c1)C(C)(CO)CO)c1nc2c3cc(F)cc(F)c3nc(N)n2n1 |r|
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(c1)C(C)(CO)CO
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(CC(C)(O)CO)c1
CC1CCC(CN1c1cnn(CC(C)(O)CO)c1)c1nc2c3cc(F)cc(F)c3nc(N)n2n1
CC1CCC(CN1c1cnn(CC(C)(CO)CO)c1)c1nc2c3cc(F)cc(F)c3nc(N)n2n1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(CC(C)(C)N)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(c1)C(C)(C)C(C)O
COc1cc(F)cc2c3nc(nn3c(N)nc12)C1CCC(C)N(C1)c1cnn(c1)C(C)(C)C(C)O
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CCC(C)N(C1)c1cnn(CC2(O)CC2)c1
COc1cc2nc(N)n3nc(nc3c2cc1F)C1CC(C)CN(C1)c1cnn(CC(C)(C)O)c1C
Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)c2nn(Cc3ccccn3)cc12
CCn1nccc1-c1c(nc(N)c2cn(Cc3ccccn3)nc12)-c1cccc(c1)C#N |(3.64,3.41,;2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,)|
Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)c2nn(Cc3ncccc3F)cc12
Cn1ccc(Cn2cc3c(N)nc(-c4cccc(c4)C#N)c(-c4ccncn4)c3n2)n1
Nc1nc(-c2cccc(c2)C#N)c(-c2ccncc2)c2nn(Cc3ccccn3)cc12
Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)c2nn(Cc3ccccc3F)cc12
Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)c2cn(Cc3ccccn3)nc12
CCn1nccc1-c1c(nc(N)c2nn(Cc3ccccn3)cc12)-c1cccc(c1)C#N |(3.69,3.35,;2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,)|
Cc1cccc(Cn2cc3c(-c4ccncn4)c(nc(N)c3n2)-c2cccc(c2)C#N)n1
CCn1nccc1-c1c(nc(N)c2nn(Cc3cccc(C)n3)cc12)-c1cccc(c1)C#N |(2.92,3.35,;1.78,2.32,;.32,2.8,;-.16,4.26,;-1.7,4.26,;-2.18,2.8,;-.93,1.9,;-.93,.36,;-2.26,-.41,;-2.26,-1.95,;-.93,-2.72,;-.93,-4.26,;.4,-1.95,;1.87,-2.43,;2.77,-1.18,;4.31,-1.18,;5.08,.15,;4.31,1.48,;5.08,2.82,;6.62,2.82,;7.39,1.48,;8.93,1.48,;6.62,.15,;1.87,.06,;.4,-.41,;-3.6,.36,;-3.6,1.9,;-4.93,2.67,;-6.27,1.9,;-6.27,.36,;-4.93,-.41,;-7.6,-.41,;-8.93,-1.18,)|
Cc1ncoc1-c1c(nc(N)c2nn(Cc3ccccn3)cc12)-c1cccc(c1)C#N |(2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,)|
Cc1ncoc1-c1c(nc(N)c2nn(Cc3cccc(C)n3)cc12)-c1cccc(c1)C#N |(1.78,2.32,;.32,2.8,;-.16,4.26,;-1.7,4.26,;-2.18,2.8,;-.93,1.9,;-.93,.36,;-2.26,-.41,;-2.26,-1.95,;-.93,-2.72,;-.93,-4.26,;.4,-1.95,;1.87,-2.43,;2.77,-1.18,;4.31,-1.18,;5.08,.15,;4.31,1.48,;5.08,2.82,;6.62,2.82,;7.39,1.48,;8.93,1.48,;6.62,.15,;1.87,.06,;.4,-.41,;-3.6,.36,;-3.6,1.9,;-4.93,2.67,;-6.27,1.9,;-6.27,.36,;-4.93,-.41,;-7.6,-.41,;-8.93,-1.18,)|
CCn1nccc1-c1c(nc(N)c2nn(Cc3ncccc3F)cc12)-c1cccc(c1)C#N |(3.64,3.41,;2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;7.39,.15,;8.16,1.48,;7.39,2.82,;5.85,2.82,;5.08,1.48,;3.54,1.48,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,)|
Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)c2nn(Cc3ccccn3)nc12
Cc1ncoc1-c1c(nc(N)c2nn(Cc3ccccn3)nc12)-c1cccc(c1)C#N |(2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,)|
CCn1nccc1-c1c(nc(N)c2nn(Cc3ccccn3)nc12)-c1cccc(c1)C#N |(3.64,3.41,;2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,)|
Cc1cnccc1-c1c(nc(N)c2nn(Cc3ccccn3)nc12)-c1cccc(c1)C#N |(2.51,1.54,;1.17,2.31,;1.17,3.85,;-.16,4.62,;-1.49,3.85,;-1.49,2.31,;-.16,1.54,;-.16,,;-1.49,-.77,;-1.49,-2.31,;-.16,-3.08,;-.16,-4.62,;1.17,-2.31,;2.64,-2.79,;3.54,-1.54,;5.08,-1.54,;5.85,-.21,;5.08,1.13,;5.85,2.46,;7.39,2.46,;8.16,1.13,;7.39,-.21,;2.64,-.29,;1.17,-.77,;-2.83,,;-2.83,1.54,;-4.16,2.31,;-5.5,1.54,;-5.5,,;-4.16,-.77,;-6.83,-.77,;-8.16,-1.54,)|
Cc1nc(CO)c(o1)-c1c(nc(N)c2nn(Cc3ccccn3)nc12)-c1cccc(c1)C#N |(-1.84,4.89,;-.93,3.64,;.61,3.64,;1.09,2.18,;2.55,1.7,;3.64,2.79,;-.16,1.27,;-1.41,2.18,;-.16,-.27,;-1.49,-1.04,;-1.49,-2.58,;-.16,-3.35,;-.16,-4.89,;1.17,-2.58,;2.64,-3.05,;3.54,-1.81,;5.08,-1.81,;5.85,-.47,;5.08,.86,;5.85,2.19,;7.39,2.19,;8.16,.86,;7.39,-.47,;2.64,-.56,;1.17,-1.04,;-2.83,-.27,;-2.83,1.27,;-4.16,2.04,;-5.5,1.27,;-5.5,-.27,;-4.16,-1.04,;-6.83,-1.04,;-8.16,-1.81,)|
Nc1nc(-c2cccc(c2)C#N)c(-c2cnco2)c2nn(Cc3ccccn3)nc12
Nc1nc(-c2cccc(c2)C#N)c(-c2ccc3ncccc3c2)c2nn(Cc3ccccn3)nc12
Nc1nc(-c2cccc(c2)C#N)c(-c2ccc3nccnc3c2)c2nn(Cc3ccccn3)nc12
Cc1cccc(Cn2nc3c(N)nc(-c4cccc(c4)C#N)c(-c4ccncn4)c3n2)n1
Cc1cccc(Cn2nc3c(N)nc(-c4cccc(c4)C#N)c(-c4ccncc4)c3n2)n1
Cc1cccc(Cn2nc3c(N)nc(-c4cccc(c4)C#N)c(-c4ccncc4C)c3n2)n1 |(8.93,1.13,;7.39,1.13,;6.62,2.46,;5.08,2.46,;4.31,1.13,;5.08,-.21,;4.31,-1.54,;2.77,-1.54,;1.87,-2.79,;.4,-2.31,;-.93,-3.08,;-.93,-4.62,;-2.26,-2.31,;-2.26,-.77,;-3.6,,;-3.6,1.54,;-4.93,2.31,;-6.27,1.54,;-6.27,,;-4.93,-.77,;-7.6,-.77,;-8.93,-1.54,;-.93,,;-.93,1.54,;-2.26,2.31,;-2.26,3.85,;-.93,4.62,;.4,3.85,;.4,2.31,;1.74,1.54,;.4,-.77,;1.87,-.29,;6.62,-.21,)|
Cc1cccc(Cn2nc3c(N)nc(-c4cccc(c4)C#N)c(-c4ccc(=O)n(C)c4)c3n2)n1
CCn1nccc1-c1c(nc(N)c2nn(Cc3cccc(C)n3)nc12)-c1cccc(c1)C#N |(2.87,3.41,;1.78,2.32,;.32,2.8,;-.16,4.26,;-1.7,4.26,;-2.18,2.8,;-.93,1.9,;-.93,.36,;-2.26,-.41,;-2.26,-1.95,;-.93,-2.72,;-.93,-4.26,;.4,-1.95,;1.87,-2.43,;2.77,-1.18,;4.31,-1.18,;5.08,.15,;4.31,1.48,;5.08,2.82,;6.62,2.82,;7.39,1.48,;8.93,1.48,;6.62,.15,;1.87,.06,;.4,-.41,;-3.6,.36,;-3.6,1.9,;-4.93,2.67,;-6.27,1.9,;-6.27,.36,;-4.93,-.41,;-7.6,-.41,;-8.93,-1.18,)|
Cc1ncoc1-c1c(nc(N)c2nn(Cc3cccc(C)n3)nc12)-c1cccc(c1)C#N |(1.78,2.32,;.32,2.8,;-.16,4.26,;-1.7,4.26,;-2.18,2.8,;-.93,1.9,;-.93,.36,;-2.26,-.41,;-2.26,-1.95,;-.93,-2.72,;-.93,-4.26,;.4,-1.95,;1.87,-2.43,;2.77,-1.18,;4.31,-1.18,;5.08,.15,;4.31,1.48,;5.08,2.82,;6.62,2.82,;7.39,1.48,;8.93,1.48,;6.62,.15,;1.87,.06,;.4,-.41,;-3.6,.36,;-3.6,1.9,;-4.93,2.67,;-6.27,1.9,;-6.27,.36,;-4.93,-.41,;-7.6,-.41,;-8.93,-1.18,)|
Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)c2nn(Cc3ncccc3F)nc12
Nc1nc(-c2cccc(c2)C#N)c(-c2ccncc2)c2nn(Cc3ncccc3F)nc12
Cn1cc(ccc1=O)-c1c(nc(N)c2nn(Cc3ncccc3F)nc12)-c1cccc(c1)C#N
CCn1nccc1-c1c(nc(N)c2nn(Cc3ncccc3F)nc12)-c1cccc(c1)C#N |(3.64,3.41,;2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;7.39,.15,;8.16,1.48,;7.39,2.82,;5.85,2.82,;5.08,1.48,;3.54,1.48,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,)|
CC(C)n1nccc1-c1c(nc(N)c2nn(Cc3ncccc3F)nc12)-c1cccc(c1)C#N |(2.87,.82,;2.55,2.32,;3.69,3.35,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;8.16,-1.18,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,)|
Cn1nccc1-c1c(nc(N)c2nn(Cc3ncccc3F)nc12)-c1cccc(c1)C#N |(2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;7.39,.15,;8.16,1.48,;7.39,2.82,;5.85,2.82,;5.08,1.48,;3.54,1.48,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,)|
Cc1ncoc1-c1c(nc(N)c2nn(Cc3ncccc3F)nc12)-c1cccc(c1)C#N |(2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;7.39,.15,;8.16,1.48,;7.39,2.82,;5.85,2.82,;5.08,1.48,;3.54,1.48,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,)|
Nc1nc(-c2cccc(c2)C#N)c(-c2ccc3nccnc3c2)c2nn(Cc3ncccc3F)nc12
CCn1nccc1-c1c(nc(N)c2nn(Cc3ccccn3)nc12)-c1cccc(C#N)c1F |(3.69,3.35,;2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-6.83,-.41,;-8.16,-1.18,;-4.16,-.41,;-4.16,-1.95,)|
Cn1nccc1-c1c(nc(N)c2nn(Cc3ccccn3)nc12)-c1cccc(C#N)c1F |(2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-6.83,-.41,;-8.16,-1.18,;-4.16,-.41,;-4.16,-1.95,)|
CC(C)n1nccc1-c1c(nc(N)c2nn(Cc3ccccn3)nc12)-c1cccc(C#N)c1F |(3.69,3.35,;2.55,2.32,;2.87,.82,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-6.83,-.41,;-8.16,-1.18,;-4.16,-.41,;-4.16,-1.95,)|
Cc1ncoc1-c1c(nc(N)c2nn(Cc3ccccn3)nc12)-c1cccc(C#N)c1F |(2.55,2.32,;1.09,2.8,;.61,4.26,;-.93,4.26,;-1.41,2.8,;-.16,1.9,;-.16,.36,;-1.49,-.41,;-1.49,-1.95,;-.16,-2.72,;-.16,-4.26,;1.17,-1.95,;2.64,-2.43,;3.54,-1.18,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;2.64,.06,;1.17,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-6.83,-.41,;-8.16,-1.18,;-4.16,-.41,;-4.16,-1.95,)|
Cc1nc(CO)c(o1)-c1c(nc(N)c2nn(Cc3ccccn3)nc12)-c1cccc(C#N)c1F |(-1.84,4.89,;-.93,3.64,;.61,3.64,;1.09,2.18,;2.55,1.7,;3.69,2.73,;-.16,1.27,;-1.41,2.18,;-.16,-.27,;-1.49,-1.04,;-1.49,-2.58,;-.16,-3.35,;-.16,-4.89,;1.17,-2.58,;2.64,-3.05,;3.54,-1.81,;5.08,-1.81,;5.85,-.47,;5.08,.86,;5.85,2.19,;7.39,2.19,;8.16,.86,;7.39,-.47,;2.64,-.56,;1.17,-1.04,;-2.83,-.27,;-2.83,1.27,;-4.16,2.04,;-5.5,1.27,;-5.5,-.27,;-6.83,-1.04,;-8.16,-1.81,;-4.16,-1.04,;-4.16,-2.58,)|
Nc1nc(-c2cccc(C#N)c2F)c(-c2ccc3nccnc3c2)c2nn(Cc3ccccn3)nc12
Cn1ccc(Cn2nc3c(N)nc(-c4cccc(c4)C#N)c(-c4ccncn4)c3n2)n1
Cc1ncoc1-c1c(nc(N)c2nn(Cc3ccn(C)n3)nc12)-c1cccc(c1)C#N |(2.08,2.32,;.61,2.8,;.13,4.26,;-1.41,4.26,;-1.88,2.8,;-.64,1.9,;-.64,.36,;-1.97,-.41,;-1.97,-1.95,;-.64,-2.72,;-.64,-4.26,;.7,-1.95,;2.16,-2.43,;3.07,-1.18,;4.61,-1.18,;5.38,.15,;4.75,1.56,;5.9,2.59,;7.23,1.82,;8.64,2.44,;6.91,.31,;2.16,.06,;.7,-.41,;-3.3,.36,;-3.3,1.9,;-4.64,2.67,;-5.97,1.9,;-5.97,.36,;-4.64,-.41,;-7.3,-.41,;-8.64,-1.18,)|
CC(c1ccccn1)n1nc2c(N)nc(-c3cccc(c3)C#N)c(-c3ocnc3C)c2n1 |(5.85,-2.52,;5.08,-1.18,;5.85,.15,;5.08,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;3.54,-1.18,;2.64,-2.43,;1.17,-1.95,;-.16,-2.72,;-.16,-4.26,;-1.49,-1.95,;-1.49,-.41,;-2.83,.36,;-2.83,1.9,;-4.16,2.67,;-5.5,1.9,;-5.5,.36,;-4.16,-.41,;-6.83,-.41,;-8.16,-1.18,;-.16,.36,;-.16,1.9,;-1.41,2.8,;-.93,4.26,;.61,4.26,;1.09,2.8,;2.55,2.32,;1.17,-.41,;2.64,.06,)|
CC(c1ccccn1)n1nc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncn3)c2n1
Cc1ncoc1-c1c(nc(N)c2nn(CCc3ccccn3)nc12)-c1cccc(c1)C#N |(1.47,2.32,;.01,2.8,;-.47,4.26,;-2.01,4.26,;-2.48,2.8,;-1.24,1.9,;-1.24,.36,;-2.57,-.41,;-2.57,-1.95,;-1.24,-2.72,;-1.24,-4.26,;.1,-1.95,;1.56,-2.43,;2.47,-1.18,;4.01,-1.18,;4.78,.15,;6.26,.55,;7.35,-.54,;8.84,-.14,;9.24,1.34,;8.15,2.43,;6.66,2.03,;1.56,.06,;.1,-.41,;-3.9,.36,;-3.9,1.9,;-5.24,2.67,;-6.57,1.9,;-6.57,.36,;-5.24,-.41,;-7.91,-.41,;-9.24,-1.18,)|
Cc1ncoc1-c1c(nc(N)c2nn(CCc3ccccn3)nc12)-c1cccc(C#N)c1F |(1.47,2.32,;.01,2.8,;-.47,4.26,;-2.01,4.26,;-2.48,2.8,;-1.24,1.9,;-1.24,.36,;-2.57,-.41,;-2.57,-1.95,;-1.24,-2.72,;-1.24,-4.26,;.1,-1.95,;1.56,-2.43,;2.47,-1.18,;4.01,-1.18,;4.78,.15,;6.26,.55,;7.35,-.54,;8.84,-.14,;9.24,1.34,;8.15,2.43,;6.66,2.03,;1.56,.06,;.1,-.41,;-3.9,.36,;-3.9,1.9,;-5.24,2.67,;-6.57,1.9,;-6.57,.36,;-7.91,-.41,;-9.24,-1.18,;-5.24,-.41,;-5.24,-1.95,)|
CN(C)CCc1c[nH]c2c1c(ccc2)O
COc1cc(c(OC)cc1C1CCCNC1)C(F)(F)F
Cc1ccc(o1)-c1nc(N)cc2nc(C)nn12
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(C)o3)n2n1
COc1ccc(Cc2nc3cc(N)nc(-c4ccc(C)o4)n3n2)cc1
COc1ccc(Cc2nc3cc(NC(=O)C4CC4)nc(-c4ccc(C)o4)n3n2)cc1
CCC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccc(C)o1
Cc1nc2cc(NC(=O)C(C)(C)C)nc(-c3ccc(C)o3)n2n1
CCc1nc2cc(N)nc(-c3ccc(C)o3)n2n1
CCc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(C)o3)n2n1
Cc1nc2cc(NC(=O)C3CCC3)nc(-c3ccc(C)o3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3ccc(C)o3)n2n1
CC(C)c1nc2cc(NC(=O)C3CC3)nc(-c3ccc(C)o3)n2n1
CC(C)c1nc2cc(N)nc(-c3ccc(C)o3)n2n1
Cc1nc2cc(NC(=O)C3CNC3)nc(-c3ccc(C)o3)n2n1
Cc1nc2c(Cl)c(NC(=O)C3CC3)nc(-c3ccc(C)o3)n2n1
Cc1nc2c(Br)c(N)nc(-c3ccc(C)o3)n2n1
CN1CC(C1)C(=O)Nc1cc2nc(C)nn2c(n1)-c1ccc(C)o1
Cc1nc2c(C)c(NC(=O)C3CC3)nc(-c3ccc(C)o3)n2n1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cc2nc(nn12)C(F)(F)F
Cc1ccc(o1)-c1nc(N)cc2nc(nn12)C(F)(F)F
CNc1nc(-c2ccc(C)o2)n2nc(C)nc2c1Cl
CN(C)c1nc(-c2ccc(C)o2)n2nc(C)nc2c1Cl
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccc(C)o1
Cc1nc2c(C#N)c(N)nc(-c3ccc(C)o3)n2n1
Cc1nc2c3sc(=O)[nH]c3nc(-c3ccc(C)o3)n2n1
Cc1nc2c3c(NCC3(C)C)nc(-c3ccc(C)o3)n2n1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccco3)n2n1
Cc1nc2c(F)c(N)nc(-c3ccc(C)o3)n2n1
Cc1nc2c(C(N)=O)c(N)nc(-c3ccc(C)o3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3ccccc3)n2n1
CC(C)c1nc2cc(NC(C)=O)nc(-c3ccc(C)o3)n2n1
Cc1nc2c3cc[nH]c3nc(-c3ccc(C)o3)n2n1
CC(C)c1nc2c3c(NCC3(C)C)nc(-c3ccc(C)o3)n2n1
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccco1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(o3)C3CC3)n2n1
Cc1nc2c(F)c(NC(=O)C3CC3)nc(-c3ccc(C)o3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3ccc(C)s3)n2n1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccc(C)o1)C(F)(F)F
Cc1ccc(o1)-c1nc(N)c(Cl)c2nc(nn12)C(F)(F)F
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(o3)C(C)(C)C)n2n1
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1cnc(C)o1
Cc1nc2c3cc(C)[nH]c3nc(-c3ccc(C)o3)n2n1
Cc1ccc(o1)-c1nc(N)c(C#N)c2nc(nn12)C(F)(F)F
CC(C)c1nc2cc(NC(C)=O)nc(-c3cnc(C)o3)n2n1
CC(C)c1nc2cc(NC(C)=O)nc(-c3ccco3)n2n1
CC(C)c1nc2cc(NC(C)=O)nc(-c3cnco3)n2n1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cc2nc(nn12)C1CCOC1
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1cnco1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(Br)o3)n2n1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3cccc(c3)C#N)n2n1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cc2nc(nn12)C1CCOCC1
CC(C)c1ccc(o1)-c1nc(NC(=O)C2CC2)cc2nc(C)nn12
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(cc3)C#N)n2n1
Cc1nc2c(Cl)c(N)nc(-c3cncc(C)c3)n2n1
CC(C)c1nc2cc(NC(=O)C3CC3)nc(-c3ccco3)n2n1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccco1)C(F)(F)F
Cc1nc2cc(NC(=O)C3COC3)nc(-c3ccc(C)o3)n2n1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccc(C)o1)C1CC1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cc2nc(nn12)C1CC1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccc(C)o1)C1CCC1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cc2nc(nn12)C1CCC1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccc(C)o1)C1CCCC1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cc2nc(nn12)C1CCCC1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cc2nc(nn12)-c1ccco1
FC(F)(F)c1nc2cc(NC(=O)C3CC3)nc(-c3ccco3)n2n1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(o3)C(F)(F)F)n2n1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3cnn(C)c3)n2n1
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1cnn(C)c1
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccoc1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccoc3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3ccccn3)n2n1
CC(C)c1nc2c3cc(C)[nH]c3nc(-c3ccc(C)o3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3cccc(C)n3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3ccc(Cl)cc3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3cccc(Cl)c3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3ccncc3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3ccc(F)cc3)n2n1
CC(C)c1nc2c3cc(C)[nH]c3nc(-c3ccco3)n2n1
Cc1cc2c(nc(-c3ccco3)n3nc(nc23)C(F)(F)F)[nH]1
Cc1nc2c(Br)c(N)nc(-c3ccc(F)cc3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3ccccc3Cl)n2n1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(F)o3)n2n1
CC(C)c1nc2c(Cl)c(N)nc(-c3ccccc3)n2n1
Nc1nc(-c2ccccc2)n2nc(nc2c1Cl)C(F)(F)F
Cc1cc2c(nc(-c3ccc(C)o3)n3nc(nc23)C(F)(F)F)[nH]1
Cc1nc2c(Br)c(N)nc(-c3ccccc3)n2n1
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccc(Br)o1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccco1)C1COC1
O=C(Nc1cc2nc(nn2c(n1)-c1ccco1)C1COC1)C1CC1
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1cccc(c1)C(C)=O
CC(=O)c1cccc(c1)-c1nc(NC(=O)OC(C)(C)C)cc2nc(C)nn12
CC(=O)c1cccc(c1)-c1nc(N)cc2nc(C)nn12
CC(=O)c1cccc(c1)-c1nc(NC(=O)C2CC2)cc2nc(C)nn12
Cc1nc2c3CC(=O)Nc3nc(-c3ccc(C)o3)n2n1
CC(C)c1nc2c3CC(=O)Nc3nc(-c3ccc(C)o3)n2n1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(cc3)S(C)(=O)=O)n2n1
Cc1nc2cc(NC(=O)OC(C)(C)C)nc(-c3ccc(cc3)S(C)(=O)=O)n2n1
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccc(cc1)S(C)(=O)=O
Cc1nc2c3cn[nH]c3nc(-c3ccc(C)o3)n2n1
Cc1nc2cc(NC(=O)N3CCCC3)nc(-c3ccco3)n2n1
Cc1nc2cc(NC(=O)N3CC[C@@H](O)C3)nc(-c3ccco3)n2n1 |r|
CC(=O)c1cccc(c1)-c1nc(N)c(Cl)c2nc(C)nn12
Cc1nc2cc(N)nc(-c3ccc(cc3)S(C)(=O)=O)n2n1
Cc1nc2cc(NC(=O)N3CC[C@H](O)C3)nc(-c3ccco3)n2n1 |r|
CNC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccco1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccc(C)o1)C1COC1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cc2nc(nn12)C1COC1
COc1ccc(cc1)-c1nc(NC(=O)C2CC2)cc2nc(C)nn12
COc1ccc(cc1)-c1nc(NC(=O)OC(C)(C)C)cc2nc(C)nn12
COc1ccc(cc1)-c1nc(NC(C)=O)cc2nc(C)nn12
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(cc3)S(N)(=O)=O)n2n1
COc1ccc(cc1)-c1nc(N)cc2nc(C)nn12
CN(C)S(=O)(=O)c1ccc(cc1)-c1nc(NC(=O)C2CC2)cc2nc(C)nn12
CN(C)S(=O)(=O)c1ccc(cc1)-c1nc(NC(C)=O)cc2nc(C)nn12
CN(C)S(=O)(=O)c1ccc(cc1)-c1nc(NC(=O)OC(C)(C)C)cc2nc(C)nn12
CN(C)S(=O)(=O)c1ccc(cc1)-c1nc(N)cc2nc(C)nn12
CC(C)c1nc2c3nc(C)[nH]c3nc(-c3ccc(C)o3)n2n1
CC(C)c1nc2c3cn[nH]c3nc(-c3ccc(C)o3)n2n1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccco1)C1CNC1
O=C(Nc1cc2nc(nn2c(n1)-c1ccco1)C1CNC1)C1CC1
Cc1nc2cc(NC(=O)OC(C)(C)C)nc(-c3ccc(cc3)S(O)(=O)=O)n2n1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(cc3)S(O)(=O)=O)n2n1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccc(C)o1)C(F)F
CC(=O)Nc1cc2nc(CF)nn2c(n1)-c1ccc(C)o1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3ccc(F)c(F)c3)n2n1
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccc(F)c(F)c1
Cc1nc2cc(N)nc(-c3ccc(F)c(F)c3)n2n1
Cc1nc2cc(NC(=O)C3CC3)nc(-c3cccc(F)c3)n2n1
CC(=O)Nc1cc2nc(C)nn2c(n1)-c1cccc(F)c1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccco1)C(F)F
Cc1nc2c3cc([nH]c3nc(-c3ccc(C)o3)n2n1)C(C)(C)O
CN1CC(C1)c1nc2cc(NC(=O)C3CC3)nc(-c3ccco3)n2n1
Cc1ccc(o1)-c1nc2ncccc2c2nc(C)nn12
Cc1nc2c3cccnc3nc(-c3ccco3)n2n1
Nc1nc(-c2ccccc2)n2nc(CF)nc2c1Cl
CC(=O)Nc1cc2nc(CF)nn2c(n1)-c1ccco1
CNC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccc(F)c(F)c1
Cc1nc2c(Cl)c(N)nc(-c3ccc(F)c(F)c3)n2n1
Cc1nc2cc(N)nc(-c3cccc(F)c3)n2n1
Cc1nc2cc(NC(=O)C(F)(F)F)nc(-c3ccco3)n2n1
Cc1nc2cc(NC(=O)C(F)F)nc(-c3ccco3)n2n1
Cc1nc2cc(NC(=O)CF)nc(-c3ccco3)n2n1
Cc1nc2c(Cl)c(N)nc(-c3cccc(F)c3)n2n1
Cc1ccc(o1)-c1nc2[nH]c(cc2c2nc(nn12)C(F)(F)F)C(C)(C)O
FC(F)c1nc2cc(NC(=O)C3CC3)nc(-c3ccco3)n2n1
FCc1nc2cc(NC(=O)C3CC3)nc(-c3ccco3)n2n1
CC(=O)Nc1cc2nc(nn2c(n1)-c1ccc(C)o1)C1CNC1
CN1CC(C1)c1nc2cc(NC(C)=O)nc(-c3ccco3)n2n1
Cc1nc2cc(NC(N)=O)nc(-c3ccco3)n2n1
Cc1ccc(o1)-c1nc2[nH]ncc2c2nc(nn12)C(F)(F)F
CCCNC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccco1
CCNC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccco1
CC(C)CNC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccco1
Cc1nc2cc(NC(=O)NCCN3CCCC3)nc(-c3ccco3)n2n1
Cc1nc2cc(NC(=O)NCCN3CCCCC3)nc(-c3ccco3)n2n1
Cc1nc2cc(NC(=O)NCCN3CCOCC3)nc(-c3ccco3)n2n1
Nc1nc(-c2ccccc2)n2nc(nc2c1Cl)C(F)F
Cc1nc2c3nc([nH]c3nc(-c3ccc(C)o3)n2n1)C(F)(F)F
CC(C)c1nc2c3cc([nH]c3nc(-c3ccc(C)o3)n2n1)C(C)(C)O
CC(C)NC(=O)Nc1cc2nc(C)nn2c(n1)-c1ccco1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cc2nc(nn12)C1CNC1
Cc1nc2c3nc([nH]c3nc(-c3ccco3)n2n1)C(F)(F)F
Cc1ccc(o1)-c1nc(N)cn2ncnc12
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2ncnc12
Cc1ccc(o1)-c1nc(N)cn2nc(C)nc12
Cc1nc2c(nc(NC(=O)C3CC3)cn2n1)-c1ccc(C)o1
Cc1nc2c(nc(N)c(Cl)n2n1)-c1ccc(F)cc1
Cc1nc2c(nc(N)c(Br)n2n1)-c1ccc(F)cc1
Cc1nc2c(nc(N)c(Br)n2n1)-c1ccccc1
CC(C)c1nc2c(nc(NC(=O)C3CC3)cn2n1)-c1ccc(C)o1
CC(=O)Nc1cn2nc(C)nc2c(n1)-c1ccc(C)o1
Cc1nc2c(nc(N)c(Cl)n2n1)-c1ccc(C)o1
CC(C)c1nc2c(nc(N)c(Cl)n2n1)-c1ccccc1
Nc1nc(-c2ccccc2)c2nc(nn2c1Cl)C(F)(F)F
CC(=O)Nc1cn2nc(C)nc2c(n1)-c1ccco1
Cc1nc2c(nc(NC(=O)C3CC3)cn2n1)-c1ccco1
CC(C)c1nc2c(nc(NC(=O)C3CC3)cn2n1)-c1ccco1
Cc1nc2c(nc(N)c(Cl)n2n1)-c1ccccc1C
Cc1nc2c(nc(N)c(Cl)n2n1)-c1cccc(C)c1
Cc1nc2c(nc(N)c(Cl)n2n1)-c1ccc(C)cc1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2nc(nc12)C(F)F
Nc1nc2c(nc(NC(=O)C3CC3)cn2n1)-c1ccco1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2nc(N)nc12
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2nc(Br)nc12
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2nc(nc12)C(F)(F)F
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2nc(CF)nc12
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2ccnc12
Cc1ccc(o1)-c1nc(N)cn2cc(nc12)C(F)(F)F
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2c(C)cnc12
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2cc(nc12)C(F)(F)F
Cc1ccc(o1)-c1nc(N)cn2c(C)cnc12
Cc1cn2cc(NC(=O)C3CC3)nc(-c3ccc(C)o3)c2n1
Cc1cn2cc(N)nc(-c3ccc(C)o3)c2n1
Cc1cn2c(Cl)c(N)nc(-c3ccccc3)c2n1
Cc1cn2c(Cl)c(N)nc(-c3ccc(F)cc3)c2n1
Cc1cn2c(Br)c(N)nc(-c3ccccc3)c2n1
Nc1nc(-c2ccccc2)c2nc(cn2c1Cl)C(F)(F)F
CC(=O)Nc1cn2cc(C)nc2c(n1)-c1ccc(C)o1
Cc1cn2c(Br)c(N)nc(-c3ccc(F)cc3)c2n1
Cc1cn2c(Cl)c(N)nc(-c3cccc(C)c3)c2n1
Cc1cn2cc(NC(=O)C3CC3)nc(-c3ccco3)c2n1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2cc(CO)nc12
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cn2cc(CF)nc12
CC(=O)Nc1cn2cc(C)nc2c(n1)-c1ccco1
CC(C)c1cn2cc(NC(=O)C3CC3)nc(-c3ccco3)c2n1
CC(C)c1cn2c(Cl)c(N)nc(-c3ccccc3)c2n1
Cc1cn2c(Cl)c(N)nc(-c3ccc(C)cc3)c2n1
CC(C)c1cn2cc(NC(=O)C3CC3)nc(-c3ccc(C)o3)c2n1
Cc1cn2c(Cl)c(N)nc(-c3ccccc3C)c2n1
CNC(=O)Nc1cn2cc(C)nc2c(n1)-c1ccco1
COC(=O)Nc1cn2cc(C)nc2c(n1)-c1ccco1
CCOC(=O)Nc1cn2cc(C)nc2c(n1)-c1ccco1
CCC(=O)Nc1cn2cc(C)nc2c(n1)-c1ccco1
Cc1cn2cc(NC(=O)C(F)F)nc(-c3ccco3)c2n1
CCCC(=O)Nc1cn2cc(C)nc2c(n1)-c1ccco1
CCNC(=O)Nc1cn2cc(C)nc2c(n1)-c1ccco1
Cc1cn2cc(NS(C)(=O)=O)nc(-c3ccco3)c2n1
CCS(=O)(=O)Nc1cn2cc(C)nc2c(n1)-c1ccco1
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCOCC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCC(C2)C(C)(C)O)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCC[C@@H]2C(C)(C)O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCNCC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCCC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCCC2CC(C)(C)O)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCOCC2C(C)(C)O)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCN[C@@H](C2)C(O)=O)nc1-c1cccc(c1)C#N |r|
CN1CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(Cl)c1)-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCC(C)(O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCC(C)(CC2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCN[C@@H](C2)C(C)(C)O)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCN[C@H](C2)C(C)(C)O)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCN(CC2)C2COC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCS(=N)(=O)CC2)nc1-c1cccc(c1)C#N
CN1CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCS(=N)(=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN(CCO)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN(CC2)C2COC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@H](O)C2)nc1-c1cccc(c1)C#N |r|
COCC1(CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(F)(CC2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@@H](C2)C#N)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC(C)(O)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@H](C2)C#N)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3CCOCC3C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCNC(=O)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCOC(C2)C(N)=O)nc1-c1cccc(c1)C#N
CN1CCN(CC1=O)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCO[C@@H](CO)C2)nc1-c1cccc(c1)C#N |r|
CC(=O)N1CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN(CC2)S(C)(=O)=O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CC2)NC(=O)NC3=O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCO[C@H](CO)C2)nc1-c1cccc(c1)C#N |r|
COC1(CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CO)(CC2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCS(=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC(CO)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC(C2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCS(=O)(=O)CC2)nc1-c1cccc(c1)C#N
CN1C(=O)N(C)C2(CCN(CC2)C(=O)Nc2nc(c(s2)-c2cc(C)nc(C)c2)-c2cccc(c2)C#N)C1=O
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)C(N)=O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC(O)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN(CCO)C(=O)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)(C#N)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC(C2)C(C)(C)O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN(CC(C)(C)O)CC2)nc1-c1cccc(c1)C#N
CN1CCC11CCN(C1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN(CC2)C(C)(C)CO)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3CCC[C@H]3C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCN[C@H](C2)C(O)=O)nc1-c1cccc(c1)C#N |r|
COC(=O)[C@H]1CN(CCN1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(Cl)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCN[C@H](CO)C2)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCN[C@@H](CO)C2)nc1-c1cccc(c1)C#N |r|
C[C@H]1CN(CCN1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
C[C@@H]1CN(CCN1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(Cl)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2C[C@@H]3C[C@H]2CN3)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCN[C@H](C2)C(N)=O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCN[C@@H](C2)C(N)=O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CCC(C)(N)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(C)(CC2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@@H](C2)S(C)(=O)=O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(C2)S(N)(=O)=O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@@H](C2)C(N)=O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CNC(=O)C3)CC2)nc1-c1cccc(c1)C#N
CN1C[C@@H]2CC[C@H]1CN(C2)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
CN1C(=O)NC2(CCN(CC2)C(=O)Nc2nc(c(s2)-c2cc(C)nc(C)c2)-c2cccc(c2)C#N)C1=O
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC(C)(C2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@H](C2)C(N)=O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@H](C2)S(N)(=O)=O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(COC3)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CNC(=O)N3)CC2)nc1-c1cccc(c1)C#N
CN1CC2(CCN(CC2)C(=O)Nc2nc(c(s2)-c2cc(C)nc(C)c2)-c2cccc(c2)C#N)OC1=O
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3C(COC3=O)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3CCS(=O)(=O)CC3C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3CCCCN3C(=O)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3CCNC(=O)C3C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3C(CCOC3=O)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3C(CCC3=O)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C(F)F)-c1sc(NC(=O)N2CCS(=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CNC3=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)n2cccn2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)c2ncon2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3C(C2)C(=O)NC3=O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CCNC3=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)c2ncc[nH]2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CCNC(=O)C3)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCn3ccnc3C2)nc1-c1cccc(c1)C#N
CNC(=O)C1CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(C2)CCOCC3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)N2CCNC2=O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)c2ncno2)nc1-c1cccc(c1)C#N
CN=S1(=O)CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)C(=O)NCCO)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(C2)CCOC(=O)N3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3C(C2)C(=O)NCC3=O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@H](C2)C(C)(C)O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3C(COCC3=O)C2)nc1-c1cccc(c1)C#N
CN1CC2(CC1=O)CCN(CC2)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
CN1CC(=O)N2CCN(CC2C1=O)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CC2)CCC(=O)NC3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)(C#N)C(C)(C)O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3C(CCNC3=O)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3C(CCCC3=O)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(C2)CC(C)(O)C3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CCC(=O)N3)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(C2)CS(=O)(=O)C3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCOC(C2)C(C)(C)C)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@@H](C2)C(C)(C)O)nc1-c1cccc(c1)C#N |r|
[H][C@@]12COC[C@]1([H])CN(C2)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CCOC(=O)N3)CC2)nc1-c1cccc(c1)C#N
CN1C(=O)NCC11CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2C[C@@H]3CNC(=O)[C@@H]3C2)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(C2)CCOC3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(C2)CCOCC3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(C2)CNC(=O)C3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CNC(=O)O3)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(C2)CNC(=O)N3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CCCC(=O)N3)CC2)nc1-c1cccc(c1)C#N |$;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;;$|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(C2)CCNC3=O)nc1-c1cccc(c1)C#N
CCN1CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(n1)C(F)(F)F)-c1sc(NC(=O)N2CCN(CC2)C2COC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)C(O)=O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@@H](C2)C(O)=O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC(CO)(C2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@H](C2)C(O)=O)nc1-c1cccc(c1)C#N |r|
Cc1cc(-c2sc(NC(=O)N3CCC(C)(CC3)C#N)nc2-c2cccc(c2)C#N)c(F)c(C)n1
Cc1cc(-c2sc(NC(=O)N3CC(C)(O)C3)nc2-c2cccc(c2)C#N)c(F)c(C)n1
Cc1cc(-c2sc(NC(=O)N3CC(C)(C3)C#N)nc2-c2cccc(c2)C#N)c(F)c(C)n1
Cc1cc(-c2sc(NC(=O)N3CCC4(CNC4=O)CC3)nc2-c2cccc(c2)C#N)c(F)c(C)n1
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC(C2)C(O)=O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC[C@H]2CO)nc1-c1cccc(c1)C#N |r|
C[C@H]1CCN1C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@H]2CO)nc1-c1cccc(c1)C#N |r|
C[C@@H]1COCCN1C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN[C@@H](C2)C(C)(C)O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCOC[C@@H]2CO)nc1-c1cccc(c1)C#N |r|
CN1CCC2(CCN(CC2)C(=O)Nc2nc(c(s2)-c2cc(C)nc(C)c2)-c2cccc(c2)C#N)C1=O
C[C@@H]1CCN1C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(C#N)c1C
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CCOC3)C2)nc1-c1cccc(c1)C#N |$;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;$|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@H]2C(C)(C)O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@@H]2C(C)(C)O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(C2)N2CCOCC2)nc1-c1cccc(c1)C#N
C[C@@H]1CN(CC(=O)N1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
C[C@H]1COCCN1C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC22COC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCOC[C@H]2CO)nc1-c1cccc(c1)C#N |r|
CN1CC2(CCN(CC2)C(=O)Nc2nc(c(s2)-c2cc(C)nc(C)c2)-c2cccc(c2)C#N)N(C)C1=O
C[C@H]1CN(CC(=O)N1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@@H]2CO)nc1-c1cccc(c1)C#N |r|
CN1CCC2(CN(C2)C(=O)Nc2nc(c(s2)-c2cc(C)nc(C)c2)-c2cccc(c2)C#N)C1=O
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(CCO3)C2)nc1-c1cccc(c1)C#N
CN1C(=O)CCC11CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CC2)S(C)(=O)=O)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(C)(O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C(F)F)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
CN1CCO[C@H]2CN(C[C@@H]12)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(n1)C(F)(F)F)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
CC(=O)N1C[C@H]2C[C@@H]1CN2C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
CN1C[C@@H]2C[C@H]1CN2C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
CN1CC2(CCN(CC2)C(=O)Nc2nc(c(s2)-c2cc(C)nc(C)c2)-c2cccc(c2)C#N)NC1=O
[2H]C([2H])([2H])c1cc(cc(n1)C([2H])([2H])[2H])-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(-c2sc(NC(=O)N3CC4(COC4)C3)nc2-c2cccc(c2)C#N)c(F)c(C)n1
CN1CCO[C@@H]2CN(C[C@H]12)C(=O)Nc1nc(c(s1)-c1cc(C)nc(c1)C(F)F)-c1cccc(c1)C#N |r|
CN1CCOC2(CCN(C2)C(=O)Nc2nc(c(s2)-c2cc(C)nc(c2)C(F)F)-c2cccc(c2)C#N)C1
Cc1cc(cc(n1)C(F)F)-c1sc(NC(=O)N2CCC3(C2)CNCCO3)nc1-c1cccc(c1)C#N
CN1CCO[C@H]2CN(C[C@H]12)C(=O)Nc1nc(c(s1)-c1cc(C)nc(c1)C(F)F)-c1cccc(c1)C#N |r|
Cc1cc(cc(n1)C1COC1)-c1sc(NC(=O)N2CCC(C)(C2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C1COC1)-c1sc(NC(=O)N2CCC(C)(CC2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC(C2)N2CCOCC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN(CC2)C2CCOCC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC(C2)N2CCCC2)nc1-c1cccc(c1)C#N
CN(C)C1CN(C1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(CN3CCOCC3)CC2)nc1-c1cccc(c1)C#N
CN1CC2CN(C2C1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN3CCC2C3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCNCC2)nc1-c1cccc(c1)C#N
C[C@@H]1CN(CCN1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(N)(CC2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(CC2)CNCCO3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2C3CCC2CNC3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2C3CC2CNC3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2C[C@H]3CC[C@@H]2CN3)nc1-c1cccc(c1)C#N |r|
C[C@H]1CN([C@@H](C)CN1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
C[C@@H]1CNC[C@@H](C)N1C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCNCC2(C)C)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCNCC22CCC2)nc1-c1cccc(c1)C#N
C[C@@H]1CN([C@@H](C)CN1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
CC(=O)N=S1(=O)CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N
Cc1cc(cc(CO)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(CO)n1)-c1sc(NC(=O)N2CCC3(CNC3=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(CO)n1)-c1sc(NC(=O)N2CC[C@H](C2)C(C)(C)O)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(CO)n1)-c1sc(NC(=O)N2CCS(=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(CO)n1)-c1sc(NC(=O)N2CCN(CC2)C2COC2)nc1-c1cccc(c1)C#N
CN1C(=O)N(C)C2(CCN(CC2)C(=O)Nc2nc(c(s2)-c2cc(C)nc(CO)c2)-c2cccc(c2)C#N)C1=O
Cc1cc(cc(CO)n1)-c1sc(NC(=O)N2CCC(CC2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(CO)n1)-c1sc(NC(=O)N2CCC(CO)(CC2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(CO)n1)-c1sc(NC(=O)N2CCC(CC2)(C#N)C#N)nc1-c1cccc(c1)C#N
COC1(CCN(CC1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(CO)c1)-c1cccc(c1)C#N)C#N
Cc1cc(-c2sc(NC(=O)N3CCS(=O)CC3)nc2-c2cccc(c2)C#N)c(F)c(C)n1
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCS(=O)(CC2)=NC#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C(C)(C)O)-c1sc(NC(=O)N2CCC(C)(CC2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C(C)(C)O)-c1sc(NC(=O)N2CC3(C2)CCOC3)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C(C)(C)O)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
CC(O)c1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
C[C@@H](O)c1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
C[C@H]1CN(C[C@@H](C)N1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(C2)CNCCO3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCNC3(CC3)C2)nc1-c1cccc(c1)C#N
C[C@H]1CN(C[C@H](C)N1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
C[C@H]1CNCCN1C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCNC[C@@H]2CO)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCNC[C@H]2CO)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3CC(C2)N3)nc1-c1cccc(c1)C#N
C[C@@H]1CNCCN1C(=O)Nc1nc(c(s1)-c1cc(C)nc(C)c1)-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(C2)COCCN3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN[C@@H](C2)C(F)(F)F)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3CCC(C2)N3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC3(C2)CNCCO3)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN[C@H](C2)C(F)(F)F)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN[C@@H](C2)C#N)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCN[C@H](C2)C#N)nc1-c1cccc(c1)C#N |r|
C[C@@H]1CN(CCN1)C(=O)Nc1nc(c(s1)-c1cc(C)nc(c1)C(F)(F)F)-c1cccc(c1)C#N |r|
Cc1cc(cc(n1)C(F)F)-c1sc(NC(=O)N2C[C@@H]3NCCO[C@H]3C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C(F)F)-c1sc(NC(=O)N2C[C@@H]3NCCO[C@@H]3C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2C[C@@H]3NCCO[C@H]3C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCNCC2C2CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCNCC2CC2CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCNC(C)(C)C2)nc1-c1cccc(c1)C#N
COc1cc(cc(C)n1)-c1sc(NC(=O)N2CCS(=N)(=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C(F)F)-c1sc(NC(=O)N2CCS(=N)(=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C(F)(F)F)-c1sc(NC(=O)N2CCS(=O)CC2)nc1-c1cccc(c1)C#N
COc1cc(cc(C)n1)-c1sc(NC(=O)N2CCS(=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C1COC1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C#N)-c1sc(NC(=O)N2CCS(=O)CC2)nc1-c1cccc(c1)C#N
Cc1cc(cc(CF)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(n1)C1CC1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
CC(C)c1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
CCc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Clc1cc(cc(Cl)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)[n+]1[O-])-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(C)(CC2)C#N)nc1-c1cccc(C#N)c1C
CC(=O)Nc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
CC(=O)NCc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
COCc1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
COC(C)c1cc(cc(C)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
CC(C)(O)c1cc(cc(Cl)n1)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(CO)n1)-c1sc(NC(=O)N2CCC(C)(CC2)C#N)nc1-c1cccc(c1)C#N
OCc1cc(cc(n1)C(F)(F)F)-c1sc(NC(=O)N2CC3(COC3)C2)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CCC(C)(C2)C#N)nc1-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@](C)(C2)C#N)nc1-c1cccc(c1)C#N |r|
Cc1cc(cc(C)n1)-c1sc(NC(=O)N2CC[C@@](C)(C2)C#N)nc1-c1cccc(c1)C#N |r|
[2H]C([2H])([2H])c1cc(cc(n1)C([2H])([2H])[2H])-c1sc(NC(=O)N2CCC(C)(CC2)C#N)nc1-c1cccc(c1)C#N
Nc1nc(cc2nc(nn12)C(O)c1ccccc1)-c1cccc(c1)C#N
Nc1nc(cc2nc(Cc3ccccc3)nn12)-c1cccc(c1)C#N
Nc1nc(cc2nc(Cc3ccccn3)nn12)-c1cccc(c1)C#N
Nc1nc(cc2nc(CC3CCCCC3)nn12)-c1cccc(c1)C#N
Cn1cc(cn1)-c1cccc(Cc2nc3cc(nc(N)n3n2)-c2cccc(c2)C#N)c1
Nc1nc(cc2nc(CN3CCCC3=O)nn12)-c1cccc(c1)C#N
Cn1ccnc1Cc1nc2cc(nc(N)n2n1)-c1cccc(c1)C#N
NC(c1nc2cc(nc(N)n2n1)-c1cccc(c1)C#N)c1ccccc1
Nc1nc(-c2cccc(c2)C#N)c(CO)c2nc(Cc3ccccc3)nn12
Nc1nc(cc2nc(Nc3ccccc3)nn12)-c1cccc(c1)C#N
Nc1nc(cc2nc(Cc3ccccc3)cn12)-c1cccc(c1)C#N
CCNC(=O)c1nc2cc(nc(N)n2n1)-c1cccc(c1)C#N
Cc1c(cccc1-c1cc2nc(nn2c(N)n1)C(O)c1c(F)cccc1F)C#N
Nc1nc(cc2nc(nn12)C(O)c1c(F)cccc1F)-c1cccc(C#N)c1F
Nc1nc(-c2cccc(C#N)c2F)c(C#N)c2nc(nn12)C(O)c1c(F)cccc1F
CN1CCC(NCc2cccc(F)c2C(O)c2nc3cc(nc(N)n3n2)-c2cccc(C#N)c2F)C1=O
CN1CCC2(CN(Cc3cccc(F)c3C(O)c3nc4cc(nc(N)n4n3)-c3cccc(C#N)c3F)C2)C1=O
CCN(Cc1cccc(F)c1C(O)c1nc2cc(nc(N)n2n1)-c1cccc(C#N)c1F)[C@H]1CCNC1=O |r|
Nc1nc(cc2nc(Cc3c(F)cccc3CNC3CCN(CC(O)=O)C3=O)nn12)-c1cccc(C#N)c1F
Nc1nc(cc2nc(Cc3c(F)cccc3CN[C@@H]3CCOC3=O)nn12)-c1cccc(C#N)c1F |r|
Nc1nc(cc2nc(Cc3c(F)cccc3CN[C@@H]3CCNC3=O)nn12)-c1cccc(C#N)c1F |r|
Nc1nc(cc2nc(Cc3c(F)cccc3CN[C@H]3CCNC3=O)nn12)-c1cccc(C#N)c1F |r|
N\N=C(/N=N)C1CCN(Cc2cccc(F)c2Cc2nc3cc(nc(N)n3n2)-c2cccc(C#N)c2F)C1
CCN1CCC(NCc2cccc(F)c2Cc2nc3cc(nc(N)n3n2)-c2cccc(C#N)c2F)C1=O
CC(=O)N[C@H]1CCN(Cc2cccc(F)c2Cc2nc3cc(nc(N)n3n2)-c2cccc(C#N)c2F)C1 |r|
Nc1nc(cc2nc(Cc3c(F)cccc3CN3CCC[C@H]3c3nn[nH]n3)nn12)-c1cccc(C#N)c1F |r|
Nc1nc(cc2nc(Cc3c(F)cccc3CN3CC[C@@H](C3)C#N)nn12)-c1cccc(C#N)c1F |r|
CN1CCC2(CN(Cc3cccc(F)c3Cc3nc4cc(nc(N)n4n3)-c3cccc(C#N)c3F)C2)C1=O
CN1CCC(NCc2cccc(F)c2Cc2nc3cc(nc(N)n3n2)-c2cccc(C#N)c2F)C1=O
CCN(Cc1cccc(F)c1Cc1nc2cc(nc(N)n2n1)-c1cccc(C#N)c1F)C1CCN(CC(O)=O)C1=O
CCN(Cc1cccc(F)c1Cc1nc2cc(nc(N)n2n1)-c1cccc(C#N)c1F)C1CCN(C)C1=O
CCN(Cc1cccc(F)c1Cc1nc2cc(nc(N)n2n1)-c1cccc(C#N)c1F)[C@@H]1CCNC1=O |r|
Nc1nc(cc2nc(NCc3cccc(n3)-c3cnn(c3)C3CCNCC3)nn12)-c1cccc(C#N)c1F
Nc1nc(cc2nc(NCc3cccc(n3)-c3cnn(CCN4CCOCC4)c3)nn12)-c1cccc(C#N)c1F
COc1cccc2c3nc(CCC4CCc5c(C4)nnn5C4CC(F)(F)C4)nn3c(N)nc12
COc1cc(F)cc2c3nc(CCC4CCc5nn(cc5C4)C(C)C)nn3c(N)nc12
COc1cccc2c3nc(CCS(C)(=O)=O)nn3c(N)nc12
COc1cc2nc(N)n3nc(CCS(C)(=O)=O)nc3c2cc1F
COc1cc2nc(N)n3nc(CCS(N)(=O)=O)nc3c2cc1F
COc1cccc2c3nc(CS(=O)(=O)c4ccccc4)nn3c(N)nc12
COc1cc(F)cc2c3nc(CC4CC4c4ccc(cc4)C(C)(C)N)nn3c(N)nc12
COc1cccc2c3nc(CC4CC4c4ccc(cc4)C(C)(C)N)nn3c(N)nc12
COc1cccc2c3nc(CCS(=O)(=O)c4ccc(F)cc4)nn3c(N)nc12
COc1cccc2c3nc(CCS(=O)(=O)C(F)(F)F)nn3c(N)nc12
COc1ccc2c3nc(CCS(=O)(=O)c4ccc(F)cc4)nn3c(N)nc2c1
COc1ccc2c3nc(CCS(=O)(=O)CC(C)C)nn3c(N)nc2c1
CCS(=O)(=O)CCc1nc2c3ccc(OC)cc3nc(N)n2n1
COc1cc(F)cc2c3nc(CCS(=O)(=O)C4CC4)nn3c(N)nc12
COc1cc(F)cc2c3nc(CCS(=O)(=O)CC(C)C)nn3c(N)nc12
CCS(=O)(=O)CCc1nc2c3cc(F)c(OC)cc3nc(N)n2n1
COc1cc2nc(N)n3nc(CCS(=O)(=O)c4ccc(F)cc4)nc3c2cc1F
COc1cc2nc(N)n3nc(CCS(=O)(=O)C4CC4)nc3c2cc1F
CCS(=O)(=O)CCc1nc2c3cc(F)cc(OC)c3nc(N)n2n1
COc1cc2nc(N)n3nc(CCS(=O)(=O)CC(C)C)nc3c2cc1F
COc1cc(F)cc2c3nc(CCCS(=O)(=O)C4CC4)nn3c(N)nc12
COc1cccc2c3nc(nn3c(N)nc12)[C@@H](C)CO |r|
COc1cccc2c3nc(nn3c(N)nc12)[C@H](C)CO |r|
COc1cccc2c3nc(C[C@H](C)O)nn3c(N)nc12 |r|
COc1cccc2c3nc(C[C@@H](C)O)nn3c(N)nc12 |r|
CC(C)(O)CNC(=O)c1ccc2nc(c(Br)n2n1)-c1cccc(c1)C#N
CC(=O)c1cc(cc(C)n1)-c1c(nc2ccc(nn12)C(=O)NCC(C)(C)O)-c1cccc(c1)C#N
Cc1cc(cc(C)n1)-c1c(nc2ccc(nn12)C(=O)NCC(C)(C)O)-c1cccc(c1)C#N
Cc1cc(cc(Cl)n1)-c1c(nc2ccc(nn12)C(=O)NCC(C)(C)O)-c1cccc(c1)C#N
Cc1cc(cc(n1)C(F)(F)F)-c1c(nc2ccc(nn12)C(=O)NCC(C)(C)O)-c1cccc(c1)C#N
COc1cc(cc(C)n1)-c1c(nc2ccc(nn12)C(=O)NCC(C)(C)O)-c1cccc(c1)C#N
CC(F)c1cc(cc(C)n1)-c1c(nc2ccc(nn12)C(=O)N[C@@H](C)C(C)(C)O)-c1cccc(c1)C#N |r|
C[C@H](NC(=O)c1ccc2nc(c(-c3cc(C)nc(c3)C(F)(F)F)n2n1)-c1cccc(c1)C#N)C(C)(C)O |r|
C[C@@H](NC(=O)c1ccc2nc(c(-c3cc(C)nc(c3)C(F)(F)F)n2n1)-c1cccc(c1)C#N)C(C)(C)O |r|
COc1cc(cc(C)n1)-c1c(nc2ccc(nn12)C(=O)N[C@@H](C)C(C)(C)O)-c1cccc(c1)C#N |r|
C[C@H](NC(=O)c1ccc2nc(c(-c3cc(C)nc(Cl)c3)n2n1)-c1cccc(c1)C#N)C(C)(C)O |r|
C[C@H](NC(=O)c1ccc2nc(c(-c3cc(C)nc(C)c3)n2n1)-c1cccc(c1)C#N)C(C)(C)O |r|
C[C@H](NC(=O)c1ccc2nc(c(-c3cc(C)nc(CO)c3)n2n1)-c1cccc(c1)C#N)C(C)(C)O |r|
CCOC(=O)c1cc(C(=O)c2ccc(Cl)cc2)n2cc(C)cc(C)c12
COC(=O)c1c(C(=O)OC)c2c(C)cc(C)cn2c1C(=O)c1ccc(OC)cc1
CCOC(=O)c1cc(C(=O)C2=CC=C(Br)CC2)n2cc(C)cc(C)c12 |t:10,12|
COC(=O)c1c(C(=O)OC)c2c(C)cc(C)cn2c1C(=O)c1ccc(Br)cc1
CCOC(=O)c1cc(C(=O)C2=CC=C(F)CC2)n2cc(C)cc(C)c12 |t:10,12|
CCOC(=O)c1cc(C(=O)c2ccccc2[N+]([O-])=O)n2cc(C)cc(C)c12
CCOC(=O)c1cc(C(=O)c2ccc(C)cc2)n2cc(C)cc(C)c12
COC(=O)c1c(C(=O)OC)c2c(C)cc(C)cn2c1C(=O)c1ccc(C)cc1
CCOC(=O)c1cc(C(=O)c2ccc(OC)cc2)n2cc(C)cc(C)c12
COC(=O)c1c(C(=O)OC)c2c(C)cc(C)cn2c1C(=O)c1ccc(Cl)cc1
CCOC(=O)c1cc(C(=O)c2ccc(cc2)C#N)n2cc(C)cc(C)c12
COC(=O)c1c(C(=O)OC)c2c(C)cc(C)cn2c1C(=O)c1ccc(cc1)C#N
CCOC(=O)c1cc(C(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)n2cc(C)cc(C)c12
Cc1c(C#N)cccc1-c1nc(N)c(F)c(-c2cn(Cc3cccc(C(C)(C)O)n3)nn2)n1
Cc1c(cccc1-c1cc(nc(N)n1)-c1cn(Cc2cccc(n2)C(C)(C)O)nn1)C#N
Fc1ccccc1-c1nc(NC2=NCC(C3CCC3)=N2)sc1-c1ccncc1F
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1cccc4c1nc(N)n5nc([C@@H]3CCCN(c2cnn(CC(F)(F)F)c2)C3)nc45
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5(C)CC5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCOCC5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(CC5(O)CCC5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@H]5CCCC[C@H]5O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@@H]5CCCC[C@@H]5O)c4)C3)nc21
CNC(=O)C(C)(C)n1cc(N2CCC[C@@H](c3nc4c5cccc(OC)c5nc(N)n4n3)C2)cn1
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cn(CC(C)(C)O)nc4C)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cn(CC5(O)CCC5)nc4C)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(CC(C)(C)O)c4C)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@H]5C[C@@](C)(O)C5)c4)C3)nc21
CCNC(=O)C(C)(C)n1cc(N2CCC[C@@H](c3nc4c5cccc(OC)c5nc(N)n4n3)C2)cn1
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C(C)(C)C(=O)NC5CCC5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C(C)(C)C(=O)NC(C)C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@@H]5CCCC[C@]5(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@H]5CCCC[C@]5(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(CC5(O)CCCCC5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@@H]5CCNC5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cn(C5CCOCC5)nc4C)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCOCC5)c4C)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cn(C5CCOCC5)nc4C(F)F)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCOCC5)c4C(F)F)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@H]5CCN(C)C5)c4)C3)nc21
COc1cccc4c1nc(N)n5nc([C@@H]3CCCN(c2cn(C)nc2C(F)(F)F)C3)nc45
COc1cccc4c1nc(N)n5nc([C@@H]3CCCN(c2cn(CC(C)(C)O)nc2C(F)(F)F)C3)nc45
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cn(CC(C)(C)O)nc4C(F)F)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C(C)(C)CO)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cn[nH]c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCCC5OC)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@@H]5CCOC5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@H]5CCOC5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCC[C@@H]5O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCC[C@H]5O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCC[C@]5(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCC[C@@]5(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@@H]5CCC5O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@H]5CCC5O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@H](C)C(C)(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn([C@@H](C)C(C)(C)O)c4)C3)nc21
COc1cccc4c1nc(N)n5nc([C@@H]3CCCN(c2nn(CC(C)(C)O)cc2C(F)(F)F)C3)nc45
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ncn(CC(C)(C)O)n4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cn(CC(C)(C)O)nn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ccn(C)n4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cn(C)nn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ncn(C5CCOCC5)n4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ncn(CC(F)(F)F)n4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4nn(C)nc4C)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4nnc5n4CCNC5)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCOCC5)n4)C3)nc21
COc1cccc4c1nc(N)n5nc([C@@H]3CCCN(c2cn(CC(F)(F)F)nn2)C3)nc45
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cc(C)n(C)n4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C)n4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cn(C)cn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4nccn4C)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ccn(C)c(=O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ccc(=O)n(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ccc(=O)n(C(F)F)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cc(C)c(=O)n(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ccc(=O)n(C(C)C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ccc(=O)n(C)n4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cc(C(F)(F)F)c(=O)n(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnc(OC(F)F)c(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4nccnc4C)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnccn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cncc(C)n4)C3)nc21
COc1cccc4c1nc(N)n5nc([C@@H]3CCCN(c2cncc(C(F)(F)F)n2)C3)nc45
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnc(C5CC5)cn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnc(C)cn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ccc(C(C)C)nn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ccc(F)cn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4ncccn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CS(=O)(=O)C5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCS(=O)(=O)CC5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3CCC4CCC3N4c3cnn(C)c3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCC4CCC3N4c3cnn(C)c3)nc21
COc1cccc2c1nc(N)n1nc(C3CCC[C@](O)(c4cnn(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc(C3CCC[C@@](O)(c4cnn(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3CCC[C@H](c4cnn(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCC[C@H](c4cnn(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc(C3CCCC(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc(C3CCCC(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3CCO[C@@H](c4cnn(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCO[C@@H](c4cnn(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3CCO[C@H](c4cnn(C)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCO[C@H](c4cnn(C)c4)C3)nc21
CCn1cc(N2C[C@@H](c3nc4c5cccc(OC)c5nc(N)n4n3)CC[C@H]2C)cn1
CCn1cc(N2C[C@H](c3nc4c5cccc(OC)c5nc(N)n4n3)CC[C@H]2C)cn1
CCn1cc(N2C[C@@H](c3nc4c5cccc(OC)c5nc(N)n4n3)CC[C@@H]2C)cn1
COc1cccc2c1nc(N)n1nc([C@H]3CC[C@H](C)N(c4cnn(C5CC5)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CC[C@H](C)N(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3CC[C@H](C)N(c4cn(CC(C)(C)O)nc4C)C3)nc21
COc1cccc4c1nc(N)n5nc([C@H]3CC[C@@H](C)N(c2cnn(C(C)(C)CO)c2)C3)nc45
COc1cccc2c1nc(N)n1nc([C@H]3CC[C@H](C)N(c4cnn(C(C)C(C)(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3CN(c4cnn(CC5(O)CCC5)c4)CC(F)(F)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3CN(c4cn(CC(C)(C)O)nc4C)CC(F)(F)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3CN(c4cnn(CC(C)(C)O)c4C)CC(F)(F)C3)nc21
COc1cccc2c1nc(N)n1nc([C@@H]3CCN(c4cnn(CC5CC5)c4)C3)nc21
COc1ccc2c(nc(N)n3nc(C4CCCN(c5cnn(C)c5)C4)nc23)c1F
Cc1ccc2c(nc(N)n3nc(C4CCCN(c5cnn(C)c5)C4)nc23)c1C
Cn1cc(N2CCCC(c3nc4c5ccc(F)cc5nc(N)n4n3)C2)cn1
Cn1cc(N2CCCC(c3nc4c5c(Cl)ccc(Cl)c5nc(N)n4n3)C2)cn1
Cc1cccc2c1nc(N)n1nc(C3CCCN(c4cnn(C)c4)C3)nc21
Cn1cc(N2CCCC(c3nc4c5c(F)ccc(F)c5nc(N)n4n3)C2)cn1
COc1c(Cl)ccc2c1nc(N)n1nc(C3CCCN(c4cnn(C)c4)C3)nc21
Cn1cc(N2CCCC(c3nc4c5ccc(C(F)(F)F)cc5nc(N)n4n3)C2)cn1
COc1cccc2c1nc(N)n1nc(C3CCCCN(c4cn(C)nn4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn(CC5(O)CCC5)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn(CC(F)(F)F)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cn(CC(C)(C)O)nc4C)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn(CC(C)(C)O)c4C)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn([C@H]5C[C@@](C)(O)C5)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn(CC5(CF)COC5)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn([C@@H](C)C(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn([C@H](C)C(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cn([C@@H](C)C(C)(C)O)nc4C)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cn([C@H](C)C(C)(C)O)nc4C)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn(C5CCC[C@H]5O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn(C(C)(C)CO)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn([C@@H](C)C(C)(C)O)c4C)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnn([C@H](C)C(C)(C)O)c4C)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4cnc(OC(F)F)c(C)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4ccc(OC(F)F)nc4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4ccc(OC(C)C)nc4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4ccc(C(C)=O)cc4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CCCN(c4ncn(CC(C)(C)O)n4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@H]3C[C@@H](C)CN(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3C[C@@H](C)CN(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@H]3C[C@H](C)CN(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3C[C@H](C)CN(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@H]3C[C@@H](F)CN(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3C[C@@H](F)CN(c4cn(CC(C)(C)O)nc4C)C3)nc21
C[C@H]1CC[C@@H](c2nc3c4ccc(Br)cc4nc(N)n3n2)CN1c1cnn(CC(C)(C)O)c1
Cc1ccc2c(c1)nc(N)n1nc(C3CCCN(c4cnn(C)c4)C3)nc21
Cn1cc(N2CCCC(c3nc4c5ccc(Cl)cc5nc(N)n4n3)C2)cn1
C[C@H]1CC[C@@H](c2nc3c4ccc(C(F)F)cc4nc(N)n3n2)CN1c1cnn(CC(C)(C)O)c1
C[C@H]1CC[C@@H](c2nc3c4ccc(C#N)cc4nc(N)n3n2)CN1c1cnn(CC(C)(C)O)c1
C[C@H]1CC[C@@H](c2nc3c4ccc(Cl)cc4nc(N)n3n2)CN1c1cnn(CC(C)(C)O)c1
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CC[C@H](C)N(c4cnn(CC(C)(C)O)c4)C3)nc21
C[C@H]1CC[C@@H](c2nc3c4ccc(C5CC5)cc4nc(N)n3n2)CN1c1cnn(CC(C)(C)O)c1
Cc1ccc2c(c1)nc(N)n1nc([C@@H]3CC[C@H](C)N(c4cnn(CC(C)(C)O)c4)C3)nc21
CCc1ccc2c(c1)nc(N)n1nc([C@@H]3CC[C@H](C)N(c4cnn(CC(C)(C)O)c4)C3)nc21
C[C@H]1CC[C@@H](c2nc3c4ccc(C5CCC5)cc4nc(N)n3n2)CN1c1cnn(CC(C)(C)O)c1
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CC[C@H](C)N(c4cnn(C5CCC[C@H]5O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CC[C@H](C)N(c4cnn(C5CCC[C@@H]5O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CC[C@H](C)N(c4cnn([C@@H](C)C(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@@H]3CC[C@H](C)N(c4cnn([C@H](C)C(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@H]3CC[C@@H](C)N(c4cnn([C@@H](C)C(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@H]3CC[C@@H](C)N(c4cnn([C@H](C)C(C)(C)O)c4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc(C3CCCCN(c4cnn(CC(C)(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccc(C(C)(C)O)cc3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3cnn(C)c3)nc21
COc1cccc2c3nc(nn3c(N)nc12)C1CC1c1nc2ccccc2n1C
CNC(=O)c1cccc(C2CC2c2nc3c4cccc(OC)c4nc(N)n3n2)c1
COc1cccc2c1nc(N)n1nc(C3CC3c3cccc(NC(C)=O)c3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccc4c(c3)C(=O)NC4)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3cn4ccnc4cc3C)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccc4c(c3)CNC4=O)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccc4nnc(C)n4c3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3C)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccc(C)nc3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccccc3[C@@H](C)O)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccc4nncn4c3)nc21
CCn1cc(C2CC2c2nc3c4cccc(OC)c4nc(N)n3n2)cn1
COc1cccc2c1nc(N)n1nc(C3CC3c3ccccc3[C@H](C)O)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3cncc(C(C)(C)O)c3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccc(C(N)=O)c(F)c3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3cncc(F)c3)nc21
CNC(=O)c1ccc(C2CC2c2nc3c4cccc(OC)c4nc(N)n3n2)cc1
COc1cccc2c1nc(N)n1nc(C3CC3c3cccc4c3CNC4=O)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccc4cnn(C)c4c3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3cnc(NCCO)nc3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3cnn(CCO)c3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccc4c(c3)NCCO4)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3c[nH]nc3C(F)(F)F)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3cnc(C)nc3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3cnn(C)c3)nc21
COc1cc(F)cc2c1nc(N)n1nc(C3CC3(F)c3ccccc3)nc21
COc1cccc2c1nc(N)n1nc(C3(CO)CC3)nc21
COc1cc(F)cc2c1nc(N)n1nc(C3CC3c3ccc(F)cc3)nc21
COc1cc(F)cc2c1nc(N)n1nc(C3CC3(F)c3ccccc3)nc21
COc1cc(F)cc2c1nc(N)n1nc(C3CC3(F)c3ccccc3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3c3ccccc3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3CO)nc21
COc1cccc2c1nc(N)n1nc(C3CC3CO)nc21
COc1cccc2c1nc(N)n1nc(C3(c4ccccc4)CC3)nc21
COc1cccc2c3nc(nn3c(N)nc12)C1CC1c1ccc2CNCCc2c1
COc1cc(F)cc2c1nc(N)n1nc(C3CC3(F)c3ccccc3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3Cc3ccc(F)cc3)nc21
COc1cccc2c1nc(N)n1nc(C3CC3Cc3ccc(F)cc3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3C[C@H](c4ccc(C(C)(C)O)cc4)C3)nc21
COc1cc(F)cc2c1nc(N)n1nc([C@H]3C[C@@H](c4ccc(C(C)(C)O)cn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3C[C@H](c4cccc(C(C)(C)O)c4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3C[C@@H](c4cccc(C(C)(C)O)c4)C3)nc21
COc1cccc2c3nc(nn3c(N)nc12)[C@H]1C[C@@H](C1)c1ccc(cn1)C(C)(C)O |r,wU:18.23,wD:16.22,(9.18,1.16,;9.18,-.38,;7.85,-1.15,;7.85,-2.7,;6.52,-3.46,;5.19,-2.7,;5.18,-1.16,;3.85,-.39,;2.39,-.86,;1.48,.38,;2.39,1.63,;3.85,1.15,;5.18,1.92,;5.18,3.46,;6.52,1.15,;6.52,-.39,;-.06,.38,;-1.15,1.47,;-2.26,.37,;-1.17,-.72,;-3.8,.37,;-4.57,-.97,;-6.1,-.97,;-6.87,.37,;-6.11,1.7,;-4.57,1.71,;-8.41,.37,;-9.18,-.97,;-9.66,1.27,;-8.41,1.91,)|
COc1cccc2c1nc(N)n1nc([C@H]3C[C@@H](c4ccc(C(C)(C)O)nc4)C3)nc21
COc1ccc2c(c1)nc(N)n1nc([C@H]3C[C@H](c4cnc(C(C)(C)O)cn4)C3)nc21
CC(C)(O)c1ccc([C@H]2C[C@@H](c3nc4c5cc(F)cc(F)c5nc(N)n4n3)C2)nc1
CC(C)(O)c1ccc([C@H]2C[C@H](c3nc4c5cc(F)cc(F)c5nc(N)n4n3)C2)nc1
COc1cccc2c1nc(N)n1nc([C@H]3C[C@@H](c4ccc(C(C)(C)N)cn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3C[C@H](c4ccc(C(C)(C)N)cn4)C3)nc21
COc1cc(F)cc2c1nc(N)n1nc(C3CC(c4ccc(C(C)(C)N)cn4)C3)nc21
COc1cccc2c3nc(nn3c(N)nc12)[C@H]1C[C@@H](C1)c1ncc(cc1C)C(C)(C)N |r,wU:18.23,wD:16.22,(9.46,1.16,;9.46,-.38,;8.13,-1.15,;8.13,-2.7,;6.8,-3.46,;5.47,-2.7,;5.47,-1.16,;4.13,-.39,;2.67,-.86,;1.76,.38,;2.67,1.63,;4.13,1.15,;5.47,1.92,;5.47,3.46,;6.8,1.15,;6.8,-.39,;.22,.38,;-.87,1.47,;-1.97,.37,;-.89,-.72,;-3.51,.37,;-4.28,-.97,;-5.82,-.97,;-6.59,.37,;-5.83,1.7,;-4.29,1.71,;-3.52,3.04,;-8.13,.37,;-8.9,-.97,;-9.46,1.14,;-8.13,1.91,)|
COc1cccc2c1nc(N)n1nc([C@H]3C[C@H](c4ncc(C(C)(C)N)cc4F)C3)nc21
COc1cccc2c1nc(N)n1nc(C3CC(c4ncc(C(C)(C)N)cc4Cl)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3C[C@H](c4ncc(C(C)(C)N)nc4C)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3C[C@@H](c4ccccc4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3C[C@H](c4ccccc4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3C[C@@](O)(c4ccc(C(C)(C)O)cn4)C3)nc21
COc1cccc2c1nc(N)n1nc([C@H]3C[C@@](N)(c4ccc(C(C)(C)O)cn4)C3)nc21
CCCOC(=O)c1ccc([C@]2(O)C[C@H](c3nc4c5cc(F)cc(OC)c5nc(NCc5ccc(OC)cc5OC)n4n3)C2)cn1
COc1cccc2c1nc(N)n1nc([C@H]3CC[C@@H](c4ccc(C(C)(C)N)cn4)C3)nc21
N(c1cccnc1)c1ncc(-c2ccncn2)c(n1)-c1ccco1
COC(=O)[C@@H]1[C@@H](O)CC[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 |r|
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCC(CC2)c2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OC(C)(C)C(=O)N2CCN(CC2)c2nc3ccc(Cl)cc3s2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccc(cc2)C(F)(F)F)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCc3ccccc3C2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2cccc(Cl)c2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OC(C)(C)C(=O)N2CCN(CC2)c2nc3cc(Cl)ccc3s2)cc1
CC(Oc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1)C(=O)N1CCN(CC1)c1ccc(C)cc1 |w:1.0|
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCC(CC2)(c2ccccc2)c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2cccc(Cl)c2)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(O)(=O)=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C#N)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(C)=O)cc1
Cn1cnc2c1C(=O)NC(=O)N2C
Cn1cnc2c1C(=O)N(C(=O)N2C)C
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2noc(n2)-c2ccc(Cl)cc2)c1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2cnccn2)cc1
COc1cc(ccc1OCC(=O)N1CCN(CC1)c1ccccc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1cc(OCC(=O)N2CCC(CC2)c2ccccc2)ccc1-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(Cc3ccccc3)CC2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2ccc(Br)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccc(cc2)C(F)(F)F)cc1
COc1ccc(cc1)C1CCN(CC1)C(=O)COc1ccc(cc1OC)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCC(CC2)c2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCC(CC2)(c2ccccc2)c2ccccc2)cc1
COc1cc(OCC(=O)N2CCc3ccccc3C2)ccc1-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
O=C(COc1ccc(cc1)-c1cc2n(CC3CC3)c(=O)n(CC3CC3)c(=O)c2[nH]1)N1CCc2ccccc2C1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2Cl)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccc(cc2)C(F)(F)F)cc1
COCCn1c2cc([nH]c2c(=O)n(CCOC)c1=O)-c1ccc(OCC(=O)N2CCc3ccccc3C2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2nc3ccc(Cl)cc3s2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)C(=O)Oc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCC(CC2)c2ccc(OC)cc2)cc1
O=C(COc1ccc(cc1)-c1cc2n(CC3CC3)c(=O)n(CC3CC3)c(=O)c2[nH]1)N1CCN(CC1)c1ccccc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCC(CC2)(c2ccccc2)c2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2cccc(Cl)c2)cc1
CCCn1c2cc([nH]c2c(=O)n(CC(C)C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2c(Cl)cncc2Cl)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccc(cc2)C#N)cc1
COc1cc(OCC(=O)N2CCN(CC2)c2ccc(Cl)cc2)ccc1-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2nc3ccc(Cl)cc3s2)cc1
COCCn1c2cc([nH]c2c(=O)n(CCOC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccn2)cc1
CC(Oc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1)C(=O)N1CCN(CC1)c1ccccc1Cl
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCc3ccccc3C2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(C)C(=O)N2CCc3ccccc3C2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2c(Cl)cncc2Cl)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OC(C)(C)C(=O)N2CCN(CC2)c2ccccc2)cc1
CC(Oc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1)C(=O)N1CCN(CC1)c1ccc(Br)cc1
COc1cc(OCC(=O)N2CCN(CC2)c2ccccc2)ccc1-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1ccccc1N1CCN(CC1)C(=O)COc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OC(C)(C)C(=O)N2CCN(CC2)c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCc3ccccc3C2)cc1
CN1CCN(CC1)C(=O)COc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2c(Cl)cncc2Cl)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(Cc3ccccc3)CC2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCC(O)(CC2)c2ccc(Cl)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2Cl)cc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccc(O)cc2)cc1
COc1ccc(cc1)N1CCN(CC1)C(=O)COc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ncccn2)cc1
CC(Oc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1)C(=O)N1CCN(CC1)c1ccccc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2)cc1
CCn1c2cc([nH]c2c(=O)n(CC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCC(CC2)c2ccccc2OC)cc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2Cl)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(C)C(=O)N2CCN(CC2)c2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2Cl)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCC(CC2)c2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccc(F)cc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2nc3cc(Cl)ccc3s2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(C)(C)C(=O)N2CCN(CC2)c2ccccc2)cc1
COc1cc(OCC(=O)Nc2ccc(Br)cc2)ccc1-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)C(=O)OCc2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccc(Br)cc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccc(F)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccc(Cl)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCC(O)(CC2)c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)N2CCC(CC2)C(=O)c2ccc(F)cc2)cc1
COc1cc(ccc1OCC(=O)N1CCc2ccccc2C1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
c1ccc(cc1)CNc2c3c(ncn2)n(cn3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)NC4CCCCC4)cc3)nc(Cl)nc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)NCc4ccccc4)cc3)nc(Cl)nc12
Nc1nc(OCCc2c[nH]c3ccc(Cl)cc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Nc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C#C[C@@H](O)c1ccccc1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccc(C)[nH]3)nc(Cl)nc12
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccco3)nc(OCCc3c[nH]c4cc(Br)ccc34)nc12
NNc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Nc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C#C[C@H](O)c1ccccc1
CCNc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C#C[C@H](O)c1ccccc1
CCNc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C#C[C@@H](O)c1ccccc1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)C#C[C@H](O)c1ccccc1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(cc3)S(O)(=O)=O)ncnc12
Nc1nc(OCCc2c[nH]c3ccc(F)cc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CCNC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC(N)=N)ncnc12
Nc1nc(OCCc2cccc3ccccc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccccc3)ncnc12
Nc1nc(OCCc2ccccc2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CC(C)Nc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C#C[C@H](O)c1ccccc1
Nc1nc(OCCc2c[nH]c3cc(Cl)ccc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
Nc1nc(OCCc2cccs2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)ncnc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc(Cl)cc4)cc3)ncnc12
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCCC3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccco3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)ncnc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccccc4)cc3)ncnc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)ncnc12
CNc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C#C[C@@H](O)c1ccccc1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)Cc3cccs3)nc(Cl)nc12 |r|
CC(C)Nc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C#C[C@@H](O)c1ccccc1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3cccs3)nc(Cl)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccsc3)nc(Cl)nc12 |r|
CCCCC#Cc1nc(NC(C)C)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc(OC)cc4)cc3)ncnc12
Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NC1CC1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC)ncnc12
CCCCC#Cc1nc(NC)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
CCCCC#Cc1nc(NCC)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc(cc4)C(C)(C)C)cc3)ncnc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc5OCOc5c4)cc3)ncnc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4cc(OC)cc(OC)c4)cc3)ncnc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc(OC)c(OC)c4)cc3)ncnc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)NCc4ccc(OC)cc4)cc3)ncnc12
CNc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C#C[C@H](O)c1ccccc1
CNc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C#CCCCc1ccccc1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)NCc4ccccc4)cc3)ncnc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccncc4)cc3)ncnc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc(cc4)N4CCOCC4)cc3)ncnc12
CCNc1nc(OCCc2c[nH]c3ccccc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)NC4CCCCC4)cc3)ncnc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccc[nH]3)nc(Cl)nc12 |r|
Nc1nc(OCCc2c[nH]c3ccccc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
C[C@H](Cc1ccccc1)Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Nc1nc(OCCc2cc[nH]c2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Nc1nc(OCCc2c[nH]c3ccc(I)cc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CC(C)(C)OC(=O)C1CCCN1CC(O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)OCc1ccccc1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccco3)nc(Cl)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc(OC)cc4)cc3)nc(Cl)nc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccccc4)cc3)nc(Cl)nc12
Nc1nc(OCCc2c[nH]c3ccc(O)cc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccc(I)cc4C(F)(F)F)cc3)ncnc12
COc1ccc2[nH]cc(CCOc3nc(N)c4ncn([C@@H]5O[C@H](CO)[C@@H](O)[C@H]5O)c4n3)c2c1
Nc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)C#C[C@@H](O)c1ccccc1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccc(Br)o3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3sccc3C)nc(Cl)nc12
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)N4CCCC4)cc3)nc(OCCc3c[nH]c4cc(Br)ccc34)nc12
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccccc4)cc3)nc(OCCc3c[nH]c4cc(Br)ccc34)nc12
Nc1nc(OCCc2c[nH]c3ccc(Br)cc23)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccc(C)s3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(OCCc3c[nH]c4ccccc34)nc12
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccc(C)o3)ncnc12 |r|
Nc1nc(SCc2cscn2)nc(-c2ccc3OCOc3c2)c1C#N
CC1(CCN(CC1)C(=O)Nc2nc3c(ccc(c3s2)N4CCOCC4)OC)O
c1cc2c(cc(nc2c(c1)C(F)(F)F)C(F)(F)F)[C@H]([C@@H]3CCCCN3)O
CC(C)c1nc(-c2nccs2)c2sccc2n1
Nc1nc(-c2ccco2)c2ncn(C(=O)NCc3ccccc3)c2n1
Nc1nc(-c2ccco2)c2ncn(C(=O)NCc3ccco3)c2n1
Cc1cc(Cn2nnc3c(nc(N)nc23)-c2ccco2)ccc1N
COCc1cccc(CNC(=O)c2cc(nc(N)n2)-c2ccco2)n1
CCCCc1nc(N)c2nc(-n3nccn3)n(C)c2n1
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Nc1nc(N=NCC2CCCCC2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r,w:4.3|
CNC(=O)c1cnn(c1)-c1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(N[C@H](CO)Cc3ccccc3)nc12
Nc1nc(OCCc2ccc(Cl)cc2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
COc1cccc(\C=C\c2nc3n(CCCO)c(=O)n(CC#C)c(=O)c3n2C)c1
CCN1c2c(n(c(n2)/C=C/c3ccc(c(c3)OC)OC)C)C(=O)N(C1=O)CC
COCCOc1ccc(cc1)N1CCN(CCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)CC1
Cc1cccc(c1)C(=O)NCN1CCN(CC1)c1ccccc1C#N
CC(C)(C)C(=O)Nc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccco1
Nc1ccc(CC(=O)Nc2nc3ccc(Cl)cc3c3nc(nn23)-c2ccco2)cc1
CC(=O)Nc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccco1
NCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccco1
NCCCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccco1
NCCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccco1
OC(=O)CCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccco1
CC(C)(C)OC(=O)Nc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccco1
Cc1ccc(cc1C)N2CCN(CC2)CC[C@H]3c4ccccc4C(=O)N3
Cc1ccc(cc1C)N1CCN(CC[C@H]2NC(=O)c3ccccc23)CC1
O=c1ccc2ccc(CNCCNc3ccccc3)cc2o1
Cn1c(\C=C\c2cccc(Br)c2)nc2n(C)c(=O)n(CC#C)c(=O)c12
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)[N+]([O-])=O)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(=O)OC)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(Cl)cc2)cc1
OC(=O)COc1ccc(cc1)-c1nc2n(Cc3ccccc3)c(=O)n(Cc3ccccc3)c(=O)c2[nH]1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(O)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NN2C(=O)C(C)=C(C)C2=O)cc1 |t:32|
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(O)=O)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(=O)NC)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2cccc(c2)C(C)=O)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NC(c2ccccc2)c2ccccc2)cc1
OC(=O)C=Cc1ccc(cc1)-c1nc2n(Cc3ccccc3)c(=O)n(Cc3ccccc3)c(=O)c2[nH]1 |w:3.2|
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N(C)c2ccccc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(N)=O)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(C=CC(=O)NN2C(=O)C(C)=C(C)C2=O)cc1 |w:22.24,t:32|
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(N)=O)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccccc2C(C)=O)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NCc2ccccc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N(CC(=O)OCC)CC(=O)OCC)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(C=CC(O)=O)cc1 |w:22.24|
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(O)=O)cc1
OC(=O)C=Cc1ccc(cc1)-c1nc2n(CC3CCCCC3)c(=O)n(CC3CCCCC3)c(=O)c2[nH]1 |w:3.2|
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(Br)cc2)cc1
CCn1c2nc([nH]c2c(=O)n(CC)c1=O)-c1ccc(OCC(=O)Nc2ccc(C)cc2)cc1
CCn1c2nc([nH]c2c(=O)n(CC)c1=O)-c1ccc(OCC(=O)Nc2ccc(CC(=O)NCCN)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(C=CC(=O)Nc2ccccc2C(C)=O)cc1 |w:22.24|
CCCCn1c2nc([nH]c2c(=O)n(CCCC)c1=O)-c1ccc(OCC(O)=O)cc1
OC(=O)COc1ccc(cc1)-c1nc2n(CC=C)c(=O)n(CC=C)c(=O)c2[nH]1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(I)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(F)(F)F)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(C)cc2)cc1
COc1ccc(CCCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1
Nc1nc2n[nH]cc2c2nc(nn12)-c1ccco1
[#6]\[#6](-[#6])=[#6]\[#6]-n1cc2c(n1)nc(-[#7])n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(N)n1nc(nc21)-c1ccco1
[#6]\[#6](-[#6])=[#6]/[#6]-n1cc2c(n1)nc(-[#7]-[#6](=O)-[#7]-c1cccc(Cl)c1)n1nc(nc21)-c1ccco1
COc1ccc(NC(=O)Nc2nc3nn(CCC(C)C)cc3c3nc(nn23)-c2ccco2)cc1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccc(OC)cc1)n1nc(nc21)-c1ccco1
Nc1nc2nn(CCc3cccc4ccccc34)cc2c2nc(nn12)-c1ccco1
CC(C)CCn1cc2c(n1)nc(N)n1nc(nc21)-c1ccco1
CC(C)(C)n1cc2c(n1)nc(NC(=O)Nc1cccc(Cl)c1)n1nc(nc21)-c1ccco1
COc1ccc(NC(=O)Nc2nc3nn(CCCc4ccccc4)cc3c3nc(nn23)-c2ccco2)cc1
COc1ccc(NC(=O)Nc2nc3n[nH]cc3c3nc(nn23)-c2ccco2)cc1
COc1ccc(NC(=O)Nc2nc3nn(CCc4cccc5ccccc45)cc3c3nc(nn23)-c2ccco2)cc1
CCCCn1cc2c(n1)nc(N)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1cccc(Cl)c1)n1nc(nc21)-c1ccco1
Clc1cccc(NC(=O)Nc2nc3nn(CCc4cccc5ccccc45)cc3c3nc(nn23)-c2ccco2)c1
CC(C)CCn1cc2c(n1)nc(NC(=O)Nc1cccc(Cl)c1)n1nc(nc21)-c1ccco1
Clc1cccc(NC(=O)Nc2nc3nn(CCc4cc(Br)c(Br)cc4Br)cc3c3nc(nn23)-c2ccco2)c1
Clc1cccc(NC(=O)Nc2nc3nn(CCCc4ccccc4)cc3c3nc(nn23)-c2ccco2)c1
CCCn1cc2c(n1)nc(N)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1cccc(Cl)c1)n1nc(nc21)-c1ccco1
COc1ccc(NC(=O)Nc2nc3nn(CCc4cc(Br)c(Br)cc4Br)cc3c3nc(nn23)-c2ccco2)cc1
COc1ccc(NC(=O)Nc2nc3nn(cc3c3nc(nn23)-c2ccco2)C(C)(C)C)cc1
Clc1cccc(NC(=O)Nc2nc3nn(CCc4ccccc4)cc3c3nc(nn23)-c2ccco2)c1
CC(C)(C)n1cc2c(n1)nc(N)n1nc(nc21)-c1ccco1
COc1ccc(NC(=O)Nc2nc3ccc(Cl)cc3c3nc(nn23)-c2ccco2)cc1
Nc1nc2nn(CCc3cc(Br)c(Br)cc3Br)cc2c2nc(nn12)-c1ccco1
Nc1nc2nn(CCCc3ccccc3)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(N)n1nc(nc21)-c1ccco1
COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1
COc1ccc(NC(=O)Nc2nc3nn(CCc4ccccc4)cc3c3nc(nn23)-c2ccco2)cc1
CCCn1cc2c(n1)nc(NC(=O)Nc1cccc(Cl)c1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1cccc(Cl)c1)n1nc(nc21)-c1ccco1
[#6]-[#8]-c1ccc(-[#7]-[#6](=O)-[#7]-c2nc3nn(-[#6]\[#6]=[#6](\[#6])-[#6])cc3c3nc(nn23)-c2ccco2)cc1
Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccco1
Clc1cccc(NC(=O)Nc2nc3ccc(Cl)cc3c3nc(nn23)-c2ccco2)c1
Clc1cccc(NC(=O)Nc2nc3n[nH]cc3c3nc(nn23)-c2ccco2)c1
COc1ccc(NC(=O)Nc2nc3nn(CC=C)cc3c3nc(nn23)-c2ccco2)cc1
CCn1cc2c(n1)nc(NC(=O)Nc1ccc(OC)cc1)n1nc(nc21)-c1ccco1
Fc1cnccc1-c1ncc(NC(=O)C2CC2)nc1-c1cccnc1
COC(=O)C1=C2C=CN(C)C=C2c2nc(nn2C1)-c1ccccc1 |c:4,6,10|
Cn1c(nc2c(N)nc(nc12)C#CC1(O)CCCCC1)-c1ccc(Cl)cc1
Cn1c(nc2c(N)nc(nc12)C#CC1(O)CCCCC1)-c1ccccc1F
Cn1c(nc2c(N)nc(nc12)C#CC1(O)CCCCC1)-c1cccc(c1)C(F)(F)F
CCC(O)(CC)C#Cc1nc(N)c2nc(-c3cccc(F)c3)n(C)c2n1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccccc1
Cn1c(nc2c(N)nc(nc12)C#CC1(O)CCCC1)-c1cccc(F)c1
Cn1c(nc2c(N)nc(nc12)C#CC1(O)CCCCC1)-c1cccc(c1)C#N
Cn1c(nc2c(N)nc(nc12)C#CC1(O)CCCCCC1)-c1cccc(F)c1
OCC[C@H]1CCCCN1C(=O)\C=C\c1c(nn2ccccc12)-c1ccccc1
Cn1c(nc2c(N)nc(nc12)C#CC(C)(C)O)-c1cccc(F)c1
Cn1c(nc2c(N)nc(nc12)C#CC1(O)CCCCC1)-c1ccco1
Cn1c(nc2c(N)nc(nc12)C#CC1(O)CCCCC1)-c1ccc(F)cc1
CCCn1c2nc(\C=C\c3ccc(OC)c(OC)c3)n(C)c2c(=O)n(CCC)c1=O
Cn1c(nc2c(N)nc(nc12)C#CC1(O)CCCCC1)-c1cccc(F)c1
Nc1ccc(CCCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1
Nc1nc2n(CCc3ccc(cc3)S(=O)(=O)N(CCO)CCO)ncc2c2nc(nn12)-c1ccco1
NCc1ccc(CCCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1
Nc1nc2n(CCCc3ccc4OC(CO)(CO)Oc4c3)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCCc3ccc4OC(Oc4c3)(C(O)=O)C(O)=O)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCc3ccc(cc3)S(=O)(=O)NCC(O)=O)ncc2c2nc(nn12)-c1ccco1
CC(=O)Nc1ccc(CCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1
CCOC(=O)COc1ccc(CCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1
CCOC(=O)[C@@H]1Oc2ccc(CCCn3ncc4c5nc(nn5c(N)nc34)-c3ccco3)cc2O1
Nc1nc2n(CCCc3ccc4OC(Oc4c3)(C([O-])=O)C([O-])=O)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCCc3ccc(cc3)C(O)=O)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCc3ccc(cc3)S(N)(=O)=O)ncc2c2nc(nn12)-c1ccco1
Nc1ccc(CCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1
Nc1nc2n(CCCc3ccc(cc3)[N+]([O-])=O)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCCc3ccc(cc3)C#N)ncc2c2nc(nn12)-c1ccco1
CN1CCN(CC1)S(=O)(=O)c1ccc(CCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1
Nc1nc2n(CCc3ccc(cc3)S(O)(=O)=O)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCCc3cc4OCOc4cc3S(O)(=O)=O)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCCc3ccc(cc3)S(O)(=O)=O)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCCc3ccc(cc3)C(=N)NO)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCCc3ccc4O[C@H](Oc4c3)C(O)=O)ncc2c2nc(nn12)-c1ccco1
CCOC(=O)c1ccc(CCCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1
NC(=N)c1ccc(CCCn2ncc3c4nc(nn4c(N)nc23)-c2ccco2)cc1
Nc1nc2n(CCc3ccc(cc3)S(=O)(=O)N(CCCl)CCCl)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCc3ccc(cc3)N(CCO)CCO)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCCc3ccccc3)ncc2c2nc(nn12)-c1ccco1
Nc1nc2n(CCCc3ccc(cc3)N(CCO)CCO)ncc2c2nc(nn12)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccc(Br)cc1)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccc(F)cc1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccc(C)cc1)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)C(F)(F)F)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(F)cc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)[N+]([O-])=O)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccccc1OC)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)[N+]([O-])=O)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccc(Cl)cc1)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccccc1Cl)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(Br)cc1)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Cc1ccccc1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1cccc(OC)c1)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(F)cc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)S(O)(=O)=O)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccc3OCOc3c1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccc(Br)cc1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1cccc(OC)c1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(Br)cc1)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)C(F)(F)F)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(C)cc1)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(Cl)cc1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccc3OCOc3c1)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccc(Cl)c(Cl)c1)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccccc1Cl)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccccc1Cl)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)C(F)(F)F)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccc(C)cc1)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Cc1ccccc1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccc(Cl)c(Cl)c1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Cc1ccccc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc3OCOc3c1)n1nc(nc21)-c1ccco1
Cc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1
CCn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)S(O)(=O)=O)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)S(O)(=O)=O)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccccc1OC)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccccc1OC)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(Cl)c(Cl)c1)n1nc(nc21)-c1ccco1
COc1cccc(NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)c1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccc(F)cc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)C(F)(F)F)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)[N+]([O-])=O)n1nc(nc21)-c1ccco1
COc1ccccc1NC(=O)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1cccc(OC)c1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccc3OCOc3c1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(Cl)cc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1ccccc1)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)S(O)(=O)=O)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Nc1ccc(cc1)[N+]([O-])=O)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccc(Cl)cc1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Nc1ccccc1Cl)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(Cl)c(Cl)c1)n1nc(nc21)-c1ccco1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S([O-])(=O)=O
O=c1[nH]c2nc([nH]c2c(=O)[nH]1)-c1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)C1CCCC1
Cn1c(=O)[nH]c2cc([nH]c2c1=O)-c1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(Br)cc1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccccc1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)N2CCN(CC2)C(C)=O)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccccc1
Brc1ccc(cc1)-c1nc2[nH]c(=O)n(CC#C)c(=O)c2[nH]1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCCO)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc2cc(ccc2c1)C(O)=O
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S([O-])(=O)=O
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)C(O)=O
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)OC)cc1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)N2CCN(CC2)C(=O)OCc2ccccc2)cc1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2)cc1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(C=CC(=O)OC)cc1 |w:19.21|
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)N2CCN(CC2)C(=O)OCC)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCCN)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(O)=O)cc1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(=O)OC)cc1
CCCn1c(=O)[nH]c2cc([nH]c2c1=O)-c1ccccc1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)N2CCN(Cc3ccccc3)CC2)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(C=CC(O)=O)cc1 |w:19.21|
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)N2CCN(CC)CC2)cc1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2OC)cc1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(Br)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(I)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)S([O-])(=O)=O
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(O)=O)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(Br)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(O)cc1O
Cn1c2nc[nH]c2c(=O)n(CCCc2ccccc2)c1=O
Cn1c2nc[nH]c2c(=O)n(CC#C)c1=O
Cn1cnc2n(CC#C)c(=O)n(C)c(=O)c12
CCn1c(=O)n(C)c2nc[nH]c2c1=O
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccccc1C(O)=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cccc(O)c1O
Cn1c2nc[nH]c2c(=O)n(Cc2ccccc2)c1=O
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)[N+]([O-])=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(O)c(OC)c(O)c1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1cccc(c1)C(O)=O
Cn1c2ncn(CC=C)c2c(=O)n(C)c1=O
Cn1cnc2n(C)c(=O)n(CC#N)c(=O)c12
CCCn1c(=O)[nH]c2nc[nH]c2c1=O
Cn1c2ncn(CCN)c2c(=O)n(C)c1=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC)cc1O
Cn1c2ncn(CCCCl)c2c(=O)n(C)c1=O
Cn1cnc2n(C)c(=O)n(CC#C)c(=O)c12
CC(=O)Cn1c(=O)n(C)c2ncn(C)c2c1=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(NC(C)=O)cc1
Cn1c2nc([nH]c2c(=O)n(CC=C)c1=O)-c1ccccc1
CC(C)CCn1c(=O)n(CC(C)C)c2nc([nH]c2c1=O)-c1ccccc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1c(F)cccc1F
C=CCn1c(=O)[nH]c2nc[nH]c2c1=O
CCn1c2nc[nH]c2c(=O)n(CC)c1=O
Cn1cnc2n(CC=C)c(=O)n(CC=C)c(=O)c12
CC(=O)CCCCN1C(=O)c2c(ncn2C)N(C1=O)C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(O)ccc1O
Cn1c(nc2n(C)c(=O)n(CC=C)c(=O)c12)-c1ccccc1
CCCn1c2nc(-c3ccccc3)n(CCCl)c2c(=O)n(CCC)c1=O
Cn1c2ncn(CC#C)c2c(=O)n(C)c1=O
O=c1[nH]c2nc[nH]c2c(=O)n1CC#C
O=c1[nH]c2nc[nH]c2c(=O)n1CCc1ccccc1
CC(C)CCn1c(=O)n(CC(C)C)c2nc[nH]c2c1=O
Cn1c2ncn(CCCCCl)c2c(=O)n(C)c1=O
C=CCn1c2nc[nH]c2c(=O)n(CC=C)c1=O
CC(C)n1c2nc[nH]c2c(=O)n(C)c1=O
O=c1[nH]c2nc[nH]c2c(=O)n1C1CCCC1
Cn1c2nc[nH]c2c(=O)n(CCc2ccccc2)c1=O
CC(=O)OCCn1cnc2n(C)c(=O)n(C)c(=O)c12
CCCCn1c(=O)[nH]c2nc[nH]c2c1=O
Cn1c2ncn(CCO)c2c(=O)n(C)c1=O
Cn1c2ncn(CC(O)=O)c2c(=O)n(C)c1=O
CN1c2c(n(cn2)CCCl)C(=O)N(C1=O)C
Cn1c2nc(-c3ccccc3)n(CCCl)c2c(=O)n(CC=C)c1=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnccn1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(O)cc1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(O)(=O)=O
Cn1c2ncn(CC#N)c2c(=O)n(C)c1=O
Cn1c2ncn(Cc3ccccc3)c2c(=O)n(C)c1=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(O)=O)cc1O
Cn1cnc2n(C)c(=O)n(CC(O)=O)c(=O)c12
COCn1c(=O)n(C)c2ncn(C)c2c1=O
CC(=O)OCCn1c(=O)n(C)c2ncn(C)c2c1=O
COc1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccccc1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
CCCCCCn1c2nc[nH]c2c(=O)n(CCCCCC)c1=O
CCCCn1c(=O)n(CC)c2nc[nH]c2c1=O
CN(C)c1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(Cl)cc1OC
Cn1cc2c(n1)nc(NC(=O)Nc1cc[nH+]cc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccncc1)n1nc(nc21)-c1ccco1
CCCCc1nc2nc[nH]c2c2nc(nn12)-c1ccc(OC)cc1
CCCCc1nc2nc[nH]c2c2nc(nn12)-c1ccc(cc1)C(F)(F)F
CCCCc1nc2nc[nH]c2c2nc(nn12)-c1ccc(OCCC)cc1
CCCCc1nc2nc[nH]c2c2nc(nn12)-c1ccc(OCC)cc1
CCCCc1nc2nc[nH]c2c2nc(nn12)-c1ccc(cc1)N(C)C
CC(C)CCn1cc2c(n1)nc(NC(=O)Cc1ccccc1)n1nc(nc21)-c1ccco1
O=C(Cc1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(nn12)-c1ccco1
O=C(COc1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(nn12)-c1ccco1
O=C(Cc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccco1
CC(C)CCn1cc2c(n1)nc(NC(=O)COc1ccccc1)n1nc(nc21)-c1ccco1
O=C(COc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccco1
CC(C)CCn1cc2c(n1)nc(NC(=O)Cc1cccc3ccccc13)n1nc(nc21)-c1ccco1
O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(nn12)-c1ccco1
O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccco1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)[N+]([O-])=O
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)[N+]([O-])=O
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(O)(=O)=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)S(O)(=O)=O
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)Oc1cccc(c1)[N+]([O-])=O
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)Oc1cccc(c1)[N+]([O-])=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)S(=O)(=O)Oc1cccc(c1)[N+]([O-])=O
OC(=O)c1cnc(NCc2ccc(cc2)C(F)(F)F)n2nc(nc12)-c1ccco1
OC(=O)c1cnc(NCc2ccc(cc2)-c2ccccc2)n2nc(nc12)-c1ccco1
OC(=O)c1cnc(NC(c2ccccc2)c2ccccc2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(SC)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCc2ccc(OC)c(OC)c2)n2nc(nc12)-c1ccco1
COc1ccc(CNc2ncc(C(O)=O)c3nc(nn23)-c2ccco2)cc1OC
CNC(=O)c1cnc(NCc2ccc(OC)c(OC)c2)n2nc(nc12)-c1ccco1
COc1ccc(CNc2ncc(C(=O)NCCc3ccccc3)c3nc(nn23)-c2ccco2)cc1OC
CNC(=O)c1cnc(N)n2nc(nc12)-c1ccco1
Nc1ncc(C(=O)NCCc2ccccc2)c2nc(nn12)-c1ccco1
CCOC(=O)c1cnc(N)n2nc(nc12)-c1ccco1
CNC(=O)c1cnc(NC(=O)Nc2ccccc2)n2nc(nc12)-c1ccco1
CNC(=O)c1cnc(NC(=O)NC2CCCCC2)n2nc(nc12)-c1ccco1
CNC(=O)c1cnc(NC(=O)Cc2ccccc2)n2nc(nc12)-c1ccco1
O=C(Nc1ccccc1)Nc1ncc(C(=O)NCCc2ccccc2)c2nc(nn12)-c1ccco1
O=C(NC1CCCCC1)Nc1ncc(C(=O)NCCc2ccccc2)c2nc(nn12)-c1ccco1
O=C(Cc1ccccc1)Nc1ncc(C(=O)NCCc2ccccc2)c2nc(nn12)-c1ccco1
CCOC(=O)c1cnc(NC(=O)Nc2ccccc2)n2nc(nc12)-c1ccco1
CCOC(=C)c1cnc(NC(=O)NC2CCCCC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NC(=O)Cc2ccccc2)n2nc(nc12)-c1ccco1
OC(=O)c1cnc(NC(=O)NC2CCCCC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NC)n2nc(nc12)-c1ccco1
CCNc1ncc(C(=O)OCC)c2nc(nn12)-c1ccco1
CCCCCNc1ncc(C(=O)OCC)c2nc(nn12)-c1ccco1
CCOC(=O)c1cnc(NC(C)C)n2nc(nc12)-c1ccco1
CCCCC(CC)CNc1ncc(C(=O)OCC)c2nc(nn12)-c1ccco1
CCOC(=O)c1cnc(NC2CC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NC2CCCC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCC2CCCCC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCc2ccccc2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCc2ccc(C)cc2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCc2ccc(OC)cc2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCc2ccc(F)cc2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCc2ccc(Cl)cc2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCc2ccc(cc2)C(F)(F)F)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCc2ccc(cc2)-c2ccccc2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NC(c2ccccc2)c2ccccc2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NC2CCC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NC2CCCCCC2)n2nc(nc12)-c1ccco1
CCCC(=C)C1=CC=C(CC2CCCCCCC2)C2C=C(C=C12)C1=CC=CC1 |c:20,28,t:5,7,22,26|
CCOC(=O)c1cnc(N2CCCC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(N2CCCCC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCCOC)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(N(C)C)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(N2CCOCC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NC2CCCCC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NN2CCOCC2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCC(C)C)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NOC)n2nc(nc12)-c1ccco1
CNc1ncc(C(O)=O)c2nc(nn12)-c1ccco1
CCNc1ncc(C(O)=O)c2nc(nn12)-c1ccco1
CCCCCNc1ncc(C(O)=O)c2nc(nn12)-c1ccco1
CC(C)Nc1ncc(C(O)=O)c2nc(nn12)-c1ccco1
CCCCC(CC)CNc1ncc(C(O)=O)c2nc(nn12)-c1ccco1
OC(=O)c1cnc(NC2CC2)n2nc(nc12)-c1ccco1
OC(=O)c1cnc(NC2CCCC2)n2nc(nc12)-c1ccco1
OC(=O)c1cnc(NCC2CCCCC2)n2nc(nc12)-c1ccco1
OC(=O)c1cnc(NCc2ccccc2)n2nc(nc12)-c1ccco1
Cc1ccc(CNc2ncc(C(O)=O)c3nc(nn23)-c2ccco2)cc1
COc1ccc(CNc2ncc(C(O)=O)c3nc(nn23)-c2ccco2)cc1
OC(=O)c1cnc(NCc2ccc(F)cc2)n2nc(nc12)-c1ccco1
OC(=O)c1cnc(NCc2ccc(Cl)cc2)n2nc(nc12)-c1ccco1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc3OCOc3c2)nn1C
CCCCc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccc(Cl)cc1
CCCCc1nc2n[nH]cc2c2nc(nn12)-c1ccccc1
COCCc1nc2nc[nH]c2c2nc(nn12)-c1ccc(cc1)-c1ccccc1
CCCCc1nc2cc(Cl)ccc2c2nc(nn12)-c1ccccc1
OC(=O)CCCc1nc2nc[nH]c2c2nc(nn12)-c1ccc(Cl)cc1
CCCCc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccccc1
CCCCc1nc2ccccc2c2nc(nn12)-c1ccccc1
CCCCc1nc2n[nH]cc2c2nc(nn12)-c1ccc(F)cc1
CCCCc1nc2n[nH]cc2c2nc(nn12)-c1ccc(Cl)cc1
CCCCc1nc2nc[nH]c2c2nc(nn12)-c1ccc(cc1)-c1ccccc1
OC(=O)CCCc1nc2nc[nH]c2c2nc(nn12)-c1ccc(cc1)-c1ccccc1
CCCCc1nc2n[nH]cc2c2nc(nn12)-c1ccc(C)cc1
CCCc1nc2n[nH]cc2c2nc(nn12)-c1ccccc1
CCCCc1nc2ccccc2c2nc(nn12)-c1ccc(Cl)cc1
CCCCc1nc2ccccc2c2nc(nn12)-c1ccc(Br)cc1
Cn1nc(c(CN2CCN(CC2)c2nc(N)n3nc(nc3n2)-c2ccco2)c1Cl)C(F)(F)F
Cc1nc(N)c2nn(cc2n1)-c1ccccc1
Nc1nc(nc2cn(nc12)-c1ccccc1)-c1ccccc1
Nc1nc(Cc2ccccc2)nc2cn(nc12)-c1ccccc1
Nc1ncnc2cn(nc12)-c1ccccc1
Nc1nc(Cc2ccccc2F)nc2cn(nc12)-c1ccccc1
Nc1nc(CCCc2ccccc2)nc2cn(nc12)-c1ccccc1
COc1ccccc1CCCc1nc(N)c2nn(cc2n1)-c1ccccc1
COc1cccc(CCCc2nc(N)c3nn(cc3n2)-c2ccccc2)c1
Nc1nc(CCCc2ccccc2O)nc2cn(nc12)-c1ccccc1
Nc1nc(CCCc2cccc(O)c2)nc2cn(nc12)-c1ccccc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccc(F)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2cccc(F)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2cccc(Cl)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccccc2F)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccc(OC)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2ccc(OC)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2cccc(c2)C(F)(F)F)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2ccc(cc2)C#N)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccccc2OC)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2ccccc2OC)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2ccc(cc2)C(F)(F)F)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2cccc(F)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2ccc(F)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2ccccc2Cl)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccccc2C)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccc(C)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccccc2C(F)(F)F)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2cccc(OC)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2cccc(C)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccc(Cl)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2cccc(C)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2cccc(OC)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2cccc(c2)C(F)(F)F)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2cccc(Cl)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2ccccc2C)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2ccc(Cl)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2ccc(C)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccc(cc2)C#N)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccc(cc2)C(F)(F)F)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2nc(no2)-c2ccccc2Cl)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCc2noc(n2)-c2ccccc2F)cc1
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(C)cn3c2c1=O
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(CC)c(C)n3c2c1=O
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(CC)cn3c2c1=O
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(cn3c2c1=O)C1CC1
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(cn3c2c1=O)C1CCCCC1
CCCn1c(=O)n(Cc2ccccc2)c2nc3C=C(CC)Cn3c2c1=O |t:18|
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(cn3c2c1=O)C(C)C
CCCn1c(=O)n(Cc2ccccc2)c2nc3C=C(C)C(C)n3c2c1=O |t:18|
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(C)c(C)n3c2c1=O
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(cn3c2c1=O)C(C)(C)C
CCCn1c(=O)n(Cc2ccccc2)c2nc3C=C(C)Cn3c2c1=O |t:18|
Cn1cc2c(nc(N)nc2n1)C(N)=O
CCOC(=O)c1nc(nc2nn(C)cc12)N(C(=O)c1ccccc1)C(=O)c1ccccc1
CCOC(=O)c1nc(nc2nn(C)cc12)N(C(=O)c1ccc(Br)cc1)C(=O)c1ccc(Br)cc1
CCOC(=O)c1nc(nc2nn(C)cc12)N(C(=O)c1ccc(F)c(F)c1)C(=O)c1ccc(F)c(F)c1
CCOC(=O)c1nc(nc2nn(cc12)C(C)C)N(C(=O)c1ccccc1)C(=O)c1ccccc1
CCOC(=O)c1nc(nc2nn(CCc3ccccc3)cc12)N(C(=O)c1ccccc1)C(=O)c1ccccc1
CCOC(=O)c1nc(NC(=O)Cc2ccccc2)nc2nn(C)cc12
CCOC(=O)c1nc(NC(=O)Cc2ccccc2)nc2nn(cc12)C(C)C
CCOC(=O)c1nc(NC(=O)Cc2ccccc2)nc2nn(CC(C)(C)C)cc12
CCOC(=O)c1nc(NC(=O)Cc2ccccc2)nc2nn(CCc3ccccc3)cc12
CC(C)n1cc2c(nc(N)nc2n1)C(N)=O
CC(C)(C)Cn1cc2c(nc(N)nc2n1)C(N)=O
NC(=O)c1nc(N)nc2nn(CCc3ccccc3)cc12
CCOC(=O)c1nc(N)nc2nn(C)cc12
CCOC(=O)c1nc(N)nc2nn(cc12)C(C)C
CCOC(=O)c1nc(N)nc2nn(CC(C)(C)C)cc12
CCOC(=O)c1nc(N)nc2nn(CCc3ccccc3)cc12
CCOC(=O)c1nc(NC(=O)c2ccccc2)nc2nn(C)cc12
CCOC(=O)c1nc(NC(=O)c2ccc(F)cc2)nc2nn(C)cc12
CCOC(=O)c1nc(NC(=O)c2ccc(cc2)C(F)(F)F)nc2nn(C)cc12
CCOC(=O)c1nc(NC(=O)c2ccc(C)cc2)nc2nn(C)cc12
CCOC(=O)c1nc(NC(=O)c2ccccc2)nc2nn(cc12)C(C)C
CCOC(=O)c1nc(NC(=O)c2ccc(F)cc2)nc2nn(cc12)C(C)C
CCOC(=O)c1nc(NC(=O)c2ccc(cc2)C(F)(F)F)nc2nn(cc12)C(C)C
CCOC(=O)c1nc(NC(=O)c2ccc(C)cc2)nc2nn(cc12)C(C)C
CCOC(=O)c1nc(NC(=O)c2ccc(F)cc2)nc2nn(CC(C)(C)C)cc12
CCOC(=O)c1nc(NC(=O)c2ccccc2)nc2nn(CCc3ccccc3)cc12
CCOC(=O)c1nc(NC(=O)c2ccc(F)cc2)nc2nn(CCc3ccccc3)cc12
CCOC(=O)c1nc(NC(=O)c2ccc(cc2)C(F)(F)F)nc2nn(CCc3ccccc3)cc12
CCOC(=O)c1nc(NC(=O)c2ccc(C)cc2)nc2nn(CCc3ccccc3)cc12
CCOC(=O)c1nc(NC(=O)c2ccc(Br)cc2)nc2nn(CCc3ccccc3)cc12
CCOC(=O)c1nc(NC(=O)c2ccc(Cl)c(Cl)c2)nc2nn(CCc3ccccc3)cc12
COc1ccc(cc1)-n1cc2c(n1)c1ccccc1[nH]c2=O
Cc1ccc(cc1)-n1cc2c(n1)c1ccccc1[nH]c2=O
Fc1ccc(cc1)-n1cc2c(n1)c1ccccc1[nH]c2=O
CCc1ccc(cc1)-n1cc2c(n1)c1ccccc1[nH]c2=O
COc1nc2ccccc2c2nn(cc12)-c1ccccc1
Clc1ccc(cc1)-n1cc2c(n1)c1ccccc1[nH]c2=O
c1n(nc2c1cnc1ccccc21)-c1ccccc1
Clc1ccccc1-n1cc2c(n1)c1ccccc1[nH]c2=O
S=c1[nH]c2ccccc2c2nn(cc12)-c1ccccc1
C(Nc1nc2ccccc2c2nn(cc12)-c1ccccc1)c1ccccc1
O=c1[nH]c2ccccc2c2nn(cc12)-c1ccccc1
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(Cl)nc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC)nc(Cl)nc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CC3)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CC3)nc(Cl)nc12 |r|
[H][C@@]12CC[C@]([H])(C1)[C@H](C2)Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)c1nnn(CC)n1 |r|
[H][C@@]12CC[C@]([H])(C1)[C@H](C2)Nc1nc(Cl)nc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)c1nnn(CC)n1 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCO3)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCO3)nc(Cl)nc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(Cl)cc3F)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(Cl)cc3F)nc(Cl)nc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccccc3I)nc(Cl)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccccc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccc(F)cc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccc(OC)cc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccc(OCCOC)cc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccc(OCc2ccccc2)cc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccc(OCc2ccc(Cl)cc2)cc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccc(OCc2ccc(F)cc2)cc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccc(OCc2ccc(cc2)C(F)(F)F)cc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccc(OCc2ccncc2)cc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccc(OCCCc2ccccc2)cc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)N1CCN(CC1)c1ccc(OCC(=O)OCC)cc1 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CCc4ccccc4)CC3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(Cc4ccccc4)CC3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCCN3CCN(CC3)c3ccccc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccccc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(F)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(Cl)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(Br)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(I)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(cc3)C(F)(F)F)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(C)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(OC)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(OCCOC)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(cc3)C(O)=O)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(CC(O)=O)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3cccc(Cl)c3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3cccc(c3)C(O)=O)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccccc3F)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccccc3Cl)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccccc3C(F)(F)F)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccccc3OC)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(F)c(Cl)c3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(Cl)c(Cl)c3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3cc(Cl)cc(Cl)c3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3cccc(F)c3F)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(Cl)cc3F)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCN3CCN(CC3)c3ccc(CC(O)=O)cc3Br)nc12 |r|
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(O)=O)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)nc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(=O)[nH]c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(N)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2cccc(OC)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2ccccc2C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2cccc(Cl)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2ccccc2C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2ccccc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(on2)-c2ccccc2OC)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(on2)-c2ccc(Cl)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(on2)-c2ccc(cc2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(on2)-c2ccccc2C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2ccc(cc2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2ccc(cc2)C#N)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2cccc(OC)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(on2)-c2ccc(OC)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(on2)-c2cccc(Cl)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC(=O)Nc2ccccc2Cl)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2ccc(C)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2ccc(cc2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2ccc(OC)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2ccccc2Cl)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2ccc(Cl)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2cccc(Cl)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(on2)-c2ccccc2Cl)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2ccccc2OC)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(on2)-c2cccc(OC)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2ccc(cc2)C#N)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2ccccc2OC)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2ccccc2Cl)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2ccc(Cl)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2ccc(OC)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2noc(n2)-c2ccccc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2nc(no2)-c2cccc(C)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(on2)-c2ccccc2)c1
CN(C)C(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12 |r|
CN(C)C(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(I)c3)nc(nc12)N(C)C
CN(C)C(=O)[C@H]1S[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12 |r|
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)Nc1ccccn1
CCn1c2cc([nH]c2c(=O)n(CC)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(F)c2)CC1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(F)cc2)CC1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)S(=O)(=O)NC1CCN(Cc2ccccc2)CC1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)NCCc1ccccn1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)NCc1ccc(OC)cn1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc3OCOc3c2)CC1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)NC1CCN(Cc2ccccc2)CC1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccccc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)NCCc1ccccn1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(Br)cc2)CC1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(Cl)s2)CC1
COc1ccc(CNS(=O)(=O)c2ccc(cc2)-c2cc3n(C)c(=O)n(C)c(=O)c3[nH]2)nc1
COc1ccc(NS(=O)(=O)c2ccc(cc2)-c2cc3n(C)c(=O)n(C)c(=O)c3[nH]2)cn1
CN(C1CCN(Cc2ccccc2)CC1)S(=O)(=O)c1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(F)c2)CC1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(F)cc2F)CC1
CCn1c2cc([nH]c2c(=O)n(CC)c1=O)-c1ccc(cc1)S(=O)(=O)NCCc1ccccn1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)NCCOc1ccccn1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(cc2)C#N)CC1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(F)c2)CC1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccccc2)CC1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccncc2)CC1
CCn1c2cc([nH]c2c(=O)n(CC)c1=O)-c1ccc(cc1)S(=O)(=O)NC1CCN(Cc2ccc(F)cc2)CC1
CCCc1c(cnn1-c1ccccc1)-c1nc2n(CCC)c(=O)n(CCC)c(=O)c2[nH]1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(c1C(F)(F)F)-c1ccccc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)nn1CC
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CCc2ccccc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccccc2)c1
CCn1c2nc([nH]c2c(=O)n(CC)c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccc(cc2)C(F)(F)F)c1
CCn1c2nc([nH]c2c(=O)n(CC)c1=O)-c1cnn(Cc2ccccc2)c1
CC(C)Cn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cccc(F)c2F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccccc2F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(c1C(F)(F)F)-c1ccc(Cl)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(Cl)ccc2Cl)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccc(Cl)c(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccccc2C)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cccc(C)c2F)c1
CC(C)Cn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cccc(OC)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-n1cccn1
CCCCn1c2nc([nH]c2c(=O)n(CCCC)c1=O)-c1cnn(Cc2ccccc2)c1
CCCn1c2nc(-n3cc(I)cn3)n(Cc3ccccc3)c2c(=O)n(CCC)c1=O
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1cnn(Cc2ccccc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2c(F)cc(F)cc2F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccc(Cl)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cn[nH]c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cccc(Cl)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cccc(Cl)c2F)c1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2c(F)cccc2F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccccc2OC)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cccc(C)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccc(F)c(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(F)ccc2Cl)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(ccc2Cl)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccnn1-c1ccccc1
CCn1c2nc([nH]c2c(=O)n(CC)c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccc(F)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccc(C)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccc(F)c(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccc(F)cc2F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccccc2Cl)c1
CCCn1c2nc(-n3cccn3)n(Cc3ccccc3)c2c(=O)n(CCC)c1=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(c1)-c1ccccc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CCCc2ccccc2)c1
CC(C)Cn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cnn(Cc2ccccc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccc(OC)c(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(c1C)-c1ccccc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cc(cc(Cl)c2F)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccccc2C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(Cc2ccc(OC)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(OC)c(OC)c2)nn1C
O=C(N(C(=O)c1ccccc1)c1nc2ccccc2n2c1nn(-c1ccccc1)c2=O)c1ccccc1
COc1ccc(cc1)-n1nc2c(NC(=O)c3ccccc3)nc3c(N)cccc3n2c1=O
COc1ccc(cc1)-n1nc2c(nc3ccccc3n2c1=O)N(C(=O)c1ccccc1)C(=O)c1ccccc1
COc1ccc(cc1)-n1nc2c(NC(=O)C(c3ccccc3)c3ccccc3)nc3ccccc3n2c1=O
O=C(Nc1cccnc1)Nc1nc2nn(CCOCc3ccccc3)cc2c2nc(nn12)-c1ccco1
OCCn1cc2c(n1)nc(NC(=O)Nc1cccnc1)n1nc(nc21)-c1ccco1
O=C(Nc1ccncc1)Nc1nc2nn(CCCOCc3ccccc3)cc2c2nc(nn12)-c1ccco1
OCCn1cc2c(n1)nc(NC(=O)Nc1ccncc1)n1nc(nc21)-c1ccco1
O=C(Nc1ccncc1)Nc1nc2nn(CCOCc3ccccc3)cc2c2nc(nn12)-c1ccco1
OCCCn1cc2c(n1)nc(NC(=O)Nc1ccncc1)n1nc(nc21)-c1ccco1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)NCCc1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)NCCO
CCCCNS(=O)(=O)c1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)NCC(O)=O
CCCN(CCC)S(=O)(=O)c1ccc(cc1)-c1nc2[nH]c(=O)n(CCC)c(=O)c2[nH]1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)NCCc1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)NCc1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)Nc1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccccc2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)NCC(O)=O
CC(C)NS(=O)(=O)c1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(=O)(=O)NCCO
CCNC(=O)c1cnn(c1)-c1nc(Nc2ccncc2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ncc4ccccc4n3)nc(nc12)-n1cc(CO)cn1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(cc3)C(F)(F)F)nc(nc12)-n1cc(CO)cn1
CNC(=O)c1cnn(c1)-c1nc(N[C@H]2CCCO2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
CNC(=O)c1cnn(c1)-c1nc(NC2CCCC2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@H]3CCCO3)nc(nc12)-n1cc(cn1)C(=O)NCc1ccc(Cl)cc1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@H]3CCCO3)nc(nc12)-n1cc(cn1)C(O)=O
CCNC(=O)c1cnn(c1)-c1nc(NC2CCCC2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC34CCC(CC3)C4)nc(nc12)-n1cc(cn1)C(O)=O
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC34CCC(CC3)C4)nc(nc12)-n1cccn1
CCOC(=O)c1cnn(c1)-c1nc(NC23CCC(CC2)C3)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@H]3CCCO3)nc(nc12)-n1cc(cn1)C(=O)NCc1ccccc1
CCCNC(=O)c1cnn(c1)-c1nc(N[C@H]2CCCO2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
CCNC(=O)c1cnn(c1)-c1nc(Nc2ccc3ccccc3n2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3cnccn3)nc(nc12)-n1cc(CO)cn1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@H]3CCCO3)nc(nc12)-n1cc(cn1)C(=O)NCc1ccc(cc1)C(O)=O
CCNC(=O)c1cnn(c1)-c1nc(N[C@H]2CCCO2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
NC(=O)c1cnn(c1)-c1nc(NC2CCCC2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc4ccccc4n3)nc(nc12)-n1cc(CO)cn1
CCOC(=O)c1cnn(c1)-c1nc(N[C@H]2CCCO2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)nc(nc12)-n1cccn1
CCOC(=O)c1cnn(c1)-c1nc(NC2CCCC2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccccn3)nc(nc12)-n1cc(CO)cn1
CCOC(=O)c1cnn(c1)-c1nc(NC2CCCCC2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
CCOC(=O)c1ccc(CNC(=O)c2cnn(c2)-c2nc(N[C@H]3CCCO3)c3ncn([C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)c3n2)cc1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3cc(ccn3)C(O)=O)nc(nc12)-n1cc(CO)cn1
Cc1ccc(Nc2nc(nc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)-n2cc(CO)cn2)cc1
CNC(=O)c1cnn(c1)-c1nc(NC2CCCCC2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
CCNC(=O)c1cnn(c1)-c1nc(Nc2ccc(C)cc2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)nc(nc12)-n1cc(cn1)C(O)=O
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccncc3)nc(nc12)-n1cc(CO)cn1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@H]3CCCO3)nc(nc12)-n1cc(cn1)C(=O)NCc1ccc(F)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)[C@@]12CC[C@@](CC1)(CC2)\C=C\C(O)=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)[C@]12CC[C@](CCC(O)=O)(CC1)CC2
CCCn1c2[nH]c(nc2c(=O)n(CCC)c1=O)C12CC3CC(CC3C1)C2 |THB:22:21:18:23.24,22:23:18:20.21.25,24:17:20:22.23,24:23:20:18.25.17|
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)[C@@]12CC[C@@](CC1)(CC2)C(=O)NCCC(=O)OC
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)[C@@]12CC[C@@](CC1)(CC2)C(=O)NCC(=O)OC
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)[C@@]12CC[C@@](CC1)(CC2)C(=O)N(C)CC(=O)OC
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)[C@]12CC[C@](CCCC(O)=O)(CC1)CC2
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)[C@H]1CC2C[C@@H]1[C@H]1O[C@@H]21 |THB:6:17:20:22.24,23:22:20:18.17,23:24:20:18.17|
CCCn1c2nc(nc2c2N[C@H](CC)Cn2c1=O)C12CCC(O)(CC1)CC2
CCCn1c2nc(nc2c2N[C@@H](Cn2c1=O)C(C)C)C12CCC(CCC(O)=O)(CC1)CC2
CCCn1c2nc(nc2c2N[C@H](CC)Cn2c1=O)C12CCC(CCC(O)=O)(CC1)CC2
CCCn1c2nc(nc2c2N[C@H](C)Cn2c1=O)C12CCC(O)(CC1)CC2
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C12CCC(O)(CC1)CC2
CCCn1c2[nH]c(nc2c(=O)n(CCC)c1=O)C12CCC(CCC(O)=O)(CC1)CC2
CCCn1c2nc(nc2c2N[C@@H](Cn2c1=O)C(C)C)C12CCC(O)(CC1)CC2
CC(C)Cc1nc2c(cc(nc2[nH]1)-c1ccccc1)-c1ccccc1
C1CCC(C1)c1nc2c(cc(nc2[nH]1)-c1ccccc1)-c1ccccc1
CCC(CC)c1nc2c(cc(nc2[nH]1)-c1ccccc1)-c1ccccc1
C1CCC(CC1)c1nc2c(cc(nc2[nH]1)-c1ccccc1)-c1ccccc1
CC(C)c1nc2c(cc(nc2[nH]1)-c1ccccc1)-c1ccccc1
[O-][n+]1cccc(Nc2ncc(-c3ccncn3)c(n2)-c2ccco2)c1
COc1ccc(Nc2ncc(-c3ccncn3)c(n2)-c2ccco2)cn1
N(c1cncnc1)c1ncc(-c2ccncn2)c(n1)-c1ccco1
COc1ncc(Nc2ncc(-c3ccncn3)c(n2)-c2ccco2)cn1
N(c1cnccn1)c1ncc(-c2ccncn2)c(n1)-c1ccco1
Cn1cc(Nc2ncc(-c3ccncn3)c(n2)-c2ccco2)ccc1=O
O=c1ccc(Nc2ncc(-c3ccncn3)c(n2)-c2ccco2)cn1CC1CC1
N#Cc1cncc(Nc2ncc(-c3ccncn3)c(n2)-c2ccco2)c1
O=c1ccc(Nc2ncc(-c3ccncn3)c(n2)-c2ccco2)c[nH]1
CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)NCCc1ccc(Nc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1
CC1(C)NC(C)(C)c2cc(Nc3ncnc4n(cnc34)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)ccc12
CC1(C)CC(CC(C)(C)N1)Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)NCCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Cn1c2nc3N(CCc4ccc(O)cc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCc4c[nH]c5ccccc45)CCCn3c2c(=O)n(C)c1=O
CCCn1c2nc3N(CCc4ccccc4)CCCn3c2c(=O)n(CCC)c1=O
Cn1c2nc3N(CCc4ccccc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCc4ccccn4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCNCc4ccccc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCOc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O
CN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccco2)-n2cccn2)CC1
CC(C)Cn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2noc(n2)-c2ccc(cc2)C(F)(F)F)c1
CC(C)Cn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2ccccc2)c1
CC(C)Cn1c2nc([nH]c2c(=O)[nH]c1=O)-c1cnn(Cc2ccccc2)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2ccccc2)c1
CC(C)Cn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cc(on2)-c2ccccc2)c1
CCCn1c2nc([nH]c2c(=O)[nH]c1=O)-c1cnn(Cc2ccccc2)c1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2ccccc2)c1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2noc(n2)-c2ccc(Cl)cc2)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(F)c2)c1
O=c1[nH]c2nc([nH]c2c(=O)n1CC1CC1)-c1cnn(Cc2ccccc2)c1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cc(on2)-c2ccc(Cl)cc2)c1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
O=c1[nH]c2nc([nH]c2c(=O)n1Cc1ccccc1)-c1cnn(Cc2ccccc2)c1
CC(C)Cn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2ccccc2)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cc(on2)-c2ccccc2)c1
FC(F)(F)c1ccc(cc1)-c1cc(Cn2cc(cn2)-c2nc3[nH]c(=O)n(CC4CC4)c(=O)c3[nH]2)no1
Fc1cccc(Cn2cc(cn2)-c2nc3[nH]c(=O)n(CC4CC4)c(=O)c3[nH]2)c1
FC(F)(F)c1cccc(Cn2cc(cn2)-c2nc3[nH]c(=O)n(CC4CC4)c(=O)c3[nH]2)c1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
O=c1[nH]c(=O)c2[nH]c(nc2n1Cc1ccccc1)-c1cnn(Cc2ccccc2)c1
FC(F)(F)c1ccc(cc1)-c1nc(Cn2cc(cn2)-c2nc3[nH]c(=O)n(CC4CC4)c(=O)c3[nH]2)no1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2noc(n2)-c2ccc(cc2)C(F)(F)F)c1
Clc1ccc(cc1)-c1nc(Cn2cc(cn2)-c2nc3[nH]c(=O)n(CC4CC4)c(=O)c3[nH]2)no1
CC(C)Cn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(Cc2noc(n2)-c2ccccc2)c1
Cn1c2nc([nH]c2c(=O)[nH]c1=O)-c1cnn(Cc2ccccc2)c1
CCn1c2nc([nH]c2c(=O)[nH]c1=O)-c1cnn(Cc2ccccc2)c1
CCCCn1c2nc([nH]c2c(=O)[nH]c1=O)-c1cnn(Cc2ccccc2)c1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccccc1
Cn1c2cc(-c3ccccc3)n(O)c2c(=O)n(C)c1=O
Cn1c2c(O)c([nH]c2c(=O)n(C)c1=O)-c1ccccc1
Cc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2n1O
Cc1ccc(cc1)-c1[nH]c2c(c1O)n(C)c(=O)n(C)c2=O
Cn1c2c(O)c([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(C)(=O)=O
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccccc1
CCCn1c2cc(-c3ccccc3)n(O)c2c(=O)n(CCC)c1=O
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccccc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(C)cc1
CCCn1c2cc(-c3ccc(C)cc3)n(O)c2c(=O)n(CCC)c1=O
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(C)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(N)cc1
CCCn1c2cc(-c3ccc(N)cc3)n(O)c2c(=O)n(CCC)c1=O
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(N)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(O)cc1
CCCn1c2cc(-c3ccc(O)cc3)n(O)c2c(=O)n(CCC)c1=O
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(O)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC)cc1
CCCn1c2cc(-c3ccc(OC)cc3)n(O)c2c(=O)n(CCC)c1=O
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC)cc1
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)C(C)=O
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)[N+]([O-])=O
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)S(C)(=O)=O
CCCn1c(=O)n(C)c2c(O)c([nH]c2c1=O)-c1ccc(cc1)S(C)(=O)=O
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccco1
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)C(O)=O
CCCn1c2c(OS(O)(=O)=O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccco1
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(Br)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(Br)cc2)cc1
CCCn1c2c(O)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)N2CCN(Cc3ccccc3)CC2)cc1
CC(=O)Cn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(C)cn3c2c1=O
Cc1cn2c(nc3n(Cc4ccccc4)c(=O)[nH]c(=O)c23)[nH]1
Cc1cn2c(nc3n(Cc4ccccc4)c(=O)n(CCO)c(=O)c23)[nH]1
Cc1cn2c(nc3n(Cc4ccccc4)c(=O)n(CCCO)c(=O)c23)[nH]1
Cc1cn2c(nc3n(Cc4ccccc4)c(=O)n(CC=C)c(=O)c23)[nH]1
Cc1cn2c(nc3n(Cc4ccccc4)c(=O)n(CC#C)c(=O)c23)[nH]1
CCOC(=O)Cn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(C)cn3c2c1=O
CN(C)CCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(C)cn3c2c1=O
CC(CO)n1c(C)cn2c1nc1n(Cc3ccccc3)c(=O)[nH]c(=O)c21
CCn1c(C)cn2c1nc1n(Cc3ccccc3)c(=O)[nH]c(=O)c21
CCCn1c(=O)n(Cc2ccccc2)c2nc3n(CC)c(C)cn3c2c1=O
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(cn3c2c1=O)-c1ccccc1
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(cn3c2c1=O)-c1ccc(OC)cc1
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(cn3c2c1=O)-c1ccc(cc1)-c1ccccc1
CCCn1c(=O)n(Cc2ccccc2)c2nc3[nH]c(cn3c2c1=O)-c1ccc(F)cc1
CCCn1c(=O)n(Cc2ccccc2)c2nc3C=C(Cn3c2c1=O)c1ccccc1 |c:18|
CCCn1c2nc3[nH]c(cn3c2c(=O)n(CCC)c1=O)-c1ccccc1
CC(C)Cn1c2nc3[nH]c(cn3c2c(=O)n(CC(C)C)c1=O)-c1ccccc1
Cn1c2nc3[nH]c(cn3c2c(=O)n(C)c1=O)-c1ccccc1
Cc1cn2c(nc3n(C)c(=O)n(C)c(=O)c23)[nH]1
CCCn1c(=O)n(Cc2ccncc2)c2nc3[nH]c(C)cn3c2c1=O
CCCn1c(=O)n(Cc2cccnc2)c2nc3[nH]c(C)cn3c2c1=O
CCCn1c(=O)n(Cc2ccccn2)c2nc3[nH]c(C)cn3c2c1=O
Nc1ccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)cc1
Nc1cccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)c1
Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3N)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3ccsc3)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3cccs3)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3ccco3)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3cccnc3)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3ccccn3)c2n1
CC(C)N(C)C(=O)c1cccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)c1
CC(C)NC(=O)c1cccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)c1
NC(=O)c1cccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)c1
Nc1nc(-c2ccco2)c2nnn(Cc3cccc(c3)C(O)=O)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3cccc(O)c3)c2n1
COC(=O)c1cccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)c1
Nc1nc(-c2ccco2)c2nnn(Cc3ccc(cc3)[N+]([O-])=O)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3cccc(c3)[N+]([O-])=O)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3[N+]([O-])=O)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3ccc4nn[nH]c4c3)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3ccc4[nH]ncc4c3)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3ccc4[nH]ccc4c3)c2n1
CC(=O)Nc1ccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)cc1
CNc1ccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)cc1
Nc1nc(-c2ccco2)c2nnn(Cc3ccc(N)c(O)c3)c2n1
CC(C)c1cc(Cn2nnc3c(nc(N)nc23)-c2ccco2)ccc1N
CCc1cc(Cn2nnc3c(nc(N)nc23)-c2ccco2)ccc1N
Nc1nc(-c2ccco2)c2nnn(Cc3ccc(N)c(F)c3)c2n1
Nc1ccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)c(F)c1
NCc1ccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)cc1
Nc1nc(-c2ccco2)c2nnn(Cc3cnccn3)c2n1
Cc1ccccc1Cn1nnc2c(nc(N)nc12)-c1ccco1
Nc1nc(-c2ccco2)c2nnn(Cc3cccc(Cl)c3)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3c(F)cccc3F)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3cc(F)ccc3F)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3ccc(F)cc3F)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3cccc(F)c3F)c2n1
Nc1nc(-c2ccco2)c2nnn(CC3CCCCC3)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3)c2n1
Nc1nc(-c2cncs2)c2nnn(Cc3ccccc3F)c2n1
Nc1nc(-c2c[nH]nn2)c2nnn(Cc3ccccc3F)c2n1
Nc1nc(-c2cccs2)c2nnn(Cc3ccccc3F)c2n1
Nc1nc(-c2ncco2)c2nnn(Cc3ccccc3F)c2n1
Cc1cnc(s1)-c1nc(N)nc2n(Cc3ccccc3F)nnc12
Cc1csc(n1)-c1nc(N)nc2n(Cc3ccccc3F)nnc12
Nc1nc(-c2nccs2)c2nnn(Cc3ccccc3F)c2n1
Nc1nc(-c2cc[nH]n2)c2nnn(Cc3ccccc3F)c2n1
Cc1ccc(o1)-c1nc(N)nc2n(Cc3ccccc3F)nnc12
Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3F)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3ccc(cc3)C#N)c2n1
Nc1nc(-c2ccco2)c2nnn(Cc3cccc(c3)C#N)c2n1
COc1cccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)c1
COc1ccccc1Cn1nnc2c(nc(N)nc12)-c1ccco1
Nc1nc(-c2ccco2)c2nnn(Cc3cccc(c3)C(F)(F)F)c2n1
Cc1cccc(Cn2nnc3c(nc(N)nc23)-c2ccco2)c1
COC[C@H]1CCCN1c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C |r|
CNc1nc(N)n2nc(nc2n1)-c1ccco1
CC(C)Nc1nc(N)n2nc(nc2n1)-c1ccco1
Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1
Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1
CNc1nc(NC(=O)Nc2ccccc2)n2nc(nc2n1)-c1ccco1
CC(C)Nc1nc(NC(=O)Nc2ccccc2)n2nc(nc2n1)-c1ccco1
O=C(Nc1ccccc1)Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1
O=C(Nc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1
CNc1nc(NC(=O)c2ccccc2)n2nc(nc2n1)-c1ccco1
CC(C)Nc1nc(NC(=O)c2ccccc2)n2nc(nc2n1)-c1ccco1
O=C(Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1)c1ccccc1
O=C(Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1
CNc1nc(NC(=O)Cc2ccccc2)n2nc(nc2n1)-c1ccco1
CC(C)Nc1nc(NC(=O)Cc2ccccc2)n2nc(nc2n1)-c1ccco1
O=C(Cc1ccccc1)Nc1nc(NC2CCCCC2)nc2nc(nn12)-c1ccco1
O=C(Cc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(nn12)-c1ccco1
C1CCC(CC1)Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1
C(Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1
Fc1ccc(CNc2nc(Oc3ccccc3)nc3nc(nn23)-c2ccco2)cc1
CNc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1
CC(C)Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1
C1CCC(CC1)Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1
C(Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1)c1ccccc1
CNc1nc(NCc2ccccc2)n2nc(nc2n1)-c1ccco1
CC(C)Nc1nc(NCc2ccccc2)n2nc(nc2n1)-c1ccco1
C(Nc1nc(NCc2ccccc2)n2nc(nc2n1)-c1ccco1)c1ccccc1
CNc1nc(NCc2ccc(F)cc2)n2nc(nc2n1)-c1ccco1
Fc1ccc(CNc2nc(NC3CCCCC3)nc3nc(nn23)-c2ccco2)cc1
Fc1ccc(CNc2nc(NCc3ccccc3)nc3nc(nn23)-c2ccco2)cc1
Fc1ccc(CNc2nc(NCc3ccc(F)cc3)n3nc(nc3n2)-c2ccco2)cc1
Nc1nc(C(=O)NCc2cccc3cccnc23)c2ccccc2n1
O[C@@H]1[C@@H](CCl)O[C@H]([C@@H]1O)n1cnc2c(NC3CCCC3)ncnc12 |r|
O[C@@H]1[C@@H](CCl)O[C@H]([C@@H]1O)n1cnc2c(NC3CCCC3)nc(Cl)nc12 |r|
O[C@@H]1[C@@H](CCl)O[C@H]([C@@H]1O)n1cnc2c(NC3CC4CCC3C4)ncnc12 |r,TLB:14:15:19.18:21|
O[C@@H]1[C@@H](CCl)O[C@H]([C@@H]1O)n1cnc2c(NC3CC4CCC3C4)nc(Cl)nc12 |r,TLB:14:15:19.18:21|
C[C@@]1(O)[C@H](O)[C@@H](CCl)O[C@H]1n1cnc2c(NC3CCCC3)ncnc12 |r|
C[C@@]1(O)[C@H](O)[C@@H](CCl)O[C@H]1n1cnc2c(NC3CCCC3)nc(Cl)nc12 |r|
C[C@@]1(O)[C@H](O)[C@@H](CCl)O[C@H]1n1cnc2c(NC3CC4CCC3C4)ncnc12 |r,TLB:15:16:20.19:22|
C[C@@]1(O)[C@H](O)[C@@H](CCl)O[C@H]1n1cnc2c(NC3CC4CCC3C4)nc(Cl)nc12 |r,TLB:15:16:20.19:22|
O[C@@H]1[C@@H](CSc2ccccc2F)O[C@H]([C@@H]1O)n1cnc2c(NC3CCCC3)ncnc12 |r|
O[C@@H]1[C@@H](CSc2ccccc2F)O[C@H]([C@@H]1O)n1cnc2c(NC3CCCC3)nc(Cl)nc12 |r|
C[C@@]1(O)[C@H](O)[C@@H](CSc2ccccc2F)O[C@H]1n1cnc2c(NC3CCCC3)ncnc12 |r|
C[C@@]1(O)[C@H](O)[C@@H](CSc2ccccc2F)O[C@H]1n1cnc2c(NC3CCCC3)nc(Cl)nc12 |r|
C[C@@]1(O)[C@H](O)[C@@H](CSc2ccccc2F)O[C@H]1n1cnc2c(NC3CC4CCC3C4)ncnc12 |r,TLB:22:23:27.26:29|
C[C@@]1(O)[C@H](O)[C@@H](CSc2ccccc2F)O[C@H]1n1cnc2c(NC3CC4CCC3C4)nc(Cl)nc12 |r,TLB:22:23:27.26:29|
O[C@@H]1[C@@H](CSc2ccccc2F)O[C@H]([C@@H]1O)n1cnc2c(NC3CCOC3)ncnc12 |r|
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NC3CC4CCC3C4)ncnc12 |r,TLB:15:16:20.19:22|
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NC3CC4CCC3C4)nc(Cl)nc12 |r,TLB:15:16:20.19:22|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CC4CCC3C4)ncnc12 |r,TLB:14:15:19.18:21|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CC4CCC3C4)nc(Cl)nc12 |r,TLB:14:15:19.18:21|
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(COC(=O)Nc2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(COC(=O)Nc2ccc(F)cc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(COC(=O)Nc2ccsc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(COC(=O)Nc2cccs2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(COC(=O)Nc2ccccn2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(COC(=O)Nc2ccco2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(COC(=O)N2CCN(CC2)c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(COC(=O)N2CCc3ccccc3C2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(COC(=O)NCc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(COC(=O)Nc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(COC(=O)Nc2ccc(F)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(COC(=O)Nc2ccsc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(COC(=O)Nc2cccs2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(COC(=O)Nc2cnccn2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(COC(=O)Nc2ccon2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(COC(=O)Nc2ccn[nH]2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(COC(=O)N2CCN(CC2)c2cccc(Cl)c2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(COC(=O)N2CCN(CC2)c2ccc(F)cc2)cc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(COC(=O)Nc2ccccc2)cc1
CCNC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3OCc3ccccc3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3O)ncnc12 |r|
NCCc1c[nH]c2ccc(OCC(=O)N3CCN(CC3)c3cccc4ccccc34)cc12
Cc1ccccc1N1CCN(CC1)C(=O)COc1ccc2[nH]cc(CCN)c2c1
CC(C)OC(=O)C1=C(C)NC(=O)NC1c1ccsc1 |c:6|
CC(C)OC(=O)C1=C(C)NC(=O)NC1c1ccoc1 |c:6|
CC(=O)NCCNc1nc(nc2nc([nH]c12)C(=O)N1CCN(CCCc2ccccc2)CC1)-c1ccccc1
CC(C)OC(=O)C1=C(C)Nc2ncnn2C1c1ccco1 |c:6|
CCOC(=O)C1=C(C)Nc2ncnn2C1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2ncnn2C1c1ccoc1 |c:6|
CCOC(=O)C1=C(C)Nc2ncnn2C1c1ccsc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2ncnn2C1c1ccsc1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1 |c:6|
CC(C)OC(=O)C1=C(C)NC(=O)NC1c1ccco1 |c:6|
CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 |c:5|
CCOC(=O)C1=C(C)NC(=O)CC1c1ccco1 |c:5|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccoc1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cccs1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cccs1 |c:6|
CCOC(=O)C1=C(C)Nc2nccn2C1c1ccco1 |c:5|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccsc1 |c:5|
CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nccn2C1c1ccco1 |c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccsc1 |c:6|
CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nccn2C1c1ccoc1 |c:6|
CC(C)OC(=O)C1=C(C)Nc2nccn2C1c1cccs1 |c:6|
CC(C)OC(=O)C1=C(C)Nc2nccn2C1c1ccsc1 |c:6|
COc1ccccc1Cn1cc2nc(nc(N)c2n1)-c1ccco1
Nc1nc(nc2cn(Cc3ccccc3O)nc12)-c1ccco1
COc1cccc(Cn2cc3nc(nc(N)c3n2)-c2ccc(C)o2)c1
Cc1ccc(o1)-c1nc(N)c2nn(Cc3ccccc3F)cc2n1
Cc1ccc(o1)-c1nc(N)c2nn(Cc3cccc(F)c3)cc2n1
Cc1ccc(o1)-c1nc(N)c2nn(Cc3ccccc3Cl)cc2n1
Cc1ccc(o1)-c1nc(N)c2nn(Cc3ccccc3O)cc2n1
Cc1ccc(o1)-c1nc(N)c2nn(Cc3cccc(O)c3)cc2n1
CC1(C)CC(CC(C)(C)N1[O])Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |^1:10|
CC1(C)N([O])C(C)(C)c2cc(Nc3ncnc4n(cnc34)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)ccc12 |^1:4|
CC1(C)N([O])C(C)(C)c2cc(ccc12)C(=O)NCCc1ccc(Nc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |^1:4|
CC1(C)N([O])C(C)(C)c2cc(ccc12)C(=O)NCCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |^1:4|
CC1(C)CC(CNc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(C)(C)N1[O] |w:4.4,^1:29|
Nc1nc(cc(n1)-c1ccco1)C(=O)NCc1ccccn1
Nc1nc(cc(n1)-c1ccco1)C(=O)NCc1cccnc1
Nc1cccc(CNC(=O)c2cc(nc(N)n2)-c2ccco2)n1
Nc1nc(cc(n1)-c1ccco1)C(=O)NCc1ccccc1
Nc1nc(cc(n1)-c1ccco1)C(=O)NCc1ccccc1F
Nc1nc(cc(n1)-c1ccco1)C(=O)NCc1cccc(F)c1
Nc1nc(cc(n1)-c1ccco1)C(=O)NCc1ccccc1Cl
Nc1nc(cc(n1)-c1ccco1)C(=O)NCc1cccc(Cl)c1
Cc1ccccc1CNC(=O)c1cc(nc(N)n1)-c1ccco1
Cc1cccc(CNC(=O)c2cc(nc(N)n2)-c2ccco2)c1
Cc1ccc(CNC(=O)c2cc(nc(N)n2)-c2ccco2)cc1
COc1ccccc1CNC(=O)c1cc(nc(N)n1)-c1ccco1
COc1cccc(CNC(=O)c2cc(nc(N)n2)-c2ccco2)c1
CCCCn1c2nc3N(CCCn3c2c(=O)n(CCCC)c1=O)c1ccc(O)cc1
CCCCn1c2nc3N(CCCn3c2c(=O)n(CCCC)c1=O)c1ccc(OCCN(C)C)cc1
CCCCn1c2nc3N(CCCn3c2c(=O)n(CCCC)c1=O)c1ccc(OCCN(CC)CC)cc1
CCCCn1c2nc3N(CCCn3c2c(=O)n(CCCC)c1=O)c1ccc(OCCN2CCCC2)cc1
CCCCn1c2nc3N(CCCn3c2c(=O)n(CCCC)c1=O)c1ccc(OCCN2CCCCC2)cc1
CCCCn1c2nc3N(CCCn3c2c(=O)n(CCCC)c1=O)c1ccc(OCCN2CCOCC2)cc1
CCN(CC)CCOc1ccc(CCN2CCn3c(C2)nc2n(C)c(=O)n(C)c(=O)c32)cc1
Cn1c2nc3CN(CCc4ccc(OCCN5CCCCC5)cc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4ccc(OCCN5CCOCC5)cc4)CCn3c2c(=O)n(C)c1=O
CN(C)CCOc1ccc(CCN2CCCn3c2nc2n(C)c(=O)n(C)c(=O)c32)cc1
CCN(CC)CCOc1ccc(CCN2CCCn3c2nc2n(C)c(=O)n(C)c(=O)c32)cc1
Cn1c2nc3N(CCc4ccc(OCCN5CCCC5)cc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCc4ccc(OCCN5CCCCC5)cc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCc4ccc(OCCN5CCOCC5)cc4)CCCn3c2c(=O)n(C)c1=O
CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(OCCN2CCCC2)cc1
CCn1c2nc3N(CCc4ccc(O)cc4)CCCn3c2c(=O)n(CC)c1=O
CCn1c2nc3N(CCc4ccc(OCCN5CCOCC5)cc4)CCCn3c2c(=O)n(CC)c1=O
CCCn1c2nc3N(CCc4ccc(O)cc4)CCCn3c2c(=O)n(CCC)c1=O
CCCn1c2nc3N(CCc4ccc(OCCN(CC)CC)cc4)CCCn3c2c(=O)n(CCC)c1=O
CCCn1c2nc3N(CCc4ccc(OCCN5CCOCC5)cc4)CCCn3c2c(=O)n(CCC)c1=O
CCCCn1c2nc3N(CCc4ccc(O)cc4)CCCn3c2c(=O)n(CCCC)c1=O
CCCCn1c2nc3N(CCc4ccc(OCCN(CC)CC)cc4)CCCn3c2c(=O)n(CCCC)c1=O
CCCCn1c2nc3N(CCc4ccc(OCCN5CCOCC5)cc4)CCCn3c2c(=O)n(CCCC)c1=O
Cn1c2nc3CN(CCc4ccc(O)cc4)CCn3c2c(=O)n(C)c1=O
CN(C)CCOc1ccc(CCN2CCn3c(C2)nc2n(C)c(=O)n(C)c(=O)c32)cc1
CN(C)CCOc1ccc(cc1)N1CCCn2c1nc1n(C)c(=O)n(C)c(=O)c21
CCN(CC)CCOc1ccc(cc1)N1CCCn2c1nc1n(C)c(=O)n(C)c(=O)c21
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)c1ccc(OCCN2CCCC2)cc1
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)c1ccc(OCCN2CCCCC2)cc1
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)c1ccc(OCCN2CCOCC2)cc1
CCn1c2nc3N(CCCn3c2c(=O)n(CC)c1=O)c1ccc(OCCN(C)C)cc1
CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(O)cc1
CCn1c2nc3N(CCCn3c2c(=O)n(CC)c1=O)c1ccc(O)cc1
CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(OCCN(C)C)cc1
CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(OCCN(CC)CC)cc1
CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(OCCN2CCCCC2)cc1
CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(OCCN2CCOCC2)cc1
COc1cc(Nc2nc3c(Cl)ncnc3s2)cc(OC)c1OC
Fc1cccc(F)c1Nc1nc2c(Cl)ncnc2s1
Clc1ncnc2sc(Nc3cccc(Br)c3)nc12
Cc1ccc(Nc2nc3c(Cl)ncnc3s2)cc1
[O-][N+](=O)c1ccc(Nc2nc3c(Cl)ncnc3s2)cc1
Clc1ncnc2sc(nc12)N(Cc1ccccc1)C(=S)NCc1ccccc1
Clc1ncnc2sc(NCCN3CCOCC3)nc12
C1CCN(C1)c1ncnc2sc(Nc3ccccc3)nc12
OC[C@@H]1CCCN1c1ncnc2sc(Nc3ccccc3)nc12 |r|
CCN(CC)c1ncnc2sc(Nc3ccc(Cl)cc3)nc12
CN(C)c1ncnc2sc(Nc3ccc(Cl)cc3)nc12
Nc1nc(SCc2ncc[nH]2)c(C#N)c(-c2cccc(O)c2)c1C#N
Clc1ccc(Nc2nc3c(ncnc3s2)N2CCOCC2)cc1
Clc1ccc(Nc2nc3c(ncnc3s2)N2CCCCC2)cc1
CCN1CCN(CC1)c1ncnc2sc(Nc3ccccc3)nc12
C1CCN(CC1)C1CCN(CC1)c1ncnc2sc(Nc3ccccc3)nc12
CN1CCN(CC1)c1ncnc2sc(Nc3ccccc3)nc12
C1CN(CCN1)c1ncnc2sc(Nc3ccccc3)nc12
CN(C)c1ncnc2sc(Nc3ccccc3)nc12
COc1cc(Nc2nc3c(ncnc3s2)N2CCCC2)cc(OC)c1OC
C1CCN(CC1)c1ncnc2sc(Nc3ccccc3)nc12
Brc1cccc(Nc2nc3c(ncnc3s2)N2CCCC2)c1
CCN(CC)c1ncnc2sc(Nc3ccccc3)nc12
OC[C@@H]1CCCN1c1ncnc2sc(Nc3cccc(Br)c3)nc12 |r|
Clc1ncnc2sc(NC(=O)c3ccccc3)nc12
Fc1cccc(F)c1Nc1nc2c(ncnc2s1)N1CCCC1
C1CN(CCO1)c1ncnc2sc(Nc3ccccc3)nc12
OC[C@@H]1CCCN1c1ncnc2sc(Nc3c(F)cccc3F)nc12 |r|
Cc1ccc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc1 |r|
[O-][N+](=O)c1ccc(Nc2nc3c(ncnc3s2)N2CCCC2)cc1
COc1ccc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc1 |r|
Cc1ccc(Nc2nc3c(ncnc3s2)N2CCCC2)cc1
OC[C@@H]1CCCN1c1ncnc2sc(Nc3ccc(Cl)cc3)nc12 |r|
COc1ccc(Nc2nc3c(Cl)ncnc3s2)cc1
Clc1ccc(Nc2nc3c(Cl)ncnc3s2)cc1
Clc1ccc(Nc2nc3c(ncnc3s2)N2CCCC2)cc1
Clc1ncnc2sc(Nc3ccccc3)nc12
CN1CCN(CC1)c1ncnc2sc(Nc3ccc(Cl)cc3)nc12
COc1cc(Nc2nc3c(ncnc3s2)N2CCC[C@H]2CO)cc(OC)c1OC |r|
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1ccc(CC(O)=O)cc1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cccc(CC(=O)NCCCCCCCN(C)CCO)c1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NC1CC1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1ccc(CC(=O)NCCN2CCCCC2)cc1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cccc(c1)C(=O)NCCN1CCOCC1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cccc(c1)C(=O)NCCCCCCCN(C)CCO
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1ccc(CC(=O)NCCCCCCCN(C)CCO)cc1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CCN(Cc2ccccc2)CC1)C(=O)NC1CC1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(OCC2CC2)cc(c1)C(=O)NCCN1CCCCC1
CCOc1cc(cc(c1)-c1cccc(c1)-c1cc(NC(=O)Nc2c(Cl)cncc2Cl)c(=O)n(CC)n1)C(=O)NC1CC1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C#N
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cncc(O)c1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)OC)C(=O)NCCCN(C)C
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cccc(c1)C(=O)NC1CC1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)C(O)=O
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCC[C@H]1CCCN1C |r|
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cccc(c1)C(=O)NCCN(C)C
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NCCN1CCCCC1)C(=O)NCCO
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cccc(O)c1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCCN1CCOCC1
CCNC(=O)c1cc(cc(c1)-c1cccc(c1)-c1cc(NC(=O)Nc2c(Cl)cncc2Cl)c(=O)n(CC)n1)C(=O)NCCCN(C)C
c1cc(c(cc1C(=O)Nc2c(cncc2Cl)Cl)OCC3CC3)OC(F)F
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cccc(CC(O)=O)c1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cccc(c1)C(=O)NCCN1CCCCC1
CCn1nc(cc(NC(=O)Nc2c(Cl)cncc2Cl)c1=O)-c1cccc(c1)-c1cc(cc(c1)C(=O)NC1CC1)C(=O)NCCN1CCCCC1
Cn1cc2c(n1)nc(NC(=O)C(c1ccccc1)c1ccccc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1ccc(cc1)-c1ccccc1)n1nc(nc21)-c1ccco1
CC(C)CCn1cc2c(n1)nc(NC(=O)C(c1ccccc1)c1ccccc1)n1nc(nc21)-c1ccco1
CC(C)CCn1cc2c(n1)nc(NC(=O)Cc1ccc(cc1)-c1ccccc1)n1nc(nc21)-c1ccco1
O=C(Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccco1)C(c1ccccc1)c1ccccc1
O=C(Cc1ccc(cc1)-c1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)C(c1ccccc1)c1ccccc1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Cc1ccc(cc1)-c1ccccc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1cccc(Cl)c1)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)C(c1ccccc1)c1ccccc1)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Cc1ccc(cc1)-c1ccccc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1ccc(Cl)cc1)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Cc1ccc(cc1)-c1ccccc1)n1nc(nc21)-c1ccco1
COc1ccc(CC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1
CC(C)CCn1cc2c(n1)nc(NC(=O)Cc1ccc3ccccc3c1)n1nc(nc21)-c1ccco1
O=C(Cc1ccc2ccccc2c1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccco1
O=C(Cc1cccs1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccco1
O=C(Cc1ccsc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Cc1cccc3ccccc13)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Cc1ccc3ccccc3c1)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Cc1ccsc1)n1nc(nc21)-c1ccco1
CCn1cc2c(n1)nc(NC(=O)Cc1cccs1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1cccs1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1ccsc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1ccc3ccccc3c1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1cccc3ccccc13)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Cc1cccc3ccccc13)n1nc(nc21)-c1ccco1
CCCn1cc2c(n1)nc(NC(=O)Cc1ccc3ccccc3c1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Cc1cccc3ccccc13)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1ccc(cc1)C(F)(F)F)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Cc1cccs1)n1nc(nc21)-c1ccco1
CCCCn1cc2c(n1)nc(NC(=O)Cc1ccsc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)COc1ccc(Cl)cc1)n1nc(nc21)-c1ccco1
CC(C)CCn1cc2c(n1)nc(NC(=O)Cc1cccc(Cl)c1)n1nc(nc21)-c1ccco1
CC(C)CCn1cc2c(n1)nc(NC(=O)Cc1ccc(Cl)cc1)n1nc(nc21)-c1ccco1
Clc1cccc(CC(=O)Nc2nc3nn(CCc4ccccc4)cc3c3nc(nn23)-c2ccco2)c1
CC(C)CCn1cc2c(n1)nc(NC(=O)Cc1ccc(cc1)C(F)(F)F)n1nc(nc21)-c1ccco1
CC(C)CCn1cc2c(n1)nc(NC(=O)Cc1ccc(F)cc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1ccc(F)cc1)n1nc(nc21)-c1ccco1
CC(C)CCn1cc2c(n1)nc(NC(=O)Cc1c(Cl)cccc1Cl)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Cc1c(Cl)cccc1Cl)n1nc(nc21)-c1ccco1
Fc1ccc(CC(=O)Nc2nc3nn(CCCc4ccccc4)cc3c3nc(nn23)-c2ccco2)cc1
O=C(Nc1nc2nn(CCCc3ccccc3)cc2c2nc(nn12)-c1ccco1)C(c1ccccc1)c1ccccc1
O=C(Cc1ccc2ccccc2c1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(nn12)-c1ccco1
Clc1cccc(CC(=O)Nc2nc3nn(CCCc4ccccc4)cc3c3nc(nn23)-c2ccco2)c1
Clc1ccc(CC(=O)Nc2nc3nn(CCCc4ccccc4)cc3c3nc(nn23)-c2ccco2)cc1
Clc1ccc(OCC(=O)Nc2nc3nn(CCCc4ccccc4)cc3c3nc(nn23)-c2ccco2)cc1
Clc1cccc(Cl)c1CC(=O)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(nn12)-c1ccco1
O=C(Cc1ccc(cc1)-c1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(nn12)-c1ccco1
O[C@H]1CC[C@@H](CC1)Nc1ncc(-c2ccc3ccccc3c2)c(n1)-c1ccccc1 |r,wU:4.7,wD:1.0,(25.3,-7.48,;23.97,-8.25,;22.62,-7.49,;21.3,-8.28,;21.31,-9.82,;22.65,-10.57,;23.98,-9.79,;19.99,-10.6,;20,-12.14,;21.34,-12.9,;21.35,-14.44,;20.02,-15.22,;20.03,-16.76,;18.7,-17.54,;18.72,-19.08,;20.06,-19.83,;20.07,-21.37,;21.4,-22.13,;22.73,-21.35,;22.72,-19.82,;21.39,-19.06,;21.37,-17.52,;18.68,-14.46,;18.67,-12.92,;17.35,-15.24,;16.01,-14.48,;14.68,-15.26,;14.69,-16.8,;16.04,-17.56,;17.36,-16.78,)|
COc1cccc(CCNc2nc(N)c3nc(sc3n2)-c2ccco2)c1
Nc1nc(Nc2ccccc2)nc2sc(nc12)-c1ccco1
Nc1nc(NCCc2ccccc2)nc2sc(nc12)-c1ccco1
CCCNc1nc(N)c2nc(sc2n1)-c1ccco1
Nc1nc(NCCc2ccc(O)c(O)c2)nc2sc(nc12)-c1ccco1
Nc1nc(NCCCc2ccccc2)nc2sc(nc12)-c1ccco1
COc1cccc(CNc2nc(N)c3nc(sc3n2)-c2ccco2)c1
Nc1nc(NCc2cccc(O)c2)nc2sc(nc12)-c1ccco1
Nc1nc(NCc2cccc(F)c2)nc2sc(nc12)-c1ccco1
Nc1nc(NCCc2ccc(O)cc2)nc2sc(nc12)-c1ccco1
Nc1nc(NCCc2cccc(O)c2)nc2sc(nc12)-c1ccco1
COc1ccc(CNc2nc(N)c3nc(sc3n2)-c2ccco2)cc1
Nc1nc(NCc2ccccc2)nc2sc(nc12)-c1ccco1
COc1ccc(CCNc2nc(N)c3nc(sc3n2)-c2ccco2)cc1
COc1ccc(CCNc2nc(N)c3nc(sc3n2)-c2ccco2)cc1OC
COc1ccccc1CNc1nc(N)c2nc(sc2n1)-c1ccco1
CCCCNc1nc(N)c2nc(sc2n1)-c1ccco1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCCOCCOCCOCCOCCCCCCCCCCC=C)cc1
CCCn1c2nc(-c3ccc(OCC(=O)Nc4ccc(cc4)C(C)=O)cc3)n(C)c2c(=O)n(CCC)c1=O
Cc1cnn(c1)[C@H]1C[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(N[C@H](CO)Cc3ccccc3)nc12 |r|
CCc1cnn(c1)[C@H]1C[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(N[C@H](CO)Cc3ccccc3)nc12 |r|
CCC(=O)N[C@H]1C[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(NCCc3cnc[nH]3)nc12 |r|
CCC(CC)Nc1nc(NCCc2cn(CC)cn2)nc2n(cnc12)[C@@H]1C[C@H](NC(=O)CC)[C@@H](O)[C@H]1O |r|
CCC(CC)CNc1nc(NCCc2cn(CC)cn2)nc2n(cnc12)[C@@H]1C[C@@H]([C@@H](O)[C@H]1O)n1cc(CO)cn1 |r|
CCCCC#Cc1nc(N)c2ncn([C@@H]3C[C@H](NC(=O)CC)[C@@H](O)[C@H]3O)c2n1 |r|
Cc1ccc(s1)C(=O)c1ncnc2ccsc12
Cc1ccc(s1)C(=O)c1nc(C)nc2ccsc12
CCc1nc(C(=O)c2ccc(C)s2)c2sccc2n1
Cc1ccc(s1)C(=O)c1nc(N)nc2ccsc12
CCNc1nc(C(=O)c2ccc(C)s2)c2sccc2n1
Cc1ccc(s1)C(=O)c1nc(NCC2CCCCC2)nc2ccsc12
Cc1ccc(s1)C(=O)c1nc(NCc2ccccc2)nc2ccsc12
CC(Nc1nc(C(=O)c2ccc(C)s2)c2sccc2n1)c1ccccc1
Cc1ccc(s1)C(=O)c1nc(NCc2ccccn2)nc2ccsc12
Cc1ccc(s1)C(=O)c1nc(NCc2cccnc2)nc2ccsc12
Cc1ccc(s1)C(=O)c1nc(NCc2ccncn2)nc2ccsc12
Cc1ccc(s1)C(=O)c1nc(NC(=O)c2cccnc2)nc2ccsc12
Cc1ccc(s1)C(=O)c1nc(NCCc2ccccn2)nc2ccsc12
Cc1ccc(s1)C(=O)c1nc(NCCc2cccnc2)nc2ccsc12
CN(Cc1cccnc1)c1nc(C(=O)c2ccc(C)s2)c2sccc2n1
CC(Nc1nc(C(=O)c2ccc(C)s2)c2sccc2n1)c1ccccn1
CC(Nc1nc(C(=O)c2ccc(C)s2)c2sccc2n1)c1cccnc1
Clc1ccc(s1)C(=O)c1nc(NCc2cccnc2)nc2ccsc12
Cc1ccc(o1)C(=O)c1nc(NCc2cccnc2)nc2ccsc12
O=C(c1cccs1)c1nc(NCc2cccnc2)nc2ccsc12
O=C(c1ccsc1)c1nc(NCc2cccnc2)nc2ccsc12
O=C(c1nccs1)c1nc(NCc2cccnc2)nc2ccsc12
O=C(c1cncs1)c1nc(NCc2cccnc2)nc2ccsc12
O=C(c1ccccc1)c1nc(NCc2cccnc2)nc2ccsc12
Cc1ccc(cc1)C(=O)c1nc(NCc2cccnc2)nc2ccsc12
COc1ccc(cc1)C(=O)c1nc(NCc2cccnc2)nc2ccsc12
O=C(c1cccnc1)c1nc(NCc2cccnc2)nc2ccsc12
O=C(c1ccncc1)c1nc(NCc2cccnc2)nc2ccsc12
Clc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1
CNC(=O)c1nc(NCc2cccnc2)nc2ccsc12
CCNC(=O)c1nc(NCc2cccnc2)nc2ccsc12
CC(C)NC(=O)c1nc(NCc2cccnc2)nc2ccsc12
O=C(NC1CC1)c1nc(NCc2cccnc2)nc2ccsc12
O=C(NC1CCCCC1)c1nc(NCc2cccnc2)nc2ccsc12
O=C(N1CCCC1)c1nc(NCc2cccnc2)nc2ccsc12
CC(Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1
C[C@@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1 |r|
C[C@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1 |r|
CC(=O)Nc1ncc(-c2ccncn2)c(n1)-c1ccco1
CC(=O)Nc1ccc(-c2ccncn2)c(n1)-c1ccco1
CC(=O)Nc1ccc(-c2ccncc2)c(n1)-c1ccco1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1ccco1)C1CC1
O=C(Nc1ccc(-c2ccncn2)c(n1)-c1ccco1)C1CC1
Brc1ccc(NC(=O)C2CC2)nc1-c1ccco1
O=C(Nc1ccc(C#N)c(n1)-c1ccco1)C1CC1
Clc1cnccc1-c1ccc(NC(=O)C2CC2)nc1-c1ccco1
Fc1cnccc1-c1ccc(NC(=O)C2CC2)nc1-c1ccco1
Clc1nc(NC(=O)C2CC2)ccc1-c1ccncc1
CC(=O)c1nc(NC(=O)C2CC2)ccc1-c1ccncc1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)ccc1-c1ccncc1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1nccs1)C1CC1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1cncs1)C1CC1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1ncco1)C1CC1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1cnco1)C1CC1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1cocn1)C1CC1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1cc[nH]n1)C1CC1
O=C(Nc1ccc(-c2ccncc2)c(n1)-n1cccn1)C1CC1
Fc1ccccc1-c1nc(NC(=O)C2CC2)ccc1-c1ccncc1
Fc1cccc(c1)-c1nc(NC(=O)C2CC2)ccc1-c1ccncc1
CC(=O)Nc1ccc(-c2ccncc2)c(n1)-c1cccc(F)c1
Fc1ccc(cc1)-c1nc(NC(=O)C2CC2)ccc1-c1ccncc1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1ccccn1)C1CC1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1cccnc1)C1CC1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1ccncc1)C1CC1
O=C(Nc1ccc(-c2ccncc2)c(n1)-c1ccncn1)C1CC1
Oc1ccc(cc1)C1CNCCc2c(Cl)c(O)c(O)cc12
[H][C@]1(Cc2ccc(O)c(O)c2)CCCN1CCCCCCN(CCC)CCc1ccc(O)c(O)c1
Oc1ccc(C[C@@H]2CCCN2CCCCCCN2CCC[C@H]2Cc2ccc(O)c(O)c2)cc1O
c1cc(c(cc1CCN)O)O
CCCN(CCC)CCc1ccc(O)c(O)c1
Oc1ccc(C[C@H]2CCCN2CCCCCCN2CCC[C@@H]2Cc2ccc(O)c(O)c2)cc1O
Oc1ccc(C[C@H]2CCCN2CCCCCCN2CCC[C@H]2Cc2ccc(O)c(O)c2)cc1O
O=c1[nH]c2nc(-c3ccco3)c(cc2c(=O)[nH]1)-c1ccncn1
c1coc(c1)-c1nc2[nH]ccc2cc1-c1ccncn1
O=c1[nH][nH]c2nc(-c3ccco3)c(cc12)-c1ccncn1
c1coc(c1)-c1nc2nc[nH]c2cc1-c1ccncn1
c1coc(c1)-c1nc2[nH]ncc2cc1-c1ccncn1
Nc1n[nH]c2nc(-c3ccco3)c(cc12)-c1ccncn1
Cn1c2cc(-c3ccncn3)c(nc2[nH]c1=O)-c1ccco1
O=c1[nH]c2cc(-c3ccncn3)c(nc2[nH]1)-c1ccco1
CN(C)c1nc(N)n2nc(nc2n1)-c1ccco1
CSc1nc(NC(=O)C(c2ccccc2)c2ccccc2)n2nc(nc2n1)-c1ccco1
CSc1nc(NC(=O)Cc2ccccc2)n2nc(nc2n1)-c1ccco1
COc1ccc(CC(=O)Nc2nc(SC)nc3nc(nn23)-c2ccco2)cc1
CCCCCC(=O)Nc1nc(SC)nc2nc(nn12)-c1ccco1
CSc1nc(NC(=O)Nc2ccccc2)n2nc(nc2n1)-c1ccco1
CSc1nc(NC(=O)Nc2ccc(C)cc2)n2nc(nc2n1)-c1ccco1
O=C(Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1)C(c1ccccc1)c1ccccc1
O=C(Cc1ccccc1)Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1
COc1ccc(CC(=O)Nc2nc(Oc3ccccc3)nc3nc(nn23)-c2ccco2)cc1
CCCCCC(=O)Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1
O=C(Nc1ccccc1)Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1
Cc1ccc(NC(=O)Nc2nc(Oc3ccccc3)nc3nc(nn23)-c2ccco2)cc1
CN(C)c1nc(NC(=O)C(c2ccccc2)c2ccccc2)n2nc(nc2n1)-c1ccco1
CN(C)c1nc(NC(=O)Cc2ccccc2)n2nc(nc2n1)-c1ccco1
COc1ccc(CC(=O)Nc2nc(nc3nc(nn23)-c2ccco2)N(C)C)cc1
CCCCCC(=O)Nc1nc(nc2nc(nn12)-c1ccco1)N(C)C
CN(C)c1nc(NC(=O)Nc2ccccc2)n2nc(nc2n1)-c1ccco1
CN(C)c1nc(NC(=O)Nc2ccc(C)cc2)n2nc(nc2n1)-c1ccco1
Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1
CSc1nc(N)n2nc(nc2n1)-c1ccco1
Cn1cc2c(n1)nc(N)n1nc(nc21)-c1ccccc1
Cn1cc2c(n1)nc(N)n1nc(nc21)-c1ccc(F)cc1
Cn1cc2c(n1)nc(N)n1nc(nc21)-c1ccc(Cl)cc1
Cn1cc2c(n1)nc(N)n1nc(nc21)-c1ccc(Br)cc1
COc1ccc(cc1)-c1nc2c3cn(C)nc3nc(N)n2n1
Cn1cc2c(n1)nc(N)n1nc(nc21)-c1ccc(cc1)[N+]([O-])=O
CCn1ncc2c1nc(N)n1nc(nc21)-c1ccc(Cl)cc1
CCn1cc2c(n1)nc(N)n1nc(nc21)-c1ccc(Cl)cc1
Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccccc1
Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccc(F)cc1
Nc1nc2n(CCc3ccccc3)ncc2c2nc(nn12)-c1ccc(Cl)cc1
Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccc(Cl)cc1
Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccc(Br)cc1
COc1ccc(cc1)-c1nc2c3cn(CCc4ccccc4)nc3nc(N)n2n1
Cn1cc2c(n1)nc(NC(=O)c1ccccc1)n1nc(nc21)-c1ccccc1
Cn1cc2c(n1)nc(NC(=O)c1ccccc1)n1nc(nc21)-c1ccc(F)cc1
Cn1cc2c(n1)nc(NC(=O)c1ccccc1)n1nc(nc21)-c1ccc(Cl)cc1
Cn1cc2c(n1)nc(NC(=O)c1ccccc1)n1nc(nc21)-c1ccc(Br)cc1
COc1ccc(cc1)-c1nc2c3cn(C)nc3nc(NC(=O)c3ccccc3)n2n1
Cn1cc2c(n1)nc(NC(=O)c1ccccc1)n1nc(nc21)-c1ccc(cc1)[N+]([O-])=O
COc1ccc(cc1)-c1nc2c3cn(C)nc3nc(N(C(=O)c3ccccc3)C(=O)c3ccccc3)n2n1
Cn1cc2c(n1)nc(N(C(=O)c1ccccc1)C(=O)c1ccccc1)n1nc(nc21)-c1ccc(Cl)cc1
O=C(Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccccc1)c1ccccc1
Brc1ccc(cc1)-c1nc2c3cn(CCc4ccccc4)nc3nc(NC(=O)c3ccccc3)n2n1
Cn1cc2c(n1)nc(NC(=O)Cc1ccccc1)n1nc(nc21)-c1ccccc1
Cn1cc2c(n1)nc(NC(=O)Cc1ccccc1)n1nc(nc21)-c1ccc(F)cc1
Cn1cc2c(n1)nc(NC(=O)Cc1ccccc1)n1nc(nc21)-c1ccc(Cl)cc1
Cn1cc2c(n1)nc(NC(=O)Cc1ccccc1)n1nc(nc21)-c1ccc(Br)cc1
COc1ccc(cc1)-c1nc2c3cn(C)nc3nc(NC(=O)Cc3ccccc3)n2n1
Cn1cc2c(n1)nc(NC(=O)Cc1ccccc1)n1nc(nc21)-c1ccc(cc1)[N+]([O-])=O
CC(=O)NCCNc1nc(nc2[nH]c(cc12)C(=O)N1CCN(CCCc2ccccc2)CC1)-c1ccccc1
CCn1c2nc([nH]c2c(=O)n(CC2CC2)c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cn[nH]c1
CCCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(c1)-c1cccnc1
Cn1c2nc(-c3ccccc3)n(O)c2c(=O)n(C)c1=O
Nc1nc(-n2cncn2)c2nnn(Cc3ccccc3F)c2n1
CC(C)Cn1c(Br)nc2c(N)ncnc12
Nc1ncnc2n(CCO)c(Br)nc12
[#6]-[#6]-[#8]-c1cccc2c(-[#6])nc(\[#7]=[#6](/[#7])-[#7])nc12
COc1ccc2c(C)nc(Nc3nc(O)c[nH]3)nc2c1
CCc1nc2n[nH]cc2c2nc(nn12)-c1ccccc1
COc1ccc(Nc2c(c(C)nn2-c2ccccc2C)-c2ccc3nccnc3c2)c(c1)C(O)=O
Cc1nn(c(Nc2ccc(Cl)cc2C(O)=O)c1-c1ccc2nccnc2c1)-c1ccccc1C
Cc1nn(c(Nc2ccc(C)cc2C(O)=O)c1-c1ccc2nccnc2c1)-c1ccccc1C
Cc1nn(c(Nc2ccccc2C(O)=O)c1-c1ccc2nccnc2c1)-c1ccccc1C
COc1ccc(Nc2c(c(C)nn2-c2ccccc2)-c2ccc3nccnc3c2)c(c1)C(O)=O
COc1ccc(Nc2c(c(C)nn2C2CCCCC2)-c2ccc3nccnc3c2)c(c1)C(O)=O
COc1ccc(Nc2c(c(C)nn2-c2ccccc2Cl)-c2ccc3nccnc3c2)c(c1)C(O)=O
CCc1ccccc1-n1nc(C)c(c1Nc1ccc(OC)cc1C(O)=O)-c1ccc2nccnc2c1
Cc1ccccc1-n1nc(c(c1Nc1ccccc1C(O)=O)-c1ccc2nccnc2c1)C(F)(F)F
CCc1nn(c(Nc2ccccc2C(O)=O)c1-c1ccc2nccnc2c1)-c1ccccc1C
Cc1ccccc1-n1ncc(c1Nc1ccccc1C(O)=O)-c1ccc2nccnc2c1
Cc1nn(c(Nc2ccccc2C(O)=O)c1-c1cc(F)c2nccnc2c1)-c1ccccc1C
Cc1nn(Cc2ccccc2)c(=O)c2ncn3nc(cc3c12)-c1ccccc1
Cc1nn(Cc2ccccc2)c(=O)c2ncn3nc(cc3c12)-c1ccsc1
CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)Nc3ccccc3)ccc2[nH]c1=O
CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)NCC3CC3)ccc2[nH]c1=O
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COc1ccc2[nH]c(=O)c(c(CCc3ccccc3)c2c1)S(C)(=O)=O
Clc1ccc(CNC(=O)COc2ccc3[nH]c(=O)c(C#N)c(CCc4ccccc4)c3c2)cc1Cl
O=C(COc1ccc2[nH]c(=O)c(-c3ccco3)c(CCc3ccccc3)c2c1)NCc1ccccc1
O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NCc1ccccc1
O=C(CCc1ccccc1)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1
O=C(NCc1ccccc1)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1
C[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 |r|
C[C@@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 |r|
CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1
O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NC1(CC1)c1ccccc1
CC(C)(C)NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1
CC[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 |r|
OC[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 |r|
Cc1c(c(=O)[nH]c2ccc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)cc12)S(C)(=O)=O
CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(COc3ccccc3)c2c1)c1ccccc1
CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccc(F)cc3)c2c1)c1ccccc1
CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O
COCCCNC(=O)COc1ccc2n(C)c(=O)c(c(CCc3ccccc3)c2c1)-c1ccc(F)cc1F |(10.42,.74,;11.75,-.03,;13.09,.74,;14.42,-.03,;15.75,.74,;17.09,-.03,;18.42,.74,;18.42,2.28,;19.75,-.03,;21.09,.74,;22.42,-.03,;22.42,-1.58,;23.75,-2.35,;25.08,-1.58,;26.42,-2.35,;26.42,-3.89,;27.77,-1.58,;29.1,-2.36,;27.77,-.03,;26.43,.76,;26.43,2.3,;25.09,3.07,;25.09,4.61,;26.42,5.37,;26.43,6.91,;25.09,7.69,;23.75,6.9,;23.76,5.36,;25.08,-.02,;23.75,.74,;29.1,.73,;30.44,-.04,;31.77,.72,;31.78,2.26,;33.11,3.03,;30.43,3.04,;29.11,2.27,;27.77,3.04,)|
COCCCNC(=O)COc1ccc2[nH]c(=O)c(c(CCc3ccccc3)c2c1)-c1ccc(F)cc1F |(-11.59,-10.43,;-10.25,-11.2,;-8.92,-10.43,;-7.58,-11.2,;-6.25,-10.43,;-4.92,-11.2,;-3.58,-10.43,;-3.58,-8.89,;-2.25,-11.2,;-.92,-10.43,;.42,-11.2,;.42,-12.74,;1.75,-13.52,;3.08,-12.75,;4.42,-13.52,;5.77,-12.75,;7.1,-13.53,;5.77,-11.2,;4.42,-10.41,;4.42,-8.87,;3.09,-8.1,;3.09,-6.56,;4.42,-5.8,;4.42,-4.26,;3.09,-3.49,;1.75,-4.27,;1.76,-5.8,;3.08,-11.19,;1.75,-10.43,;7.1,-10.44,;8.43,-11.21,;9.77,-10.45,;9.77,-8.9,;11.11,-8.14,;8.43,-8.13,;7.1,-8.9,;5.77,-8.13,)|
Cn1c2ccc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)cc2c(CCc2ccccc2)c(c1=O)S(C)(=O)=O
COCCCNC(=O)COc1ccc2[nH]c(=O)c(c(CCc3ccccc3)c2c1)S(C)(=O)=O
Cn1c2ccc(OCC(=O)NCc3ccccc3)cc2c(CCc2ccccc2)c(c1=O)S(C)(=O)=O
Cn1c2ccc(OCC(=O)NCc3ccccc3)cc2c(CCc2ccccc2)c(-c2ccc(F)cc2F)c1=O |(4.58,-37.42,;4.58,-35.88,;3.24,-35.1,;1.91,-35.87,;.58,-35.1,;.58,-33.55,;-.75,-32.78,;-2.09,-33.55,;-3.42,-32.78,;-3.42,-31.24,;-4.75,-33.55,;-6.09,-32.78,;-7.42,-33.56,;-8.75,-32.78,;-10.09,-33.55,;-10.09,-35.09,;-8.74,-35.86,;-7.42,-35.09,;1.91,-32.78,;3.24,-33.55,;4.59,-32.77,;4.59,-31.23,;3.25,-30.46,;3.25,-28.92,;4.58,-28.15,;4.59,-26.62,;3.25,-25.84,;1.91,-26.62,;1.92,-28.16,;5.93,-33.55,;7.26,-32.79,;8.6,-33.56,;9.93,-32.8,;9.94,-31.26,;11.27,-30.49,;8.59,-30.48,;7.27,-31.25,;5.93,-30.49,;5.93,-35.11,;7.26,-35.88,)|
COc1ccc2[nH]c(=O)c(c(CCc3ccccc3)c2c1)S(C)(=O)=O
CC(C)(NC(=O)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1
CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3ccccn3)c(CCc3ccccc3)c2c1)c1ccccc1
CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3cccnc3)c(CCc3ccccc3)c2c1)c1ccccc1
CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3ccncc3)c(CCc3ccccc3)c2c1)c1ccccc1
Cc1cc(on1)-c1c(CCc2ccccc2)c2cc(OCC(=O)NC(C)(C)c3ccccc3)ccc2[nH]c1=O
CS(=O)(=O)c1c(-c2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O
CC(C)CCc1c(-c2nccs2)c(=O)[nH]c2ccc(OCC(=O)NC(C)(C)c3ccccc3)cc12
CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCC(F)(F)F)c2c1)c1ccccc1
CCC(=O)Nc1cc(nc(n1)-c1ccccc1)-c1ccccc1
CCC(=O)Nc1cc(nc(n1)-c1ccc2OCOc2c1)-c1ccc2OCOc2c1
CC(=O)Nc1cc(nc(n1)-c1ccco1)-c1ccco1
CCC(=O)Nc1cc(nc(n1)-c1ccco1)-c1ccco1
CCCC(=O)Nc1cc(nc(n1)-c1ccco1)-c1ccco1
CC(=O)Nc1cc(nc(n1)-c1ccoc1)-c1ccoc1
CCC(=O)Nc1cc(nc(n1)-c1ccoc1)-c1ccoc1
CCC(=O)Nc1cc(nc(n1)-c1ccsc1)-c1ccsc1
CCC(=O)Nc1nc(cc(n1)-c1ccccc1)-c1ccccc1
CCC(=O)Nc1nc(cc(n1)-c1ccc(SC)cc1)-c1ccc(SC)cc1
CCC(=O)Nc1nc(cc(n1)-c1ccccc1F)-c1ccccc1F
CCC(=O)Nc1nc(cc(n1)-c1ccsc1)-c1ccsc1
O=C(Nc1cnc(-c2ccncc2)c(n1)-c1ccco1)C1CC1
CC(=O)Nc1cnc(-c2ccncc2)c(n1)-c1ccco1
CCC(=O)Nc1cnc(-c2ccncc2)c(n1)-c1ccco1
CC(C)C(=O)Nc1cnc(-c2ccncc2)c(n1)-c1ccco1
O=C(Nc1cnc(-c2ccncc2)c(n1)-c1ccco1)C1CCC1
O=C(Nc1cnc(-c2ccncc2)c(n1)-c1ccco1)C1CCCC1
Fc1ccc(cc1)C(=O)Nc1cnc(-c2ccncc2)c(n1)-c1ccco1
O=C(CC1CCCC1)Nc1cnc(-c2ccncc2)c(n1)-c1ccco1
Cc1ccc(o1)-c1nc(NC(=O)C2CC2)cnc1-c1ccncc1
O=C(Nc1cnc(-c2ccncc2)c(n1)-c1ccccn1)C1CC1
O=C(Nc1cnc(-c2ccncc2)c(n1)-c1cccnc1)C1CC1
O=C(Nc1cnc(-c2ccncc2)c(n1)-c1ccncc1)C1CC1
Fc1ccccc1-c1nc(NC(=O)C2CC2)cnc1-c1ccncc1
O=C(Nc1cnc(-c2ccncc2)c(n1)-c1ncco1)C1CC1
O=C(Nc1cnc(-c2ccncc2)c(n1)-c1cnco1)C1CC1
O=C(Nc1cnc(-c2ccncn2)c(n1)-c1ccco1)C1CC1
Clc1cnccc1-c1ncc(NC(=O)C2CC2)nc1-c1cccnc1
Fc1cncc(F)c1-c1ncc(NC(=O)C2CC2)nc1-c1cccnc1 |(-1.07,4.1,;-2.52,3.57,;-3.7,4.56,;-5.15,4.04,;-5.41,2.52,;-4.23,1.53,;-4.76,.08,;-2.79,2.06,;-1.25,.77,;.08,1.54,;1.41,.77,;1.41,-.77,;2.75,-1.54,;4.08,-.77,;5.41,-1.54,;4.08,.77,;4.85,2.1,;3.31,2.1,;.08,-1.54,;-1.25,-.77,;-2.79,-2.06,;-4.23,-1.53,;-5.41,-2.52,;-5.15,-4.04,;-3.7,-4.56,;-2.52,-3.57,)|
Fc1cnccc1-c1ncc(NC(=O)C2CC2)nc1-c1ccncc1
Fc1ccccc1-c1nc(NC(=O)C2CC2)cnc1-c1ccncc1F
Fc1cnccc1-c1ncc(NC(=O)C2CC2)nc1-c1ncco1
Fc1cnccc1-c1ncc(NC(=O)C2CC2)nc1-c1cnco1
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(c4)C(F)(F)F)c3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(O)(CC3)c3cccc(c3)C(F)(F)F)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@@H](C3)NC(=O)c3cccc(c3)C(F)(F)F)sc12 |r|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@H](C3)NC(=O)c3cccc(c3)C(F)(F)F)sc12 |r|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccnn3C)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@@H](CC3)NS(=O)(=O)c3cccc(c3)C(F)(F)F)sc12 |r,wU:18.17,wD:21.24,(10.57,-46.93,;10.57,-45.39,;11.9,-44.62,;13.23,-45.39,;14.57,-44.62,;13.24,-46.93,;11.9,-43.08,;10.57,-42.31,;10.57,-40.76,;11.9,-39.99,;11.89,-38.45,;13.22,-37.68,;13.23,-40.76,;14.71,-40.28,;15.62,-41.53,;17.16,-41.53,;17.93,-40.2,;17.16,-38.86,;19.46,-40.19,;20.23,-38.85,;21.77,-38.86,;22.54,-40.2,;21.76,-41.53,;20.23,-41.52,;24.08,-40.2,;24.85,-41.54,;23.5,-42.3,;24.83,-43.07,;26.38,-41.53,;27.14,-42.85,;28.67,-42.85,;29.43,-41.52,;28.65,-40.19,;27.12,-40.21,;29.41,-38.86,;30.95,-38.84,;28.63,-37.53,;30.17,-37.51,;14.71,-42.78,;13.23,-42.31,)|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(C3)C(=O)c3cccc(c3)C(F)(F)F)sc12 |r|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@@H](CC3)NS(=O)(=O)c3cccc(c3)C(F)(F)F)sc12 |r,wU:18.17,21.24,(11.5,-4.73,;11.5,-3.19,;12.83,-2.42,;14.17,-3.19,;15.5,-2.41,;14.17,-4.73,;12.83,-.88,;11.5,-.11,;11.5,1.44,;12.83,2.21,;12.82,3.75,;14.16,4.52,;14.16,1.45,;15.64,1.93,;16.55,.67,;18.09,.67,;18.86,2.01,;18.09,3.34,;20.4,2.02,;21.17,.68,;22.7,.67,;23.48,2.01,;22.71,3.34,;21.16,3.35,;25.02,2,;25.78,.66,;24.44,-.09,;26.17,-.82,;27.31,.67,;28.07,-.65,;29.6,-.65,;30.36,.68,;29.58,2.01,;28.06,2,;30.34,3.35,;31.88,3.36,;29.56,4.67,;31.1,4.69,;15.64,-.58,;14.17,-.1,)|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)C3CCN(CC3)C(=O)c3cccc(c3)C(F)(F)F)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(CC3)c3cccc(c3)C(F)(F)F)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@@H](CC3)NCc3cccc(c3)C(F)(F)F)sc12 |r,wU:18.17,wD:21.24,(30.23,-47.93,;30.23,-46.39,;31.56,-45.62,;32.9,-46.39,;34.23,-45.62,;32.9,-47.93,;31.56,-44.08,;30.23,-43.31,;30.23,-41.77,;31.56,-41,;31.55,-39.46,;32.89,-38.68,;32.89,-41.76,;34.37,-41.28,;35.28,-42.53,;36.82,-42.53,;37.59,-41.2,;36.82,-39.87,;39.13,-41.19,;39.89,-39.86,;41.44,-39.86,;42.2,-41.2,;41.43,-42.53,;39.89,-42.53,;43.74,-41.21,;44.51,-42.54,;46.04,-42.54,;46.8,-43.86,;48.33,-43.85,;49.09,-42.52,;48.31,-41.2,;46.79,-41.21,;49.07,-39.86,;50.61,-39.85,;48.29,-38.53,;49.83,-38.52,;34.37,-43.79,;32.89,-43.31,)|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@@H](C3)NCc3cccc(c3)C(F)(F)F)sc12 |r|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(CC3)S(=O)(=O)c3cccc(c3)C(F)(F)F)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@@H](CC3)NC(=O)c3cccc(c3)C(F)(F)F)sc12 |r,wU:18.17,21.24,(-10.24,-4.6,;-10.24,-3.06,;-8.91,-2.29,;-7.57,-3.06,;-6.24,-2.29,;-7.57,-4.6,;-8.91,-.75,;-10.24,.02,;-10.24,1.56,;-8.91,2.33,;-8.91,3.87,;-7.58,4.65,;-7.57,1.57,;-6.1,2.05,;-5.19,.8,;-3.65,.8,;-2.88,2.13,;-3.65,3.46,;-1.34,2.14,;-.57,.8,;.96,.8,;1.74,2.13,;.97,3.47,;-.58,3.47,;3.28,2.12,;4.04,.79,;3.27,-.55,;5.57,.79,;6.33,-.53,;7.86,-.52,;8.62,.81,;7.84,2.13,;6.32,2.12,;8.61,3.47,;10.15,3.48,;7.83,4.8,;9.37,4.81,;-6.1,-.46,;-7.57,.02,)|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@@H](CC3)NC(=O)c3cccc(c3)C(F)(F)F)sc12 |r,wU:18.17,wD:21.24,(-11.53,-48.22,;-11.53,-46.68,;-10.19,-45.91,;-8.85,-46.68,;-7.52,-45.91,;-8.85,-48.22,;-10.19,-44.37,;-11.53,-43.6,;-11.53,-42.05,;-10.19,-41.28,;-10.2,-39.74,;-8.87,-38.97,;-8.86,-42.05,;-7.38,-41.57,;-6.47,-42.82,;-4.93,-42.82,;-4.16,-41.49,;-4.93,-40.15,;-2.63,-41.48,;-1.86,-40.14,;-.32,-40.15,;.45,-41.49,;-.32,-42.82,;-1.86,-42.82,;1.99,-41.49,;2.76,-42.83,;1.99,-44.16,;4.29,-42.82,;5.05,-44.15,;6.58,-44.14,;7.34,-42.81,;6.56,-41.49,;5.03,-41.5,;7.32,-40.15,;8.86,-40.14,;6.54,-38.82,;8.08,-38.8,;-7.38,-44.08,;-8.86,-43.6,)|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CCN(C3)C(=O)c3cccc(c3)C(F)(F)F)sc12 |r|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(C3)S(=O)(=O)c3cccc(c3)C(F)(F)F)sc12 |r|
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)C3CCN(Cc4cccc(c4)C(F)(F)F)CC3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)C3CCN(CC3)S(=O)(=O)c3cccc(c3)C(F)(F)F)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(Cc4cccc(c4)C(F)(F)F)C3)sc12 |r|
COc1ccc(NC(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
CC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |c:4|
CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |c:5|
CC[C@@H]1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |r,c:5|
CC[C@H]1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |r,c:5|
COc1cc(-c2nc3c4NC(C)Cn4c(=O)n(CC=C)c3n2)n(C)n1
CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C
CC[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
CC[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4CC(C)N=C4c3[nH]2)n(C)n1 |c:23|
COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)nn1C |c:5|
CC1CN2C(=N1)c1[nH]c(nc1N(CC=C)C2=O)-c1cc(OCc2ccccc2)nn1C |c:4|
CCC1Cn2c(N1)c1nc(nc1n(Cc1ccccc1)c2=O)-c1cc(C)n(C)n1
COc1cc(on1)-c1nc2c3NC(C)Cn3c(=O)n(CC=C)c2n1
CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)no1
COc1cc(on1)-c1nc2N(Cc3ccccc3)C(=O)N3CC(C)N=C3c2[nH]1 |c:26|
CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)no1 |c:5|
CCC1CN2C(=N1)c1[nH]c(nc1N(CC=C)C2=O)-c1cc(OCc2ccccc2)nn1C |c:5|
CC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OCc2ccccc2)nn1C |c:4|
CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OCc2ccccc2)nn1C |c:5|
CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1
CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1
C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1 |r|
C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1 |r|
CC1Cn2c(N1)c1nc(nc1n(Cc1ccccc1)c2=O)-c1cc(C)n(C)n1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(F)cc1)n1nc(nc21)-c1ccc(cc1)C(F)(F)F
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(F)cc1)n1nc(nc21)-c1ccc(cc1)-c1ccccc1
COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccc(Cl)cc2)cc1
COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccc(Br)cc2)cc1
COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccc(cc2)C(F)(F)F)cc1
COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccc(cc2)-c2ccccc2)cc1
Fc1ccc(cc1)-c1nc2c3cn(CCc4ccccc4)nc3nc(NC(=O)c3ccccc3)n2n1
Clc1ccc(cc1)-c1nc2c3cn(CCc4ccccc4)nc3nc(NC(=O)c3ccccc3)n2n1
COc1ccc(cc1)-c1nc2c3cn(CCc4ccccc4)nc3nc(NC(=O)c3ccccc3)n2n1
O=C(Cc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(nn12)-c1ccccc1
Fc1ccc(cc1)-c1nc2c3cn(CCc4ccccc4)nc3nc(NC(=O)Cc3ccccc3)n2n1
Clc1ccc(cc1)-c1nc2c3cn(CCc4ccccc4)nc3nc(NC(=O)Cc3ccccc3)n2n1
Brc1ccc(cc1)-c1nc2c3cn(CCc4ccccc4)nc3nc(NC(=O)Cc3ccccc3)n2n1
Cn1cc2c(n1)nc(N)n1nc(nc21)-c1ccc(cc1)C(F)(F)F
Cn1cc2c(n1)nc(N)n1nc(nc21)-c1ccc(cc1)-c1ccccc1
Cn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccc(Cl)cc1
Cn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccc(Br)cc1
Cn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccc(cc1)C(F)(F)F
Cn1cc2c(n1)nc(NC(=O)Nc1ccccc1)n1nc(nc21)-c1ccc(cc1)-c1ccccc1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(F)cc1)n1nc(nc21)-c1ccc(Cl)cc1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc(F)cc1)n1nc(nc21)-c1ccc(Br)cc1
CCCn1c(Oc2cccnc2C)nc2nc([nH]c2c1=O)C1CCCC1
CCCn1c(nc2nc([nH]c2c1=O)C1CCCC1)-c1cccc(OC)c1
CCCn1c(Oc2ccc(F)c(F)c2)nc2nc([nH]c2c1=O)C1CCCC1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CCN(C2)c2cccc(OC)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(C)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC2CN(C(=O)C2)c2cccc(F)c2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC2CN(C(=O)C2)c2cccc(c2)C(F)(F)F)nc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CCN(C2=O)c2cccc(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC(=O)N2CCN(CC2)c2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC2CN(C(=O)C2)c2ccc(cc2)C(F)(F)F)cc1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC2CN(C(=O)C2)c2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC2CN(C(=O)C2)c2ccc(F)cc2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC(O)C2CN(C(=O)C2)c2cccc(c2)C(F)(F)F)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(OC)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC(=O)N2CCN(CC2)c2ccc(cc2)C(F)(F)F)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC2CN(C(=O)C2)c2cccc(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC2CN(C(=O)C2)c2cccc(c2)C(F)(F)F)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CCC2CN(C(=O)C2)c2cccc(c2)C(F)(F)F)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(F)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CCN(C2)c2ccc(C)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(cc2)C#N)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(OC(F)(F)F)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC2CN(C(=O)C2)c2ccc(cc2)C(F)(F)F)nc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(c1)C(C)C1CN(C(=O)C1)c1cccc(c1)C(F)(F)F
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2cccc(OC)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC(=O)N2CCN(CC2)c2ccc(C)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CCN(C2)c2ccc(OC(F)(F)F)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(cc2)C(F)(F)F)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(cc2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC2CN(C(=O)C2)c2ccc(cc2)C(F)(F)F)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CCN(C2=O)c2ccc(OC(F)(F)F)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CCN(C2=O)c2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(F)cc2F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC2CN(C(=O)C2)c2cccc(F)c2)nc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(cc2)C(O)=O)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC(=O)N2CCN(CC2)c2ccc(F)c(Cl)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC2CN(C(=O)C2)c2cccc(c2)C(F)(F)F)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2cccc(OC(F)(F)F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2cccc(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC2CN(C(=O)C2)c2ccc(F)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC2CN(C(=O)C2)c2ccc(F)cc2)nc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CCN(C2)c2ccc(OC)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CCN(C2)c2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC(=O)N2CCN(CC2)c2ccc(F)cc2F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC2CN(C(=O)C2)c2cccc(F)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(F)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2cccc(C)c2)c1
Cn1c2[nH]cnc2c(=O)n(C)c1=O
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC2CN(C(=O)C2)c2cccc(OC(F)(F)F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC2CN(C(=O)C2)c2ccc(OC)cc2)c1
CC(C)(C)OC(=O)N1CCN(CC1)c1nc(N)n2nc(nc2n1)-c1ccco1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCCC1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CC[NH2+]CC1
CC(C)(C)OC(=O)NCCNc1nc(NCCNC(=O)OC(C)(C)C)n2nc(nc2n1)-c1ccco1
CC(C)(C)OC(=O)NCCNc1nc(N)n2nc(nc2n1)-c1ccco1
CC(C)(C)OC(=O)NCCCCCNc1nc(N)n2nc(nc2n1)-c1ccco1
CC(C)(C)OC(=O)NCCOCCOCCNc1nc(N)n2nc(nc2n1)-c1ccco1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(Cc2ccccc2)CC1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(Cc2cccc(Cl)c2)CC1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(Cc2ccc(F)cc2)CC1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(Cc2ccc(Cl)cc2)CC1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(Cc2ccc(Br)cc2)CC1
Nc1nc(NCCOCCOCC[NH3+])nc2nc(nn12)-c1ccco1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(CC1)C(=O)Cc1ccc(Br)cc1
CCCCC(=O)N1CCN(CC1)c1nc(N)n2nc(nc2n1)-c1ccco1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(CC1)C(=O)Cc1ccccc1
COC(=O)CCC(=O)N1CCN(CC1)c1nc(N)n2nc(nc2n1)-c1ccco1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(CC1)C(=O)C(Cl)Cl
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(CC1)C(=O)c1ccc(cc1)[N+]([O-])=O
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(CC1)C(=O)c1ccccc1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(CC1)C(=O)c1cccc2ccccc12
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(CC1)C(=O)Cc1ccc(Cl)cc1
[NH3+]CCNc1nc(NCC[NH3+])n2nc(nc2n1)-c1ccco1
Nc1nc(NCC[NH3+])nc2nc(nn12)-c1ccco1
Nc1nc(NCCC[NH3+])nc2nc(nn12)-c1ccco1
Nc1nc(NCCCCC[NH3+])nc2nc(nn12)-c1ccco1
Nc1nc(nc2nc(nn12)-c1ccco1)N1CCN(CC1)C(=O)C(c1ccccc1)c1ccccc1
CC(C)(C)C(=O)N1CCN(CC1)c1nc(N)n2nc(nc2n1)-c1ccco1
CC(C)(C)CC(=O)N1CCN(CC1)c1nc(N)n2nc(nc2n1)-c1ccco1
O=C(Nc1nc(Oc2ccccc2)nc2nc(nn12)-c1ccco1)c1ccccc1
Nc1nc(=O)[nH]c2nc(nn12)-c1ccco1
O=C(Nc1nc(=O)[nH]c2nc(nn12)-c1ccco1)c1ccccc1
CC(C)(C)OC(=O)NCC1CCC(CNc2nc(N)n3nc(nc3n2)-c2ccco2)CC1 |(24.73,-16.21,;24.74,-14.67,;23.41,-13.89,;23.4,-15.43,;26.07,-13.91,;26.09,-12.37,;24.76,-11.59,;27.42,-11.61,;28.75,-12.39,;30.09,-11.63,;30.1,-10.09,;31.44,-9.33,;32.76,-10.11,;34.09,-9.34,;34.1,-7.8,;35.44,-7.04,;35.44,-5.49,;36.77,-4.72,;36.76,-3.18,;38.1,-5.48,;39.58,-5,;40.49,-6.26,;39.58,-7.51,;38.11,-7.04,;36.77,-7.81,;42.03,-6.26,;42.93,-5.01,;44.4,-5.49,;44.4,-7.03,;42.93,-7.5,;32.77,-11.64,;31.42,-12.41,)|
CC(C)(C)OC(=O)NCCCNc1nc(N)n2nc(nc2n1)-c1ccco1
Nc1nc(NCC2CCC(C[NH3+])CC2)nc2nc(nn12)-c1ccco1 |(33.51,-20.77,;33.51,-22.31,;32.18,-23.08,;32.18,-24.63,;30.84,-25.4,;29.51,-24.62,;28.17,-25.39,;26.84,-24.61,;25.51,-25.37,;25.5,-26.91,;24.16,-27.67,;22.83,-26.89,;26.83,-27.69,;28.17,-26.92,;33.51,-25.4,;34.85,-24.63,;36.32,-25.11,;37.23,-23.85,;36.32,-22.6,;34.85,-23.08,;38.77,-23.85,;39.68,-22.61,;41.14,-23.08,;41.14,-24.62,;39.68,-25.1,)|
Nc1nc(N)n2nc(nc2n1)-c1ccco1
Nc1nc(NC(=O)c2ccccc2)n2nc(nc2n1)-c1ccco1
Cn1cc2nc(N)n3nc(nc3c2c1)-c1ccco1
CCCn1cc2nc(N)n3nc(nc3c2c1)-c1ccco1
Nc1nc2cn(CCc3ccccc3)cc2c2nc(nn12)-c1ccco1
Nc1nc2cn(CCCc3ccccc3)cc2c2nc(nn12)-c1ccco1
COc1ccc(NC(=O)Nc2nc3cn(C)cc3c3nc(nn23)-c2ccco2)cc1
CCCn1cc2nc(NC(=O)Nc3ccc(OC)cc3)n3nc(nc3c2c1)-c1ccco1
COc1ccc(NC(=O)Nc2nc3cn(CCc4ccccc4)cc3c3nc(nn23)-c2ccco2)cc1
COc1ccc(NC(=O)Nc2nc3cn(CCCc4ccccc4)cc3c3nc(nn23)-c2ccco2)cc1
Cn1cc2nc(NC(=O)Nc3ccncc3)n3nc(nc3c2c1)-c1ccco1
Cn1ncc2nc(N)n3nc(nc3c12)-c1ccco1
CCCn1ncc2nc(N)n3nc(nc3c12)-c1ccco1
Nc1nc2cnn(CCc3ccccc3)c2c2nc(nn12)-c1ccco1
Nc1nc2cnn(CCCc3ccccc3)c2c2nc(nn12)-c1ccco1
COc1ccc(NC(=O)Nc2nc3cnn(C)c3c3nc(nn23)-c2ccco2)cc1
CCCn1ncc2nc(NC(=O)Nc3ccc(OC)cc3)n3nc(nc3c12)-c1ccco1
COc1ccc(NC(=O)Nc2nc3cnn(CCc4ccccc4)c3c3nc(nn23)-c2ccco2)cc1
COc1ccc(NC(=O)Nc2nc3cnn(CCCc4ccccc4)c3c3nc(nn23)-c2ccco2)cc1
Cn1cc2nc(N)n3nc(nc3c2n1)-c1ccco1
CCCn1cc2nc(N)n3nc(nc3c2n1)-c1ccco1
Nc1nc2cn(CCc3ccccc3)nc2c2nc(nn12)-c1ccco1
Nc1nc2cn(CCCc3ccccc3)nc2c2nc(nn12)-c1ccco1
COc1ccc(NC(=O)Nc2nc3cn(C)nc3c3nc(nn23)-c2ccco2)cc1
CCCn1cc2nc(NC(=O)Nc3ccc(OC)cc3)n3nc(nc3c2n1)-c1ccco1
COc1ccc(NC(=O)Nc2nc3cn(CCc4ccccc4)nc3c3nc(nn23)-c2ccco2)cc1
COc1ccc(NC(=O)Nc2nc3cn(CCCc4ccccc4)nc3c3nc(nn23)-c2ccco2)cc1
Cn1ncc2nc(NC3CCCCC3)n3nc(nc3c12)-c1ccco1
Cn1ncc2nc(N3CCOCC3)n3nc(nc3c12)-c1ccco1
CN1CCN(CC1)c1nc2cnn(C)c2c2nc(nn12)-c1ccco1
Cn1ncc2nc(N3CCN(CC3)c3ccccc3)n3nc(nc3c12)-c1ccco1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3cc4ccccc4cc3[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(cc3[nH]2)[N+]([O-])=O)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(cc3[nH]2)C(=O)OCC)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(cc3[nH]2)C(O)=O)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3c(C)cccc3[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3cc(cc(Cl)c3[nH]2)C(F)(F)F)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3cc(cc(c3[nH]2)C(F)(F)F)C(F)(F)F)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3cc(Cl)c(F)cc3[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3cc(C)c(C)cc3[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccccc3c(=O)[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ncncc3[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2noc(n2)-c2cccc(OC)c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccccc3[nH]2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(Cl)cc3[nH]2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(Br)cc3[nH]2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(cc3[nH]2)C(F)(F)F)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(OC)cc3[nH]2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3cc(Cl)c(F)cc3[nH]2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3cc(cc(Cl)c3[nH]2)C(F)(F)F)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3cc(cc(c3[nH]2)C(F)(F)F)C(F)(F)F)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(=O)[nH]n1C
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1cc(=O)[nH]n1C
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccccc3[nH]2)nn1C
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(F)cc2)nn1C
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc3OCOc3c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(F)cc2)nn1C
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(F)cc3[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(Cl)cc3[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(OC)cc3[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(Br)cc3[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(cc3[nH]2)C(F)(F)F)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccc(C)cc3[nH]2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCc2nc3ccccc3[nH]2)nn1C
COc1ccc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)c(F)c3)nc12
COc1cnc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)cc3)nc12
COc1ccc(N2CCOCC2)c2sc(NC(=O)C3(C)CCC(O)CC3)nc12 |(8.17,-13.78,;9.51,-14.53,;9.54,-16.06,;8.22,-16.86,;8.24,-18.4,;9.59,-19.15,;9.61,-20.69,;10.95,-21.44,;10.98,-22.98,;9.66,-23.77,;8.31,-23.02,;8.29,-21.48,;10.91,-18.36,;12.39,-18.81,;13.27,-17.55,;14.81,-17.53,;15.6,-18.85,;14.85,-20.2,;17.13,-19.03,;16.68,-20.51,;17.04,-17.5,;18.33,-16.65,;19.7,-17.35,;20.99,-16.5,;19.79,-18.88,;18.51,-19.72,;12.34,-16.32,;10.89,-16.81,)|
CCN(CC)C1CCC(C)(CC1)C(=O)Nc1nc2c(OC)ccc(N3CCOCC3)c2s1
COc1ccc(N2CCOCC2)c2sc(NC(=O)C3(C)CCC(C)(O)CC3)nc12 |(8.17,-13.78,;9.51,-14.53,;9.54,-16.06,;8.22,-16.86,;8.24,-18.4,;9.59,-19.15,;9.61,-20.69,;10.95,-21.44,;10.98,-22.98,;9.66,-23.77,;8.31,-23.02,;8.29,-21.48,;10.91,-18.36,;12.39,-18.81,;13.27,-17.55,;14.81,-17.53,;15.6,-18.85,;14.85,-20.2,;17.13,-19.03,;16.68,-20.51,;17.04,-17.5,;18.33,-16.65,;19.7,-17.35,;19.69,-15.82,;20.99,-16.5,;19.79,-18.88,;18.51,-19.72,;12.34,-16.32,;10.89,-16.81,)|
COc1ccc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)cc3)nc12
Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(\C=C\C(=O)c3ccccc3)nc12 |r|
CCCCC#Cc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(nc12)C#Cc1ccccc1 |r|
Oc1ccc(cc1)-n1nc2n(cc([nH]c2=O)-c2ccccc2)c1=O
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCc2ccccc2)cc1
COc1ccc(cc1)-n1nc2n(cc(C)[nH]c2=O)c1=O
O=c1n(nc2n1cc([nH]c2=O)-c1ccccc1)-c1ccccc1
CCOc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1cccc(OCC#C)c1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(O)cc1
CC(C)Oc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
COc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(=O)[nH]1
Oc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(=O)[nH]1
Cc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(=O)[nH]1
Cc1cn2c(nn(-c3ccc(O)cc3)c2=O)c(N)n1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1cccc(OCc2ccccc2)c1
CCNC(=O)C1OC(C(O)C1O)n1cnc2c(NC3CCCC3)nc(Cl)nc12
Oc1ccccc1-n1nc2n(cc([nH]c2=O)-c2ccccc2)c1=O
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1cccc(O)c1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCC#C)cc1
COc1cccc(c1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Oc1cccc(c1)-c1cn2c(nn(-c3ccccc3)c2=O)c(=O)[nH]1
COc1ccc(cc1)-n1nc2c(N)nc(C)cn2c1=O
Nc1nc(cn2c1nn(-c1ccc(cc1)[N+]([O-])=O)c2=O)-c1ccccc1
COc1ccc(cc1)-n1nc2c(N)nc(cn2c1=O)-c1ccccc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccccc1
Nc1nc(cn2c1nn(-c1ccc(O)cc1)c2=O)-c1ccccc1
COc1cccc(c1)-c1cn2c(nn(-c3ccccc3)c2=O)c(=O)[nH]1
COc1ccccc1-n1nc2n(cc([nH]c2=O)-c2ccccc2)c1=O
COc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
COc1ccccc1-n1nc2c(N)nc(cn2c1=O)-c1ccccc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCC2CCC2)cc1
Cc1cn2c(nn(-c3ccccc3)c2=O)c(=O)[nH]1
Nc1ccc(cc1)-n1nc2n(cc([nH]c2=O)-c2ccccc2)c1=O
COc1ccc(cc1)-n1nc2n(cc([nH]c2=O)-c2ccccc2)c1=O
Cc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Cc1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Cc1cn2c(nn(-c3ccc(O)cc3)c2=O)c(=O)[nH]1
Nc1nc(cn2c1nn(-c1ccccc1O)c2=O)-c1ccccc1
CCCOc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCC2CC2)cc1
Nc1ccc(cc1)-n1nc2c(N)nc(cn2c1=O)-c1ccccc1
Cc1nc[nH]c1Cc1nc(cs1)-c1ccccc1
CCS(=O)(=O)Nc1ccc(c(c1)C2=CN(C(=O)c3c2cc[nH]3)C)Oc4ccc(cc4F)F
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2cccc(c2)C(O)=O)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC#Cc2cccc(OC(F)(F)F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2cccc(OC(F)(F)F)c2)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC#Cc2ccc(cc2)C(O)=O)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC#Cc2cccc(c2)C(O)=O)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC#Cc2ccc(OC(F)(F)F)cc2)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC#Cc2ccc(cc2)C(F)(F)F)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC#Cc2ccc(F)cc2)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC#Cc2cccc(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2ccccc2C(=O)OCC)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2ccccc2C(=O)OC)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2cccc(OC)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#CCN(CC)CC)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#CCN2CCCC2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#CCN2CCCCC2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#CCN2CCN(C)CC2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#CCN2CCN(CC2)c2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#CC2(O)CCCC2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2ccc(C)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2ccc(cc2)C#N)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2cccc(c2)C#N)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2ccc(OC(F)(F)F)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2ccc(cc2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2cccc(c2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2ccc(F)cc2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2cccc(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC#Cc2cccc(OC(F)(F)F)c2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC#Cc2ccc(F)cc2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC#Cc2cccc(F)c2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC#Cc2cccc(F)c2)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(CC#Cc2ccc(F)cc2)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(CC#Cc2cccc(c2)C(F)(F)F)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(CC#Cc2cccc(OC(F)(F)F)c2)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(CC#Cc2ccc(OC(F)(F)F)cc2)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(CC#Cc2cccc(c2)C(O)=O)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#CC)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#CCN2CCOCC2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#CC2(O)CCCCC2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2cccc(C)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2ccccc2C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC#Cc2cccc(c2)C(F)(F)F)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC#Cc2ccc(OC(F)(F)F)cc2)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(CC#Cc2ccc(cc2)C(F)(F)F)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#C)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cnn(CC#Cc2cccc(F)c2)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2ccc(cc2)C(=O)OCC)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cnn(CC#Cc2ccc(cc2)C(O)=O)c1
O[C@@H]1[C@@H](CCl)O[C@H]([C@@H]1O)n1cnc2c(N[C@@H]3CCOC3)ncnc12 |r|
O[C@@H]1[C@@H](CCl)O[C@H]([C@@H]1O)n1cnc2c(Nc3ccc(Cl)cc3F)ncnc12 |r|
O[C@@H]1[C@@H](CCl)O[C@H]([C@@H]1O)n1cnc2c(Nc3ccc(Cl)cc3F)nc(Cl)nc12 |r|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(NC4CCCC4)nc(Cl)nc23)n1 |r|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(NC4CC5CCC4C5)ncnc23)n1 |r,TLB:19:20:26:23.24|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(NC4CC5CCC4C5)nc(Cl)nc23)n1 |r,TLB:19:20:26:23.24|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc23)n1 |r|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(Nc4ccc(Cl)cc4F)ncnc23)n1 |r|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(NC4CCCC4)nc(nc23)-c2cc(C)cc(C)c2)n1 |r|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(NC4CC5CCC4C5)nc(nc23)-c2cc(C)cc(C)c2)n1 |r,TLB:19:20:26:23.24|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N[C@@H]4CCOC4)nc(nc23)-c2cc(C)cc(C)c2)n1 |r|
O[C@@H]1[C@@H](CCl)O[C@H]([C@@H]1O)n1cnc2c(N[C@@H]3CCOC3)nc(Cl)nc12 |r|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(NC4CCCC4)ncnc23)n1 |r|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N[C@@H]4CCOC4)ncnc23)n1 |r|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(Nc4ccc(Cl)cc4F)nc(Cl)nc23)n1 |r|
Cc1cc(C)n(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(Nc4ccc(Cl)cc4F)nc(nc23)-c2cc(C)cc(C)c2)n1 |r|
Oc1cc2CC[C@H]3NCc4ccccc4[C@@H]3c2cc1O
CC(C)NC(=O)[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
CNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3NCc4cccc(c4)I)O)O
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(I)c3)ncnc12
c1nc(c2c(n1)n(cn2)[C@@H]3C[C@@H]([C@H]([C@H]3O)O)CO)N
OC[C@@]12C[C@@H]1[C@H]([C@H](O)[C@@H]2O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12
OC[C@@]12C[C@@H]1[C@H]([C@H](O)[C@@H]2O)n1cnc2c(NCc3cccc(I)c3)ncnc12
OC[C@@]12C[C@@H]1[C@H]([C@H](O)[C@@H]2O)n1cnc2c(NC3CCCC3)ncnc12
COc1ccccc1NC(=O)Nc1nc(nc2ccccc12)-c1cccnc1
CCNc1nc(nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O)C#Cc1ccccc1 |r|
Cn1c(nc2NC(=O)N3CCN=C3c12)-c1ccccc1 |c:11|
CSc1n(C)nc2nc(N)n3nc(nc3c12)-c1ccco1
COc1ccc(NC(=O)Nc2nc3nn(C)c(SC)c3c3nc(nn23)-c2ccco2)cc1
COc1ccc(Nc2n(C)nc3nc(N)n4nc(nc4c23)-c2ccco2)cc1
CCNc1n(C)nc2nc(NC(=O)Cc3ccc4OCOc4c3)n3nc(nc3c12)-c1ccco1
CCNc1n(C)nc2nc(NC(=O)Nc3ccc(OC)cc3)n3nc(nc3c12)-c1ccco1
Nc1nc2n(CCc3ccccc3)ncc2c2nc(nn12)-c1ccccc1
CCNc1n(C)nc2nc(N)n3nc(nc3c12)-c1ccco1
COc1ccc(NC(=O)Nc2nc3nn(C)c(N4CCN(C)CC4)c3c3nc(nn23)-c2ccco2)cc1
CSc1n(C)nc2nc(NC(=O)Cc3ccc(CC(C)C)cc3)n3nc(nc3c12)-c1ccco1
COc1ccc(CC(=O)Nc2nc3nn(C)c(SC)c3c3nc(nn23)-c2ccco2)cc1
CCCSc1n(C)nc2nc(N)n3nc(nc3c12)-c1ccco1
Nc1nc2n(CCc3ccccc3)ncc2c2nc(nn12)-c1ccc(OCC(=O)Nc2ccc(I)cc2)cc1
CCOc1ccccc1-c1nc2c3cnn(CCc4ccccc4)c3nc(N)n2n1
Nc1nc2n(CCc3ccccc3)ncc2c2nc(nn12)-c1ccc(OCC(O)=O)cc1
CSc1n(CCCc2ccccc2)nc2nc(N)n3nc(nc3c12)-c1ccco1
CN1CCN(CC1)c1n(C)nc2nc(N)n3nc(nc3c12)-c1ccco1
CSc1n(C)nc2nc(NC(=O)Cc3ccc4OCOc4c3)n3nc(nc3c12)-c1ccco1
Nc1nc2n(CCc3ccccc3)ncc2c2nc(nn12)-c1ccc(CN2CCOCC2)o1
Nc1nc2n(CCc3ccccc3)ncc2c2nc(nn12)-c1ccc(O)cc1
CN1CCN(Cc2ccc(o2)-c2nc3c4cnn(CCc5ccccc5)c4nc(N)n3n2)CC1
CCOC(=O)COc1ccc(cc1)-c1nc2c3cnn(CCc4ccccc4)c3nc(N)n2n1
CSc1n(C)nc2nc(N)n3nc(nc3c12)-c1ccc(CN2CCN(C)CC2)o1
Cn1nc2nc(N)n3nc(nc3c2c1Nc1ccc(O)cc1)-c1ccco1
CC(=O)Nc1cc(cc(n1)-c1ccccc1)-c1ccccc1
COc1cccc(c1)-c1cc(NC(C)=O)nc(c1)-c1cccc(OC)c1
COc1cccc(-c2cc(NC(C)=O)nc(c2)-c2cccc(OC)c2OC)c1OC
Nc1nc(SCc2ncc[nH]2)c(C#N)c(-c2ccc(O)cc2)c1C#N
COc1ccc(cc1)-c1c(C#N)c(N)nc(SCc2ncc[nH]2)c1C#N
COc1cccc(c1)-c1c(C#N)c(N)nc(SCc2ncc[nH]2)c1C#N
Nc1nc(SCc2ncc[nH]2)c(C#N)c(-c2ccccc2)c1C#N
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(C)cn2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)N2CCN(CC2)c2ccccc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(cc2)C(=O)OCC)nn1C
CC(C)Cn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cc(OCC(=O)Nc2ccc(Br)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(I)cc2)nn1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)N2CCN(C)CC2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(NC(=O)Nc2cccc(OC)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(OC)c(OC)c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(OCc3cccc(c3)C(F)(F)F)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(O)c(OC)c2)nn1C
CC(C)Cn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cc(OCC(=O)Nc2ccc(F)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(Br)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Nc2cccc(OC)c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(C)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(I)cc2)nc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(F)cc2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)[C@@H](C)c2ccccc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(cc2)[N+]([O-])=O)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(Cl)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(N)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(C)c(C)c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccccc2)n(C)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(O)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(OCc3ccccc3C(F)(F)F)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(cc2)N2CCOCC2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(cc2)N(C)C)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccccc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)N2CCN(CC2)c2ccc(F)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(NC(=O)Cc2ccc(OC)c(OC)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Nc2ccc(OC)cc2)nn1C
Cn1nc(cc1N)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(OCc3ccccc3)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc3OCOc3c2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(CC(C)C)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(N)n(C)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2cccc(Cl)c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(OCc3ccc(cc3)[N+]([O-])=O)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(OC)c(OC)c2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2cccc(F)c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(cc2)C(C)=O)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(cc2)C(O)=O)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(F)cc2)nn1C
CCCn1c2nc(-c3ccc(N)cc3)n(C)c2c(=O)n(CCC)c1=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(OC)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2cccc(OC)c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Nc2ccc(cc2)N(C)C)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc3OCOc3c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)CCC(O)=O)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(cc2)C(C)CC)nn1C
CC(C)Cn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cc(OCC(=O)Nc2ccc(Br)cc2)n(C)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)[C@H](C)c2ccccc2)nn1C
Cn1nc(NC(=O)Cc2ccccc2)cc1-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2cc(OC)c(OC)c(OC)c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(cc2)C(F)(F)F)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(NC(=O)Cc2ccccc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc(OC)cc2)no1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)N2CCN(Cc3ccccc3)CC2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)CCCN)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C(O)=O)n(C)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Cc2ccc(F)c(F)c2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccncc2)nn1C
CC(C)Cn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cc(OCC(=O)Nc2ccc(F)cc2)n(C)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(NC(=O)Nc2cccc(Cl)c2)nn1C
COC(=Cc1ccc(O)cc1)C(=O)O[C@@H]1[C@H](OC(=O)C=Cc2cnc[nH]2)[C@@H](CSC)O[C@H]1n1cnc2c(N)ncnc12 |w:20.21,3.3|
CSC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)O
Cc1cccc(Nc2nc(c(s2)-n2cncn2)-c2cccc(c2)C#N)n1
N#Cc1cccc(c1)-c1nc(Nc2cccnc2)sc1-n1ccnc1
Cc1nccn1-c1sc(Nc2cccc(C)n2)nc1-c1cccc(c1)C#N
N#Cc1cccc(c1)-c1nc(Nc2ccccn2)sc1-n1cncn1
[O-]C(=O)Nc1nc(c(s1)-n1cncn1)-c1cccc(c1)C#N
N#Cc1cccc(c1)-c1nc(Nc2cccnc2)sc1-n1cncn1
N#Cc1cccc(c1)-c1nc(Nc2ccncc2)sc1-n1cncn1
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(N[C@H](CO)Cc3ccc(cc3)[N+]([O-])=O)nc12
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(N[C@H](CO)Cc3ccc(Br)cc3)nc12
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(N[C@H](CO)Cc3ccc(O)cc3)nc12
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(N[C@H](CO)Cc3ccc(OC)cc3)nc12
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(N[C@H](CO)Cc3ccc(Cl)cc3)nc12
O[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)nc(Cl)nc12
CCCn1c2[nH]c(nc2c(=O)n(CCC)c1=O)C1=CC(C)(C)N([O])C1(C)C |t:19,^1:23|
CCCn1c2[nH]c(nc2c(=O)n(CCC)c1=O)C1CC(C)(C)N([O])C(C)(C)C1 |^1:23|
CCCn1c(=O)n(CC2=CC(C)(C)N([O])C2(C)C)c2[nH]c(nc2c1=O)C1CCCC1 |t:8,^1:14|
CCCc1c(O)c2[nH]c(nc2[nH]c1=O)-c1ccc(OCC(=O)NC2CC(C)(C)N([O])C(C)(C)C2)cc1 |^1:29|
CCCc1nc(N)c2nc(-n3nccn3)n(C)c2n1
Cc1cc2n(C)c(nc2c(N)n1)-n1nccn1
O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1
Cn1c(nc2c(N)nccc12)-n1nccn1
CCCCCc1nc(N)c2nc(-n3nccn3)n(C)c2n1
Cn1c(nc2c(N)nc(CCc3ccccc3)nc12)-n1nccn1
Cn1cc2c(n1)nc(NC(=O)Nc1ccccn1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)[NH+]=c1ccn(C)cc1)n1nc(nc21)-c1ccco1 |(-10.58,-30.28,;-9.82,-28.94,;-8.3,-28.76,;-7.99,-27.26,;-9.33,-26.5,;-10.46,-27.54,;-9.32,-24.95,;-7.99,-24.17,;-7.99,-22.62,;-6.66,-21.85,;-6.66,-20.31,;-5.32,-22.62,;-3.98,-21.85,;-3.98,-20.32,;-2.65,-19.55,;-1.31,-20.32,;.02,-19.54,;-1.3,-21.86,;-2.64,-22.63,;-6.66,-24.95,;-5.19,-24.47,;-4.29,-25.71,;-5.19,-26.96,;-6.66,-26.49,;-2.74,-25.71,;-1.84,-24.46,;-.38,-24.91,;-.37,-26.48,;-1.83,-26.96,)|
Cn1cc2c(n1)nc(NC(=O)Nc1ccc3ccccc3n1)n1nc(nc21)-c1ccco1
Cc1sccc1NC(=O)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc[n+](C)c1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1cccc[n+]1[O-])n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1ccoc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1cc3ccccc3o1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1cc[n+]([O-])cc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)Nc1cccnc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)[NH+]=c1ccccn1C)n1nc(nc21)-c1ccco1 |w:11.11|
Cn1cc2c(n1)nc(NC(=O)Nc1ccco1)n1nc(nc21)-c1ccco1
Cc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)s1
Cn1cc2c(n1)nc(NC(=O)Nc1ccc[n+]([O-])c1)n1nc(nc21)-c1ccco1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CC(O)c1cccc(OC)c1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CC(O)C1CCCCC1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CC(O)c1ccc(OC)cc1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CCCCc1ccccc1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CC(O)c1ccccc1OC
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CC(O)c1ccccc1[N+]([O-])=O
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CC1(O)CCCCC1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CC(O)c1ccccc1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CC1(O)CCCC1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#C[C@H](C)O
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CCc1ccccc1
CCCCC[C@H](O)C#Cc1nc(NCC)c2ncn([C@@H]3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NCC)c2n1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CC(O)c1cccc(c1)[N+]([O-])=O
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC)nc(nc12)C#CC(O)C1CCCC1
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3cc(C)on3)nc(Cl)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3cc(on3)-c3ccccc3)nc(Cl)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccc(C)s3)nc(Cl)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccccc3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3cccnc3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3nc(cn3C)[N+]([O-])=O)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccccc3)nc(Cl)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3ccc(Cl)cc3)ncnc12 |r|
Nc1nc(OCCc2ccc3ccccc3c2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(OCC(=O)Nc4ccccc4C(F)(F)F)cc3)ncnc12
Clc1ccc(cc1)-c1nn2n(c3ccccc3[nH]c2=O)c1=O
COc1ccc(cc1)C(=O)Nc1nc2ccccc2n2n1nc(-c1ccc(C)cc1)c2=O
COc1ccc(cc1)C(=O)Nc1nc2ccc(Cl)cc2n2n1nc(-c1ccc(C)cc1)c2=O
COc1ccc(cc1)C(=O)Nc1nc2ccc(Cl)cc2n2n1nc(-c1ccccc1)c2=O
CNC(=S)OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc23)[C@](C)(O)[C@@H]1O
CNC(=O)OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc23)[C@](C)(O)[C@@H]1O
CNC(=O)OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc23)[C@](C)(O)[C@@H]1O
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N[C@@H]3CCOC3)ncnc12
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N[C@@H]3CCOC3)nc(Cl)nc12
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCOC3)nc(Cl)nc12
CNC(=S)OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc23)[C@](C)(O)[C@@H]1O
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCOC3)ncnc12
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NC3CCCC3)nc(Cl)nc12
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NC3CCCC3)ncnc12
Nc1cc(c(s1)-c1ccc(cc1)C(=O)NCCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)-c1cccc(c1)C(F)(F)F |r|
Nc1sc(cc1C(=O)c1ccccc1)-c1ccc(cc1)C(=O)NCCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCCCCCCNC(=O)c3ccc(cc3)-c3sccc3-c3cccc(c3)C(F)(F)F)ncnc12 |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCCCCCCNC(=O)c3cccc(c3)-c3cc(cs3)C(=O)c3ccccc3)ncnc12 |r|
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccccc1C(=O)NCCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
CC(=O)Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccc(cc1)C(=O)NCCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCCCCCCNC(=O)c3ccc(cc3)-c3sc(N)c(C(=O)c4ccccc4)c3-c3cccc(c3)C(F)(F)F)ncnc12 |r|
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccc(cc1)C(=O)NCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccc(cc1)C(=O)NCCCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1cccc(c1)C(=O)NCCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccc(cc1)C(=O)NCCCCCCNc1nc(Cl)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCCCCCCNC(=O)c3ccc(cc3)-c3scc(C(=O)c4ccccc4)c3-c3cccc(c3)C(F)(F)F)ncnc12 |r|
Nc1ccc(s1)-c1cccc(c1)C(=O)NCCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCCCCCCNC(=O)c3cccc(c3)-c3cccs3)ncnc12 |r|
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccc(cc1)C(=O)NCCCCCCNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccc(cc1)C(=O)NCCCCCCNc1nc(N)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1nn(CC(=O)Nc2ccc(Cl)cc2)c(C)c1I
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1nn(CC(=O)Nc2ccc(Cl)cc2)c(C)c1Br
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccn(CC(=O)Nc2ccc(Cl)cc2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(CC)n(CC(=O)Nc2ccc(Cl)cc2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2cccc3ccccc23)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(OC)c(OC)c2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(Cl)c(Cl)c2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2cccc(OC)c2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(CC(C)C)cc2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(OC)cc2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(C)cc2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(I)cc2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(Cl)cc2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(F)cc2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1nn(CC(=O)Nc2ccc(Cl)cc2)c(C)c1Cl
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2cccc(Cl)c2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(cc2)N(C)C)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(Br)cc2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccccc2)n1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(C)n(CC(=O)Nc2ccc(C)c(C)c2)n1
CCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cn[nH]c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(Cc2cc(on2)-c2ccc(Cl)cc2)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(Cc2cc(on2)-c2ccc(cc2)C(F)(F)F)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(Cc2nc(no2)-c2ccc(Cl)cc2)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(Cc2noc(n2)-c2ccc(cc2)C(F)(F)F)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(Cc2noc(n2)-c2ccc(Cl)cc2)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(c1)-c1ccc[n+]([O-])c1
CCn1c2nc([nH]c2c(=O)n(CC2CC2)c1=O)-c1cnn(c1)-c1ccc(nc1)C(F)(F)F
CCn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cnn(c1)-c1ccc(nc1)C(F)(F)F
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(c1)-c1ccc(nc1)C(F)(F)F
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(c1)-c1ccc(C)nc1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(c1)-c1ccccn1
CCn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCn1c2nc([nH]c2c(=O)n(CC(C)C)c1=O)-c1cn[nH]c1
CCn1c2nc([nH]c2c(=O)n(CC2CC2)c1=O)-c1cnn(Cc2ccccc2)c1
CCn1c2nc([nH]c2c(=O)n(CC2CC2)c1=O)-c1cn[nH]c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(Cc2ccccc2)c1
Cn1c2nc([nH]c2c(=O)n(CC2CC2)c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
Cn1c2nc([nH]c2c(=O)n(CC2CC2)c1=O)-c1cnn(Cc2cccc(F)c2)c1
Cn1c2nc([nH]c2c(=O)n(CC2CC2)c1=O)-c1cnn(Cc2ccccc2)c1
CC(C)Cn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CC(C)Cn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(F)c2)c1
CC(C)Cn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2ccccc2)c1
CC(C)Cn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cn[nH]c1
CCCCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCCCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCCCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2ccccc2)c1
CCCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2ccccc2)c1
CCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1
CCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(F)c2)c1
CCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2ccccc2)c1
CCc1nc(-c2nccs2)c2sccc2n1
OC[C@@H]1CCCN1c1nc(-c2nccs2)c2sccc2n1
C1CC1c1nc(-c2nccs2)c2sccc2n1
CN(C)c1nc(-c2nccs2)c2sccc2n1
Nc1nc(cc(-c2ccccc2)c1C#N)-c1ccco1
Cc1cccc(c1)-c1cc(nc(N)c1C#N)-c1ccco1
Nc1nc(cc(-c2ccc(O)cc2)c1C#N)-c1ccco1
Cc1ccc(o1)-c1cc(nc(N)c1C#N)-c1ccco1
Nc1nc(cc(-c2ccco2)c1C#N)-c1ccco1
Nc1nc(cc(-c2ccco2)c1C#N)-c1cccs1
Nc1nc(cc(-c2cccs2)c1C#N)-c1ccco1
Nc1nc(cc(-c2ccco2)c1C#N)-c1ccccc1
Nc1ncnc2nc(Br)[nH]c12
Cn1cnc2c1ncnc2N
Cn1cnc2ncnc(N)c12
Cn1c(Br)nc2c(N)ncnc12
CCn1cnc2c1ncnc2N
CCn1cnc2ncnc(N)c12
CCn1c2c(c(ncn2)N)nc1Br
CCCn1cnc2c(N)ncnc12
CCCn1cnc2ncnc(N)c12
CCCn1c(Br)nc2c(N)ncnc12
CC(C)n1cnc2c(N)ncnc12
CC(C)n1cnc2ncnc(N)c12
CC(C)n1c(Br)nc2c(N)ncnc12
CCC(C)n1cnc2c(N)ncnc12
CCC(C)n1cnc2ncnc(N)c12
CCC(C)n1c(Br)nc2c(N)ncnc12
CC(C)Cn1cnc2c(N)ncnc12
CC(C)Cn1cnc2ncnc(N)c12
CCCCn1cnc2c(N)ncnc12
CCCCn1c(Br)nc2c(N)ncnc12
Nc1ncnc2n(CCC=C)cnc12
Nc1ncnc2n(CCC=C)c(Br)nc12
Nc1ncnc2n(cnc12)C1CC1
Nc1ncnc2n(CC=C)c(Br)nc12
Nc1ncnc2n(cnc12)C1CCC1
Nc1ncnc2n(C3CCC3)c(Br)nc12
c1nc(c2c(n1)n(cn2)C3CCCC3)N
Nc1ncnc2n(C3CCCC3)c(Br)nc12
Nc1ncnc2n(cnc12)C1CCCCC1
Nc1ncnc2n(C3CCCCC3)c(Br)nc12
Nc1ncnc2n(cnc12)C1CCCCCC1
Nc1ncnc2n(C3CCCCCC3)c(Br)nc12
Nc1ncnc2n(CCO)cnc12
Nc1ncnc2ncn(CCO)c12
Nc1ncnc2n(CCCO)cnc12
Nc1ncnc2ncn(CCCO)c12
c1nc(c2c(n1)n(c(n2)Br)CCCO)N
C[C@@H](Cn1cnc2c1ncnc2N)O
CC(O)Cn1cnc2ncnc(N)c12
CC(O)Cn1c(Br)nc2c(N)ncnc12
Nc1ncnc2n(C[C@H](O)CO)cnc12 |r|
Nc1ncnc2ncn(CC(O)CO)c12
Nc1ncnc2n(CC(O)CO)c(Br)nc12
Nc1ncnc2n(Cc3ccccc3)cnc12
Nc1ncnc2n(Cc3ccccc3)c(Br)nc12
Nc1ncnc2n(CCc3ccccc3)cnc12
Nc1ncnc2n(CCc3ccccc3)c(Br)nc12
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccccc2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(Cl)cc2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(Cl)c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(F)c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(cc2)C(F)(F)F)CC1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(c2)C(F)(F)F)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(c2)C(F)(F)F)CC1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(OC)cc2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(OC)cc2)CC1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc3OCOc3c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc3OCOc3c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CCc2ccccc2)CC1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)NCCO)cc1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(Cl)cc2)CC1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(Cl)c2)CC1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(F)cc2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(F)cc2)CC1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(F)c2)CC1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(cc2)C(F)(F)F)CC1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(C)cc2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(C)cc2)CC1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Clc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)-c1nc2[nH]c(=O)n(CC#C)c(=O)c2[nH]1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(OC)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(OC)cc1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CCc2ccccc2)CC1
CCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCCCC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCCCC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)NC1CCN(Cc2ccccc2)CC1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OC(C)(C)C(=O)N2CCN(CC2)c2nc3cc(Cl)ccc3s2)cc1
CC(C)OC(=O)C1=C(C)N\C(N[C@@H]1c1ccco1)=N/C#N |r,c:6|
CC(C)OC(=O)C1=C(C)N\C(NC1c1ccsc1)=N/C#N |c:6|
CCOC(=O)C1=C(C)N\C(NC1c1ccsc1)=N/C#N |c:5|
CC(C)OC(=O)C1=C(C)N\C(NC1c1cccs1)=N/C#N |c:6|
CC(C)OC(=O)C1=C(C)N\C(NC1c1ccoc1)=N/C#N |c:6|
CCOC(=O)C1=C(C)N\C(NC1c1ccoc1)=N/C#N |c:5|
CC(C)OC(=O)C1=C(C)N\C(NC1c1ccco1)=N/C#N |c:6|
CCOC(=O)C1=C(C)N\C(NC1c1cccs1)=N/C#N |c:5|
CCOC(=O)C1=C(C)N\C(NC1c1ccco1)=N/C#N |c:5|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC3CC3)nc(Cl)nc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccco3)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccs3)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccs3)nc(Cl)nc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(F)c3)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(Cl)c3)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(Cl)c3)nc(Cl)nc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(Br)c3)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(I)c3)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccc(Cl)cc3F)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC3CC3)ncnc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccco3)nc(Cl)nc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(F)c3)nc(Cl)nc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(Br)c3)nc(Cl)nc12 |r|
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccc(Cl)cc3F)nc(Cl)nc12 |r|
OC1CCC(CC1)Nc1nc(nc2[nH]ccc12)-c1ccccc1 |(25.44,4.86,;24.11,4.15,;24.1,2.61,;22.77,1.85,;21.43,2.63,;21.43,4.16,;22.77,4.93,;20.1,1.87,;20.1,.33,;18.77,-.45,;18.78,-1.98,;20.11,-2.75,;21.42,-1.98,;22.89,-2.46,;23.8,-1.22,;22.9,.03,;21.44,-.44,;17.45,-2.75,;16.11,-1.99,;14.78,-2.75,;14.78,-4.3,;16.11,-5.07,;17.45,-4.3,)|
CCCn1c(=O)n(CCc2ccc(N)cc2)c2ncn(CCN(CC)CCO)c2c1=O
Clc1ccc(cc1)C(=O)c1sc(NC(=O)c2ccco2)nc1-c1ccccc1
O=C(Nc1nc(c(s1)C(=O)c1ccccc1)-c1ccccc1)c1ccco1
Cc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1ccc(Cl)cc1)-c1ccccc1
Cc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1ccccc1)-c1ccccc1
CS(=O)(=O)c1ccc(cc1)C(=O)c1sc(NC(=O)c2ccccc2)nc1-c1ccccc1
Cc1ccc(cc1)C(=O)c1sc(NC(=O)c2ccccc2)nc1-c1ccccc1
COc1ccc(cc1)C(=O)c1sc(NC(=O)c2ccccc2)nc1-c1ccccc1
O=C(Nc1nc(c(s1)C(=O)c1ccccc1)-c1ccccc1)c1ccccc1
CS(=O)(=O)c1ccc(cc1)C(=O)c1sc(Nc2ccccc2)nc1-c1ccccc1
Cc1ccc(cc1)C(=O)c1sc(Nc2ccccc2)nc1-c1ccccc1
COc1ccc(cc1)C(=O)c1sc(Nc2ccccc2)nc1-c1ccccc1
O=C(c1sc(Nc2ccccc2)nc1-c1ccccc1)c1ccccc1
CCOC(=O)Nc1nc(c(s1)C(=O)c1ccc(Cl)cc1)-c1ccccc1
CCOC(=O)Nc1nc(c(s1)C(=O)c1ccc(OC)cc1)-c1ccccc1
CCOC(=O)Nc1nc(c(s1)C(=O)c1ccccc1)-c1ccccc1
CNc1nc(c(s1)C(=O)c1ccc(Cl)cc1)-c1ccccc1
CNc1nc(c(s1)C(=O)c1ccc(OC)cc1)-c1ccccc1
CNc1nc(c(s1)C(=O)c1ccccc1)-c1ccccc1
Cn1cc2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(nc2nn(C)cc12)-c1ccccc1
O=C(Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1)c1ccccc1
Clc1cccc(c1)C(=O)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
O=C(Nc1ccccc1)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
COc1ccc(NC(=O)Nc2nc(nc3nn(Cc4ccccc4)cc23)-c2ccccc2)cc1
CNC(=O)CN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12
COc1ccc(N(CC(N)=O)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
COc1ccc(N(CC(O)=O)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
COC(=O)CN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12
COCCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12
COc1ccc(N(CCCO)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
COc1ccc(N(CCO)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
COc1ccc(N(C(F)F)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
COc1ccc(N(CC(F)(F)F)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
COc1ccc(N(C(C)C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
COc1ccc(N(CC(C)C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12
COc1ccc(N(C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
COc1ccc(N(CC(=O)N(C)C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12
CCN(C(C)=O)c1ccc(Cl)c2nc(NC(=O)c3ccc(F)cc3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)S(C)(=O)=O)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)C#N)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)C(=O)OC)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(NS(C)(=O)=O)cc3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(CN(C)S(C)(=O)=O)cc3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(CN4CCCC4=O)cc3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)-n3ccnc3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)-n3cnnn3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)-n3cccn3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)C(=O)N3CCCCC3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)C(=O)N3CCOCC3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)C(=O)N(C)CCOC)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)C(=O)N3CCN(C)CC3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)C(=O)NC)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(cc3)C(=O)N3CCCC3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cc[nH]c3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cn[nH]c3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(C)c3)sc12
CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(F)c4)c3)sc12
CC(C)(C)CC(=O)Nc1c(cc(cc1F)C(=O)Nc2nccs2)F
CCCCC#Cc1nc(N)c2ncn([C@@H]3SC[C@@H](O)[C@H]3O)c2n1 |r|
Nc1nnc(-c2cc(Cl)cc(Cl)c2)c(n1)-c1ccccc1
Cc1cc(cc(C)n1)-c1nnc(N)nc1-c1ccccc1
Cc1cc(cc(C)n1)-c1nnc(N)nc1-c1ccc(F)cc1
Clc1ccc2n(-c3ccccc3)c3nnc(-c4ccco4)c(=O)n3c2c1
Clc1ccc2n(-c3ccccc3)c3nnc(-c4ccccc4)c(=O)n3c2c1
O=c1c(nnc2n(CCc3ccccc3)c3ccccc3n12)-c1ccco1
O=c1c(nnc2n(CCc3ccccc3)c3ccccc3n12)-c1ccccc1
O=c1c(nnc2n(Cc3ccccc3)c3ccccc3n12)-c1ccco1
O=c1c(nnc2n(Cc3ccccc3)c3ccccc3n12)-c1ccccc1
Clc1ccc(cc1)-n1c2ccccc2n2c1nnc(-c1ccccc1)c2=O
O=c1c(nnc2n(-c3ccccc3)c3ccccc3n12)-c1ccco1
O=c1c(nnc2n(-c3ccccc3)c3ccccc3n12)-c1ccccc1
Cn1c2ccccc2n2c1nnc(-c1ccco1)c2=O
Cn1c2ccccc2n2c1nnc(-c1ccccc1)c2=O
O=c1c(nnc2[nH]c3ccccc3n12)-c1ccco1
O=c1c(nnc2[nH]c3ccccc3n12)-c1ccccc1
Clc1ccc(cc1)-n1c2ccccc2n2c1nnc(-c1ccco1)c2=O
Nc1nc(SCCc2ccc(cc2)S(O)(=O)=O)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Nc1nc(SCCc2ccc(cc2)C(O)=O)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCc3ccc(N)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCc3ccc(Br)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCc3ccc(NC(=O)c4cc(cc(c4)C(C)(C)C)C(C)(C)C)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCc3ccc(NC(=O)c4cc(c(O)c(c4)C(C)(C)C)C(C)(C)C)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCc3ccc(NC(=O)CCCC[C@H]4CCSS4)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(F)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(NCCc3ccccc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(NCCc3ccc(N)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(NCCc3ccc(Br)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(NCCc3ccc(NC(=O)c4cc(cc(c4)C(C)(C)C)C(C)(C)C)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(NCCc3ccc(NC(=O)c4cc(c(O)c(c4)C(C)(C)C)C(C)(C)C)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(NCCc3ccc(NC(=O)CCCC[C@H]4CCSS4)cc3)nc12 |r|
CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(F)nc12 |r|
CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(NCCc3ccc(NC(=O)c4cc(c(O)c(c4)C(C)(C)C)C(C)(C)C)cc3)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(F)nc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCc3ccccc3)nc12 |r|
COc1cccc2cc(C(=O)NCCCCCO)c(=N)oc12
COc1cccc2cc(C(=O)NCCc3ccc(O)cc3)c(=N)oc12
COc1cccc2cc(C(=O)NC3CCCCC3)c(=N)oc12
COc1cccc2cc(C(=O)NCCCNC(=O)c3cc4cccc(OC)c4oc3=N)c(=N)oc12
COc1cccc2cc(C(=O)NCCCN3CCN(CCCNC(=O)c4cc5cccc(OC)c5oc4=N)CC3)c(=N)oc12
COc1cccc2cc(C(=O)NCC(O)c3ccccc3)c(=N)oc12
COc1cccc2cc(C(N)=O)c(=N)oc12
COC(=O)C(=C\c1cccc(OC)c1O)\C#N
O=C(Nc1ccccc1)c1coc2ccccc2c1=O
Oc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1
COc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1O
COc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1OC
Oc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1O
COc1cccc(COC(=O)c2nn(nc2N)-c2ccccc2)c1
Clc1cccc2nc(NC(=O)c3ccccc3)[nH]c12
Cn1cc2c(n1)nc(NC(=O)NC1CCNCC1)n1nc(nc21)-c1ccco1
CN1CCC(CC1)NC(=O)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCCN1CCC(CC1)NC(=O)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC=C)CC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC#C)CC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC3CCCCC3)CC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(Cc3ccccc3)CC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(Cc3ccc(F)cc3)CC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(Cc3ccc(Cl)cc3)CC1)n1nc(nc21)-c1ccco1
Cc1ccc(CN2CCC(CC2)NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1
COc1ccc(CN2CCC(CC2)NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(Cc3ccc(cc3)C#N)CC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(Cc3ccc(cc3)[N+]([O-])=O)CC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(Cc3cccnc3)CC1)n1nc(nc21)-c1ccco1
CCOC(=O)CN1CCC(CC1)NC(=O)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCNC(=O)N1CCC(CC1)NC(=O)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CC(C)NC(=O)N1CCC(CC1)NC(=O)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC1)C(=O)NC1CCCC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC1)C(=O)NC1CCCCC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC1)C(=O)NC1CCCCCC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC1)C(=O)NCc1ccccc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC1)C(=O)NCCc1ccccc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC1)C(=O)NCCCc1ccccc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC1)C(=O)NCc1ccc(F)cc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC1)C(=O)NCc1ccc(Cl)cc1)n1nc(nc21)-c1ccco1
Cc1ccc(CNC(=O)N2CCC(CC2)NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1
COc1ccc(CNC(=O)N2CCC(CC2)NC(=O)Nc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(CC1)C(=O)Nc1ccncc1)n1nc(nc21)-c1ccco1
CN1CCN(CC1)C(=O)N1CCC(CC1)NC(=O)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(NC(=O)NC1CCN(Cc3ccncc3)CC1)n1nc(nc21)-c1ccco1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C1C2CC3OC(=O)C1C3C2 |TLB:22:24:26:19.20,21:20:24.17:26,THB:6:17:26:19.20|
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)C1CCCCC1
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)C1CCCCCCC1
Cn1c2nc3N(CCCCn3c2c(=O)n(C)c1=O)C1CCCCCCC1
Cn1c2nc3N(CCC4=CCCCC4)CCCn3c2c(=O)n(C)c1=O |t:8|
CC1CCC(CC1)N1CCCn2c1nc1n(C)c(=O)n(C)c(=O)c21 |(38.63,-4.22,;37.75,-2.96,;36.21,-3.1,;35.33,-1.85,;35.97,-.45,;37.5,-.3,;38.39,-1.56,;35.09,.81,;35.73,2.22,;34.83,3.48,;33.29,3.33,;32.65,1.92,;33.55,.66,;32.65,-.58,;31.19,-.1,;29.86,-.86,;29.86,-2.4,;28.53,-.1,;27.2,-.87,;28.53,1.44,;27.2,2.2,;29.86,2.21,;29.86,3.75,;31.19,1.44,)|
CC(=O)O[C@H]1CC[C@@H](CC1)N1CCCn2c1nc1n(C)c(=O)n(C)c(=O)c21 |r,wU:7.10,wD:4.3,(21.45,-4.6,;20.56,-3.34,;21.2,-1.94,;19.03,-3.48,;18.14,-2.22,;18.78,-.82,;17.89,.44,;16.36,.29,;15.72,-1.11,;16.6,-2.36,;15.47,1.56,;16.11,2.96,;15.21,4.22,;13.67,4.08,;13.03,2.67,;13.93,1.41,;13.03,.17,;11.57,.64,;10.24,-.12,;10.24,-1.66,;8.91,.65,;7.58,-.13,;8.91,2.18,;7.57,2.95,;10.24,2.96,;10.24,4.5,;11.57,2.18,)|
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)C1CCC(O)CC1 |(29.41,-38.04,;29.41,-36.5,;30.74,-35.74,;32.21,-36.22,;33.11,-34.98,;34.64,-34.83,;35.28,-33.42,;34.38,-32.16,;32.84,-32.31,;32.21,-33.72,;30.74,-34.2,;29.41,-33.42,;29.41,-31.89,;28.09,-34.2,;26.75,-33.44,;28.09,-35.74,;26.75,-36.51,;35.53,-36.08,;34.89,-37.48,;35.77,-38.73,;37.3,-38.59,;38.19,-39.85,;37.95,-37.19,;37.06,-35.93,)|
CC(=O)OC1CCC(CC1)N1CCCCn2c1nc1n(C)c(=O)n(C)c(=O)c21 |(3.24,-21.68,;2.66,-20.26,;3.6,-19.04,;1.14,-20.05,;.55,-18.63,;-.97,-18.42,;-1.55,-17,;-.61,-15.78,;.91,-15.98,;1.49,-17.41,;-1.21,-14.36,;-.17,-13.2,;-.43,-11.66,;-1.79,-10.9,;-3.23,-11.5,;-3.66,-13,;-2.77,-14.27,;-3.67,-15.51,;-5.13,-15.04,;-6.46,-15.8,;-6.46,-17.33,;-7.79,-15.03,;-9.12,-15.81,;-7.79,-13.5,;-9.12,-12.73,;-6.46,-12.72,;-6.46,-11.18,;-5.13,-13.5,)|
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)C12CC3CC(CC(C3)C1)C2 |TLB:5:17:20:24.22.23,THB:22:21:18:24.23.25,22:23:20.21.26:18,25:23:20:26.17.18,25:17:20:24.22.23|
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)C1CCCCCC1
Cn1c2nc3N(CCn3c2c(=O)n(C)c1=O)C1CCCCC1
Cn1c2nc3N(CCn3c2c(=O)n(C)c1=O)C1CCC(O)CC1 |(9.82,-12.09,;9.82,-10.55,;11.15,-9.79,;12.61,-10.27,;13.51,-9.02,;14.98,-8.56,;14.99,-7.01,;13.53,-6.53,;12.61,-7.77,;11.15,-8.25,;9.82,-7.47,;9.82,-5.93,;8.49,-8.25,;7.15,-7.48,;8.49,-9.79,;7.16,-10.56,;16.31,-9.32,;16.31,-10.86,;17.63,-11.63,;18.97,-10.87,;20.3,-11.64,;18.97,-9.33,;17.64,-8.55,)|
Cn1c2nc3N(CCn3c2c(=O)n(C)c1=O)C1CCCCCCC1
Cn1c2nc3N(CC4CC4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)C1CCC1
COc1ccccc1CNc1nc(N)c2nc(sc2n1)-c1ccccc1
Nc1nc(NCCc2ccccc2)nc2sc(nc12)-c1ccccc1
COc1cccc(CNc2nc(N)c3nc(sc3n2)-c2cnccn2)c1
COc1ccccc1CNc1nc(N)c2nc(C)sc2n1
Cc1nc2c(N)nc(NCCc3ccccc3)nc2s1
Nc1nc(Nc2ccccc2)nc2sc(nc12)-c1ccccc1
Nc1nc(NCc2ccccc2)nc2sc(nc12)-c1ccccc1
COc1cccc(CNc2nc(N)c3nc(sc3n2)-c2ccccc2)c1
Nc1nc(NCc2cccs2)nc2sc(nc12)-c1ccccc1
COc1ccc(CCNc2nc(N)c3nc(sc3n2)-c2ccccc2)cc1
Nc1nc(NCCc2ccc(O)cc2)nc2sc(nc12)-c1ccccc1
COc1ccccc1CNc1nc(N)c2nc(sc2n1)-c1cnccn1
Nc1nc(NCc2cccs2)nc2sc(nc12)-c1cnccn1
Cc1nc2c(N)nc(Nc3ccccc3)nc2s1
Cc1nc2c(N)nc(NCc3ccccc3)nc2s1
COc1cccc(CNc2nc(N)c3nc(C)sc3n2)c1
Cc1nc2c(N)nc(NCc3cccs3)nc2s1
Cc1nc2c(N)nc(NCCc3cccs3)nc2s1
Nc1nc(nc(n1)-c1ccccc1O)-c1ccccc1
Cn1cc2c(n1)nc(NC(c1ccccc1)c1ccccc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(N1CCOCC1)n1nc(nc21)-c1ccco1
CN1CCN(CC1)c1nc2nn(C)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(N1CCCCC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(N1CCCC1)n1nc(nc21)-c1ccco1
CCN(CCO)c1nc2nn(C)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(N(Cc1ccccc1)Cc1ccccc1)n1nc(nc21)-c1ccco1
CN(Cc1ccccc1)c1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CN(C1CCCCC1)c1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCCCCN(CCCCC)c1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCN(CC)c1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCCCN(C)c1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CN(C)c1nc2nn(C)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(NCCOc1ccccc1)n1nc(nc21)-c1ccco1
COCCNc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CONc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(NCCCCCCO)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NCCCCCO)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NCCCCO)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(CO)CO)n1nc(nc21)-c1ccco1
CCC(CO)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CC(O)CNc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(NCCCO)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NCCO)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NCCc1c[nH]c3ccccc13)n1nc(nc21)-c1ccco1
CC(CCc1ccccc1)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
COc1ccc(CCNc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1OC
Cn1cc2c(n1)nc(NCCc1ccccc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NCc1ccc(cc1)-c1ccccc1)n1nc(nc21)-c1ccco1
COc1ccc(CNc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1OC
Cn1cc2c(n1)nc(NCc1ccc(cc1)C(F)(F)F)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NCc1ccc(F)cc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NCc1ccc(Cl)cc1)n1nc(nc21)-c1ccco1
COc1ccc(CNc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1
Cc1ccc(CNc2nc3nn(C)cc3c3nc(nn23)-c2ccco2)cc1
C[C@@H](Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1)c1ccccc1 |r|
C[C@H](Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1)c1ccccc1 |r|
Cn1cc2c(n1)nc(NCc1ccccc1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC1C3CC4CC(C3)CC1C4)n1nc(nc21)-c1ccco1 |TLB:8:9:11.12.18:15.14.16,8:9:11:15.14.13,THB:13:12:9:15.14.16,13:14:9:11.12.18,16:17:11:15.14.13,16:14:11:9.18.17,(18.41,-21.76,;19.17,-20.43,;20.71,-20.26,;21.02,-18.75,;19.69,-17.99,;18.54,-19.02,;19.69,-16.45,;21.02,-15.67,;21.02,-14.13,;19.69,-13.36,;18.29,-12.8,;16.79,-13.22,;17.98,-11.95,;17.98,-10.46,;19.32,-9.98,;18.28,-11.22,;20.72,-10.56,;20.71,-12.09,;19.31,-12.44,;22.35,-16.45,;23.82,-15.97,;24.72,-17.22,;23.82,-18.47,;22.35,-17.99,;26.25,-17.22,;27.16,-15.97,;28.62,-16.45,;28.62,-17.99,;27.16,-18.46,)|
Cn1cc2c(n1)nc(NC13CC4CC(CC(C4)C1)C3)n1nc(nc21)-c1ccco1 |TLB:8:9:12:16.15.14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9|
Cn1cc2c(n1)nc(NCC1CCCCC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC1CCCCCCC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC1CCCCCC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC1CCCCC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC1CCCC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC1CCC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC1CC1)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)nc(NC(C)(C)C(C)(C)C)n1nc(nc21)-c1ccco1
CCCCC(CC)CNc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCCCCCC(C)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCCCCC(C)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCCCCNc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CC[C@@H](C)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1 |r|
CC[C@H](C)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1 |r|
CC(C)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCNc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CNc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCOc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
COc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
Cn1cc2c(n1)nc(Cl)n1nc(nc21)-c1ccco1
Cn1cc2c(n1)[nH]c(=O)n1nc(nc21)-c1ccco1
C[C@H](Oc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1)C(=O)N1CCN(CC1)c1ccc(C)cc1 |r|
Cc1cc(NC(=O)CNc2ccc3OC(F)(F)Oc3c2)on1
C[C@H](Oc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1)C(=O)Nc1ccc(Br)cc1 |r|
CCCc1cc(O)nc(SC(C)C(=O)Nc2cc(C)no2)n1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(O[C@@H](C)C(=O)N2CCN(CC2)c2nc3ccc(Cl)cc3s2)cc1 |r|
O=C(CN1CCOC(Cn2cncn2)C1)Nc1cccnc1
CC(C)c1noc(OCC(=O)NCc2ccc3OCOc3c2)n1
CC(OC(=O)c1nccnc1N)C(=O)NCc1ccc2OCOc2c1
CC(=O)c1ccc(NC(=O)COc2ccc(cc2)-c2cc3n(C)c(=O)n(C)c(=O)c3[nH]2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1cccc(OCC(=O)Nc2ccccc2)c1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)NC2CCc3ccccc23)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)c2ccc(I)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)c2ccc(cc2)C(=O)OCC)nn1C
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(C)C(=O)Nc2ccc(F)cc2)cc1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2cccc(F)c2)cc1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(OC)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(NC(C)=O)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(O)=O)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)[N+]([O-])=O)cc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(CC(=O)OCC)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NCc2ccccc2)cc1
COc1cc(OCC(O)=O)ccc1-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(=O)NCCc2ccc(OC)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(C)(C)C)cc1
CCOC(=O)COc1ccc(-c2cc3n(C)c(=O)n(C)c(=O)c3[nH]2)c(OC)c1
CC(Oc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1)C(=O)Nc1ccccc1
CCOC(=O)COc1ccc(cc1)-c1cc2n(CCCOC)c(=O)n(C)c(=O)c2[nH]1
COc1cc(ccc1OCC(=O)Nc1ccccc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(CC)C(=O)Nc2ccc(Br)cc2)cc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(OC)nc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)NC2CCCC2)cc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1
CCOC(=O)COc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(O)=O)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(C=O)cc2)cc1
CCn1c2cc([nH]c2c(=O)n(CC)c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(O)cc2)cc1
CC(Oc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1)C(=O)Nc1ccc(Br)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NCc2ccncc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ncccc2O)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(C)C(=O)Nc2ccccc2)cc1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(C)=O)cc1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccccc2Cl)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(CC#N)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)NCc2ccc(Cl)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(CC)C(=O)Nc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)N(CC(=O)Nc1ccc(Br)cc1)C=O
COCCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(O)=O)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(N)=O)cc1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(C)cc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)NCc2ccc(F)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(OC)nc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)[N+](C)(C)C)cc1
COc1cc(ccc1OCC(=O)Nc1ccc(cc1)C#N)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1
CCN(Cc1ccccc1)C(=O)COc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2cc(OC)nc(OC)n2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)c2ccc(F)cc2)n(C)n1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(C)C(=O)Nc2ccc(OC)cc2)cc1
O=C(COc1ccc(cc1)-c1cc2n(CC3CC3)c(=O)n(CC3CC3)c(=O)c2[nH]1)Nc1ccccc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(O)=O)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(CC(=O)OCC)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)-c2ccccc2)cc1
CCCn1c2c(Br)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(O)=O)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)c2ccc(I)cc2)nn1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(C)(C)C(=O)Nc2ccc(F)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(I)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)c2ccc(cc2)C(C)=O)nn1C
COc1cc(ccc1OCC(=O)Nc1ccc(Br)cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1cc(OCC(=O)Nc2ccc(F)cc2)ccc1-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1cc(ccc1OCC(=O)NCc1ccc(Cl)cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2nncs2)cc1
COc1cc(ccc1OCC(O)=O)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(O)=O)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)c2ccc(I)cc2)cn1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2ccc(CCN)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C2=NC(C)(C)CO2)cc1 |t:35|
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(O)=O)cc1
CCOC(=O)COc1ccc(cc1OC)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NCc2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)NCc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(C)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1cccc(OCC(=O)Nc2ccc(Br)cc2)c1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(I)cc2)cc1
CCOC(=O)COc1ccc(cc1)-c1cc2n(CCCOC)c(=O)n(CC)c(=O)c2[nH]1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(Br)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)c2c(NC(O)=O)[nH]c(=O)n(C)c2=O)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)S(N)(=O)=O)cc1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccccc2F)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(C)C(O)=O)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)S(=O)(=O)c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(=O)OCC)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)c2ccc(F)cc2)nn1C
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)c2ccc(Br)cc2)nn1C
COc1cc(ccc1OCC(=O)Nc1ccc(F)cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1cc(OCC(=O)Nc2ccccc2)ccc1-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NCc2ccc(F)cc2)cc1
COc1cccc(CNC(=O)COc2ccc(cc2)-c2cc3n(C)c(=O)n(C)c(=O)c3[nH]2)c1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccccn2)cc1
CCn1c(=O)n(CCCOC)c2cc([nH]c2c1=O)-c1ccc(OCC(O)=O)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(Cl)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1
CCCn1c2c(Cl)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(Cl)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)c2ccc(Br)cc2)n(C)n1
CN(Cc1ccccc1)C(=O)COc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(=O)OCC)cc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)-c2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)NCc2ccco2)cc1
COCCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C#N)cc1
COCCCn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)NC2CCCC2)cc1
CCn1c2cc([nH]c2c(=O)n(CC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C#N)cc1
COc1cc(OCC(=O)NCc2ccc(Cl)cc2)ccc1-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)NCc2ccc(Cl)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(C)(C)C(=O)Nc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(OC)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(C)C(=O)NCc2ccc(Cl)cc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)n2ccc(N)n2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(C)cn2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OC(CC)C(=O)Nc2ccc(F)cc2)cc1
CC(Oc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1)C(=O)Nc1ccc(F)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccccc2O)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(C)=O)cc1
CC(NC(=O)COc1ccc(cc1)-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1)c1ccccc1
CCCn1c2c(Br)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)c2c(NC(O)=O)n(C)c(=O)n(C)c2=O)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(CS(=O)(=O)N3CCCC3)cc2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(CC(O)=O)cc2)cc1
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2nc3ccccc3[nH]2)cc1
CCCn1c2cc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(=O)c2ccccc2)cc1
CCCn1c2c(Br)c([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)c2ccc(C)cc2)nn1C
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NN2CCc3ccccc3C2)cc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccon2)cc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C#N)cc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)N(C)C)cc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2nc3ccccc3[nH]2)cc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(C)=O)cc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(O)cc2)cc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2cccnc2)cc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccccn2)cc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(Br)cc2)cc1
CCSCCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccco1
CCCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc[nH]1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc[nH]1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(cc1)-c1ccccc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1cccs1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccco1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
CCSCCn1c(=O)n(CCCOC)c2nc(Cc3ccco3)[nH]c2c1=O
CCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NC2CCCC2)cc1
CCCn1c(=O)n(CCCOC)c2nc([nH]c2c1=O)-c1ccccc1
CCn1c(=O)n(Cc2ccco2)c2nc(Cc3cccs3)n(C)c2c1=O
CCn1c(=O)n(Cc2ccco2)c2nc(Cc3ccccc3)n(C)c2c1=O
CCn1c(=O)n(Cc2ccco2)c2nc(Cc3ccco3)n(C)c2c1=O
CCCn1c(=O)n(Cc2ccco2)c2nc(Cc3cccs3)n(C)c2c1=O
CCCn1c(=O)n(Cc2ccco2)c2nc(Cc3ccco3)n(C)c2c1=O
Cn1c(Cc2c(F)cccc2F)nc2n(Cc3ccco3)c(=O)n(CC=C)c(=O)c12
Cn1c(Cc2cccs2)nc2n(Cc3ccco3)c(=O)n(CC=C)c(=O)c12
COCCn1c(=O)n(Cc2ccco2)c2nc(Cc3cccs3)n(C)c2c1=O
Cn1c(Cc2ccco2)nc2n(Cc3ccco3)c(=O)n(C)c(=O)c12
Cn1c(Cc2cccs2)nc2n(Cc3ccco3)c(=O)n(CC3CC3)c(=O)c12
COCCn1c(=O)n(Cc2ccco2)c2nc(Cc3c(F)cccc3F)n(C)c2c1=O
CCCn1c(=O)n(Cc2ccco2)c2nc(Cc3ccccc3)n(C)c2c1=O
Cn1c(Cc2c(F)cccc2F)nc2n(Cc3ccco3)c(=O)n(CC3CC3)c(=O)c12
CCSCCn1c(=O)n(Cc2ccco2)c2nc(Cc3cccs3)n(C)c2c1=O
CCCn1c(=O)n(Cc2ccco2)c2nc(Cc3ccccc3)[nH]c2c1=O
CCn1c(=O)n(Cc2ccco2)c2nc(Cc3cccs3)[nH]c2c1=O
CCn1c(=O)n(Cc2ccco2)c2nc(Cc3ccccc3)[nH]c2c1=O
CSCCn1c(=O)n(Cc2ccco2)c2nc(Cc3c(F)cccc3F)[nH]c2c1=O
CCSCCn1c(=O)n(Cc2ccco2)c2nc(Cc3cccs3)[nH]c2c1=O
Cn1c(=O)n(Cc2ccco2)c2nc(Cc3ccco3)[nH]c2c1=O
CCSCCn1c(=O)n(Cc2ccco2)c2nc(Cc3ccco3)[nH]c2c1=O
COCCn1c(=O)n(Cc2ccco2)c2nc(Cc3ccccc3)n(C)c2c1=O
CSCCn1c(=O)n(Cc2ccco2)c2nc(Cc3cccs3)[nH]c2c1=O
CCn1c(=O)n(Cc2ccco2)c2nc(Cc3ccco3)[nH]c2c1=O
O=c1n(Cc2ccco2)c2nc(Cc3cccs3)[nH]c2c(=O)n1CC#C
C=CCn1c(=O)n(Cc2ccco2)c2nc(Cc3cccs3)[nH]c2c1=O
CCSCCn1c(=O)n(Cc2ccco2)c2nc(Cc3ccccc3)[nH]c2c1=O
Fc1cccc(F)c1Cc1nc2n(Cc3ccco3)c(=O)n(CC#C)c(=O)c2[nH]1
CCCn1c(=O)n(CCS(=O)CC)c2nc([nH]c2c1=O)-c1ccccc1
CCn1c(=O)n(Cc2cccs2)c2nc(Cc3c(F)cccc3F)n(C)c2c1=O
CCn1c(=O)n(Cc2cccs2)c2nc(Cc3ccco3)n(C)c2c1=O
CCn1c(=O)n(Cc2cccs2)c2nc(Cc3cccs3)n(C)c2c1=O
CCn1c(=O)n(Cc2ccccc2)c2nc(Cc3ccco3)n(C)c2c1=O
CCn1c(=O)n(Cc2ccccc2)c2nc(Cc3cccs3)n(C)c2c1=O
CCn1c(=O)n(Cc2cccs2)c2nc(Cc3cccs3)[nH]c2c1=O
CCSCCn1c2nc([nH]c2c(=O)n(CC)c1=O)-c1ccccc1
CCCn1c(=O)n(CCSCC)c2nc([nH]c2c1=O)-c1ccccc1
NC(=O)c1nc(-c2ccccc2O)n2CN(C(=N)c12)c1ccc(O)cc1
CCCn1c2cc([nH]c2c(=O)[nH]c1=O)-c1ccc(OCC(=O)Nc2ccc(Br)cc2)cc1
CCCn1c2cc([nH]c2c(=O)[nH]c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1
CCCn1c2cc([nH]c2c(=O)[nH]c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)[nH]c1=O)-c1ccc(OCC(=O)N2CCN(CC2)c2ccccc2)cc1
CCCn1c2cc([nH]c2c(=O)[nH]c1=O)-c1ccc(OCC(=O)N2CCc3ccccc3C2)cc1
CCCn1c(=O)[nH]c2cc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1
CCCn1c(=O)[nH]c2cc([nH]c2c1=O)-c1ccc(OCC(=O)Nc2ccc(Br)cc2)cc1
CCCn1c(=O)[nH]c2cc([nH]c2c1=O)-c1ccc(OCc2nc(no2)-c2ccc(Br)cc2)cc1
COc1cc(OCc2nc(no2)-c2ccc(Br)cc2)ccc1-c1cc2n(C)c(=O)n(C)c(=O)c2[nH]1
CCCn1c(=O)n(C)c2cc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)n(C)c2c1=O
CCCn1c2cc(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)n(C)c2c(=O)n(CCC)c1=O
Nc1nc2ccccc2c2cc(nn12)-c1ccco1
COc1cccc(-c2cc(NC(C)=O)nc(n2)-c2cccc(OC)c2OC)c1OC
COc1cccc(c1)-c1cc(NC(C)=O)nc(n1)-c1cccc(OC)c1
CN(NC(CO)C(=O)[C@@H](O)[C@@H](O)CO)c1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|
CN(NCC(=O)[C@@H](O)[C@@H](O)CO)c1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|
CN(NCC(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)c1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|
CN(NCC(=O)[C@@H](O)[C@@H](O)[C@H](O)CO)c1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|
Nc1nc(NNC(CO)C(=O)[C@@H](O)[C@@H](O)CO)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Nc1nc(NNCC(=O)[C@@H](O)[C@@H](O)CO)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Nc1nc(NNCC(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Nc1nc(NNCC(=O)[C@H](O)[C@H](O)[C@@H](O)CO)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
COC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3ccc(OCC4CC4)cc3)c2C#N)c1
Nc1nc(SCc2cnc[nH]2)c(C#N)c(-c2ccc(OCC3CC3)cc2)c1C#N
CCOc1ccc(cc1)-c1c(C#N)c(N)nc(SCC(N)=O)c1C#N
Nc1nc(SCC(=O)NCO)c(C#N)c(-c2ccc(OCC3CC3)cc2)c1C#N
NC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3ccc(OCC4CC4)cc3)c2C#N)c1
Nc1nc(SCc2ccn[nH]2)c(C#N)c(-c2ccc(OCC3CC3)cc2)c1C#N
Nc1nc(SCc2ncn[nH]2)c(C#N)c(-c2ccc(OCC3CC3)cc2)c1C#N
CCOc1ccc(cc1)-c1c(C#N)c(N)nc(SCc2ncc[nH]2)c1C#N
NC(=O)CSc1nc(N)c(C#N)c(-c2ccc(OCC3CC3)cc2)c1C#N
CCOc1ccc(cc1)-c1c(C#N)c(N)nc(SCC(=O)NC)c1C#N
CNC(=O)CSc1nc(N)c(C#N)c(-c2ccc(OCC3CC3)cc2)c1C#N
CC(=O)Nc1ccc(cc1)-c1c(C#N)c(N)nc(SCC(N)=O)c1C#N
Nc1nc(SCc2ncc[nH]2)c(C#N)c(-c2ccc(OCC3CC3)cc2)c1C#N
CCOc1ccc(cc1)-c1c(C#N)c(N)nc(SCc2ccn[nH]2)c1C#N
Cn1c(nc2c(NC3CCCC3)ncnc12)-c1ccc(Cl)cc1
Cn1c(nc2c(NC3CCCCC3)ncnc12)-c1ccccc1
CCn1c(nc2c(N)ncnc12)-c1ccccc1
Cn1c(nc2c(NC3CCCC3)ncnc12)-c1cccc(Cl)c1
Cc1cccc(c1)-c1nc2c(NC3CCCC3)ncnc2n1C
CCCn1c(nc2c(NC3CCOC3)ncnc12)-c1ccccc1
Cn1c(nc2c(NC3CCCC3)ncnc12)-c1ccccc1
Cn1c(nc2c(N)ncnc12)-c1ccccc1
COc1ccc(cc1)-c1nc2c(NC3CCCC3)ncnc2n1C
CCn1c(nc2c(NC3CCOC3)ncnc12)-c1ccccc1
Cn1c(nc2c(NC3CCCC3)ncnc12)-c1ccc(O)cc1
Cn1c(nc2c(NC3CCCC3)ncnc12)-c1ccc(F)cc1
Cn1c(nc2c(NC3CCCC3)ncnc12)-c1ccccc1Cl
Cc1ccc(cc1)-c1nc2c(NC3CCCC3)ncnc2n1C
Cn1c(nc2c(NC3CCCC3)ncnc12)-c1cccnc1
CCCn1c(nc2c(NC3CCCCC3)ncnc12)-c1ccccc1
CCn1c(nc2c(NC3CCCCC3)ncnc12)-c1ccccc1
Cn1c(nc2c(NC3CCOC3)ncnc12)-c1ccccc1
CCn1c(nc2c(NC3CCCC3)ncnc12)-c1ccccc1
CCCn1c(nc2c(NC3CCC3)ncnc12)-c1ccccc1
Cn1c(nc2c(NC3CCC3)ncnc12)-c1ccccc1
CCCn1c(nc2c(N)ncnc12)-c1ccccc1
CCn1c(nc2c(NC3CCC3)ncnc12)-c1ccccc1
Cc1ccccc1-c1nc2c(NC3CCCC3)ncnc2n1C
CCCn1c(nc2c(NC3CCCC3)ncnc12)-c1ccccc1
Cn1c(nc2c(NC3CCCC3)ncnc12)-c1ccc(cc1)C(O)=O
COc1ccccc1CNc1nc(N)c2nc(sc2n1)-c1ccc(C)o1
COc1cccc(CNc2nc(N)c3nc(sc3n2)-c2cccs2)c1
Nc1nc(NCc2cccs2)nc2sc(nc12)-c1ccco1
Nc1nc(NCc2ccco2)nc2sc(nc12)-c1ccco1
Nc1nc(NCc2cccnc2)nc2sc(nc12)-c1ccco1
Nc1nc(NCc2ccsc2)nc2sc(nc12)-c1ccco1
Nc1nc(NCc2ccccn2)nc2sc(nc12)-c1ccco1
Nc1nc(NCc2ccncc2)nc2sc(nc12)-c1ccco1
Nc1nc(NCc2cnccn2)nc2sc(nc12)-c1ccco1
Nc1nc(NCCc2cccs2)nc2sc(nc12)-c1ccco1
Nc1nc(NCCc2ccco2)nc2sc(nc12)-c1ccco1
Nc1nc(NCCc2cccnc2)nc2sc(nc12)-c1ccco1
COc1cccc(CNc2nc(N)c3nc(sc3n2)-c2ccc(C)o2)c1
Cc1ccc(o1)-c1nc2c(N)nc(NCc3cccs3)nc2s1
COc1ccccc1CNc1nc(N)c2nc(sc2n1)-c1cccs1
Nc1nc(NCc2cccs2)nc2sc(nc12)-c1cccs1
CCCN1C(=O)N=C2N=C(N=C2C1=O)c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 |c:8,10,t:6|
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCCCCC2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c23)cc1 |c:29,32,35|
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCCCc2ccccc2)cc1
CCCN1C(=O)N=C2N=C(N=C2C1=O)c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccccc2)CC1 |c:8,10,t:6|
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCCC2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c23)cc1 |c:27,30,33|
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCc2ccccc2)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCCCCCCCCCCC2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c23)cc1 |c:35,38,41|
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCCCCCC2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c23)cc1 |c:30,33,36|
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCCc2ccccc2)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCCCC2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c23)cc1 |c:28,31,34|
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OCC(=O)NCCCCc2ccccc2)cc1
COCCOc1ccc(cc1F)N1CCN(CCn2c3nc(N)n4nc(nc4c3n(C)c2=O)-c2nccs2)CC1
CNc1ncc(C(=O)NCCc2ccccc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2ccc(F)cc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OC(c2ccccc2)c2ccccc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NCc2ccc(F)cc2)c2nc(nn12)-c1ccco1
CCc1ccc(COC(=O)c2cnc(NC)n3nc(nc23)-c2ccco2)cc1
CC(C)(C)OC(=O)NCCNc1ncc(C(O)=O)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NCCOc2ccccc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NC(C)(C)Cc2ccccc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NCc2ccc(OC)c(OC)c2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NCc2ccc(cc2)-c2ccccc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NCc2ccc(Cl)cc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NCc2ccc(OC)cc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NCc2ccc(C)cc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NCc2ccccc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OC(C)c2ccccc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2cccc(F)c2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2ccc(Cl)cc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2cccc(Cl)c2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2ccc(OC)cc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2ccc(C)cc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2cccc(C)c2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2ccccc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OC(C)C)c2nc(nn12)-c1ccco1
CCOC(=O)c1cnc(NCCNC(=O)OC(C)(C)C)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NNc2ccccc2)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NNC(=O)OC(C)(C)C)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NCCN)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(NN)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(OCC)n2nc(nc12)-c1ccco1
CNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2nc(nc3NCc4cccc(c4)I)Cl)O)O
CNc1ncc(C(=O)OCc2ccccc2OC)c2nc(nn12)-c1ccco1
CCOC(=O)c1cnc(N2CCN(CC2)C(=O)OC(C)(C)C)n2nc(nc12)-c1ccco1
COc1ccc(CNc2ncc(C(=O)NC(c3ccccc3)c3ccccc3)c3nc(nn23)-c2ccco2)cc1OC
CNc1ncc(C(=O)OCc2cccc(OC)c2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NNc2ccccc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NCCc2ccc(OC)c(OC)c2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NCc2ccc(cc2)C(F)(F)F)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)NC(c2ccccc2)c2ccccc2)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2ccccc2Br)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2ccccc2Cl)c2nc(nn12)-c1ccco1
CNc1ncc(C(=O)OCc2ccccc2C)c2nc(nn12)-c1ccco1
CCOC(=O)CNC(=O)c1cnc(NCC(=O)OCC)n2nc(nc12)-c1ccco1
CCOC(=O)c1cnc(N2CCNCC2)n2nc(nc12)-c1ccco1
Nc1nc2ccccc2n2nc(nc12)-c1ccco1
O=C(CCc1ccccc1)Nc1nc2ccccc2n2nc(nc12)-c1ccco1
O=C(Cc1ccccc1)Nc1nc2ccccc2n2nc(nc12)-c1ccco1
CC(O)CNc1nc2ccccc2n2nc(nc12)-c1ccco1
C(Nc1nc2ccccc2n2nc(nc12)-c1ccco1)c1ccco1
CC(=O)Nc1nc2ccccc2n2nc(nc12)-c1ccco1
COCCCNc1nc2ccccc2n2nc(nc12)-c1ccco1
OCCNc1nc2ccccc2n2nc(nc12)-c1ccco1
C(Oc1nc2ccccc2n2nc(nc12)-c1ccco1)c1ccoc1
O=C(Nc1nc2ccccc2n2nc(nc12)-c1ccco1)c1ccco1
CCN(CC)c1nc2ccccc2n2nc(nc12)-c1ccco1
O[C@@H]1[C@@H](CF)O[C@H]([C@@H]1O)n1cnc2c(NC3CCOCC3)ncnc12 |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@H]3CCC[C@@H]3O)ncnc12 |r|
Brc1ccc2nc(NC(=O)CCCc3ccccc3)sc(=O)c2c1
Clc1ccc2nc(NC(=O)CCCc3ccccc3)sc(=O)c2c1
Clc1ccc(CN2CCN(CC2)C(=O)c2ccc(cc2)C(=O)Nc2nc3ccccc3c(=O)s2)cc1
Clc1cccc(CN2CCN(CC2)C(=O)c2ccc(cc2)C(=O)Nc2nc3ccccc3c(=O)s2)c1
Clc1ccc(\C=C\CC(=O)Nc2nc3ccccc3c(=O)s2)cc1Cl
O=C(C\C=C\c1ccccc1)Nc1nc2ccccc2c(=O)s1
Clc1ccc(CCCC(=O)Nc2nc3ccccc3c(=O)s2)cc1Cl
O=C(CCCc1ccccc1)Nc1nc2ccccc2c(=O)s1
COc1cccc(\C=C\C(=O)Nc2nc3ccccc3c(=O)s2)c1
Clc1cccc(OCC(=O)Nc2nc3ccccc3c(=O)s2)c1
Clc1ccc(CCC(=O)Nc2nc3ccccc3c(=O)s2)cc1Cl
O=C(CCc1ccccc1)Nc1nc2ccccc2c(=O)s1
Cc1sc2nc(NC(=O)CCCc3ccccc3)sc(=O)c2c1C
Clc1cccc(\C=C\C(=O)Nc2nc3ccccc3c(=O)s2)c1
COc1cccc(CCC(=O)Nc2nc3ccccc3c(=O)s2)c1
Clc1cccc(\C=C\CC(=O)Nc2nc3ccccc3c(=O)s2)c1
Brc1ccccc1CCC(=O)Nc1nc2ccccc2c(=O)s1
O=C(CCCc1ccccc1)Nc1nc2sccc2c(=O)s1
Cc1ccc2nc(NC(=O)CCCc3ccccc3)sc(=O)c2c1
Clc1ccccc1CN1CCN(CC1)C(=O)c1ccc(cc1)C(=O)Nc1nc2ccccc2c(=O)s1
COc1cccc(c1)C#CC(=O)Nc1nc2ccccc2c(=O)s1
Cn1c(\C=C\c2cccc(Cl)c2)nc2n(C)c(=O)n(C)c(=O)c12
CN(C(=O)CCCc1ccccc1)c1nc2ccccc2c(=O)s1
O=C(CCCc1ccccc1)Nc1nc2ccsc2c(=O)s1
Clc1ccc2c(c1)nc(NC(=O)CCCc1ccccc1)sc2=O
COc1cccc(CCCC(=O)Nc2nc3ccccc3c(=O)s2)c1
Fc1ccccc1CCC(=O)Nc1nc2ccccc2c(=O)s1
Cc1sc2nc(nc(N)c2c1C)-c1sc(NC(=O)c2ccco2)nc1-c1ccccc1
O=C(Nc1nc(c(s1)C(=O)c1cccnc1)-c1ccccc1)c1ccco1
Nc1nc(nc2sc3CCCCc3c12)-c1sc(NC(=O)c2ccccc2)nc1-c1ccccc1
Cc1sc2nc(nc(N)c2c1C)-c1sc(NC(=O)c2ccccc2)nc1-c1ccccc1
Cc1sc2nc(nc(N)c2c1C)-c1sc(NC(=O)c2ccc(C)cc2)nc1-c1ccccc1
CN(C)c1nc(N)nc(n1)-c1sc(NC(=O)c2ccccc2)nc1-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1ccccn1)-c1ccccc1
Cc1sc2nc([nH]c(=O)c2c1C)-c1sc(NC(=O)c2ccco2)nc1-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1cccnc1)-c1ccccc1
CN(C)c1nc(N)nc(n1)-c1sc(NC(=O)c2ccco2)nc1-c1ccccc1
Nc1nc(nc2sc3CCCCc3c12)-c1sc(NC(=O)c2ccco2)nc1-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1nc(N)nc(n1)N(C)C)-c1ccccc1
O=C(Nc1nc(c(s1)-c1ccncc1)-c1ccccc1)c1ccco1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)-c1nc(N)c2c3CCCCc3sc2n1)-c1ccccc1
O=C(Nc1nc(c(s1)-c1nc2ccccc2c(=O)[nH]1)-c1ccccc1)c1ccco1
Cc1ccc(cc1)C(=O)Nc1nc(c(s1)-c1nc(N)c2c3CCCCc3sc2n1)-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)-c1nc(N)c2c(C)c(C)sc2n1)-c1ccccc1
O=C(Nc1nc(c(s1)-c1ccccn1)-c1ccccc1)c1ccco1
O=C(Nc1nc(c(s1)C(=O)c1ccccn1)-c1ccccc1)c1ccco1
CN(C)c1nc(N)nc(n1)-c1sc(NC(=O)c2ccc(C)cc2)nc1-c1ccccc1
CCCn1c(nc2c(N)ncnc12)-c1ccco1
Cc1ccc(NC(=O)Nc2ncnc3n(C)c(nc23)-c2ccco2)cc1
Cn1c(nc2c(NC(=O)Cc3ccc(OCc4ccccc4)cc3)ncnc12)-c1ccco1
Cn1c(nc2c(NC(=O)C(c3ccccc3)c3ccccc3)ncnc12)-c1ccco1
Cn1c(nc2c(NC(=O)c3ccc(cc3)-c3ccccc3)ncnc12)-c1ccco1
Cn1c(nc2c(N)ncnc12)-c1ccco1
Cn1c(nc2c(NC(=O)Nc3ccccc3)ncnc12)-c1ccco1
Cn1c(nc2c(NC(=O)Cc3ccccc3)ncnc12)-c1ccco1
CCn1c(nc2c(N)ncnc12)-c1ccco1
Cc1ccc(COc2ccc(CC(=O)Nc3ncnc4n(C)c(nc34)-c3ccco3)cc2)cc1
Nc1ncnc2n(CCCO)c(nc12)-c1ccco1
Nc1ncnc2n(CCO)c(nc12)-c1ccco1
CC(C)OC(=O)C1=C(C)NC(=S)NC1c1ccsc1 |c:6|
CC(C)OC(=O)C1=C(C)N(C)C(=O)NC1c1ccsc1 |c:6|
CCOC(=O)C1=C(C)NC(=S)NC1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)N(C)C(=O)NC1c1ccco1 |c:6|
CCOC(=O)C1=C(CC)NC(=O)NC1c1ccco1 |c:5|
CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccco1 |c:5|
CCCC1=C(C(NC(=O)N1)c1ccco1)C(=O)OCC |t:3|
CCOC(=O)c1c(C)[nH]c(=O)nc1-c1ccco1
CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccsc1 |c:5|
CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)NC(=S)NC1c1ccoc1 |c:6|
CC(C)OC(=O)C1=C(C)N=C(S)NC1c1cccs1 |c:6,t:9|
CCOC(=O)C1=C(C)N=C(S)NC1c1cccs1 |c:5,t:8|
CC(C)OC(=O)C1=C(C)NC(=S)NC1c1ccco1 |c:6|
CCOC(=O)C1=C(C)N=C(S)NC1c1ccco1 |c:5,t:8|
CCCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 |c:6|
CCOC(=O)C1=C(C)NC(=O)N(C1c1ccco1)C(C)=O |c:5|
COC(=O)C1=C(C)NC(=O)NC1c1ccco1 |c:4|
CCOC(=O)C1=C(C)N=C(S)NC1c1ccsc1 |c:5,t:8|
CCCn1c2nc3N(CC(=O)N4CCN(CC4)c4ccccc4)CCCn3c2c(=O)n(CCC)c1=O
Cn1c2nc3N(CCc4ccccc4)CCCn3c2c(=O)n(CC#C)c1=O
Cn1c2nc3N(Cc4ccccc4)CCCn3c2c(=O)n(CC#C)c1=O
Cn1c2nc3N(CC(=O)N4CCN(CC4)c4ccccc4)CCCn3c2c(=O)n(C)c1=O
CCCn1c2nc3N(CCC(=O)N4CCN(CC4)c4ccccc4)CCCn3c2c(=O)n(CCC)c1=O
CCCn1c2nc3N(CC(=O)N4CCN(Cc5ccccc5)CC4)CCCn3c2c(=O)n(CCC)c1=O
[H][C@@]12C[C@@]3([H])C[C@]([H])(C[C@]3(C1)c1nc3n(C)c(=O)n(C)c(=O)c3[nH]1)C2 |r,wD:9.12,6.6,3.3,1.0,TLB:5:6:10:2.3,THB:5:3:10:24.6.8,(14.09,-14.42,;12.36,-15.15,;12.34,-13.62,;10.87,-13.16,;12.72,-13.48,;13.43,-13.25,;13.03,-14.75,;14.92,-14.74,;11.3,-15.18,;9.98,-14.41,;10.9,-15.65,;8.44,-14.44,;7.53,-15.7,;6.07,-15.24,;4.75,-16.03,;4.75,-17.57,;3.4,-15.27,;2.07,-16.06,;3.39,-13.73,;2.04,-12.98,;4.71,-12.95,;4.68,-11.41,;6.05,-13.7,;7.5,-13.21,;13.44,-16.24,)|
CCn1c2nc3N(CCc4ccccc4OC)CCCn3c2c(=O)n(CC)c1=O
Cn1c2nc3N(Cc4cc(Cl)cc(Cl)c4)CCCn3c2c(=O)n(C)c1=O
CCn1c2nc3N(CCc4ccc(OC)c(OC)c4)CCCn3c2c(=O)n(CC)c1=O
Cn1c2nc3N(CCCn3c2c(=O)n(CC#C)c1=O)C1CCCCC1
COc1ccccc1CN1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21
Cn1c2nc3N(CC(=O)N4CCN(Cc5ccc(Cl)cc5)CC4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CC(=O)N4CCN(Cc5ccccc5)CC4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CC(=O)N4CCN(CC4)c4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4cccc(Cl)c4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)c1cc(Cl)cc(Cl)c1
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)c1ccc(Cl)cc1
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)c1cccc(Cl)c1
CCn1c2nc3N(CCCn3c2c(=O)n(CC)c1=O)C1CCCCC1
CCn1c2nc3N(CCc4ccc(OC)cc4)CCCn3c2c(=O)n(CC)c1=O
CCn1c2nc3N(CCc4cccc(OC)c4)CCCn3c2c(=O)n(CC)c1=O
Cn1c2nc3N(CC4CCCCC4)CCCn3c2c(=O)n(CC#C)c1=O
Cn1c2nc3N(CCCn3c2c(=O)n(CC#C)c1=O)C1CCC1
Cn1c2nc3N(CCc4cccs4)CCCn3c2c(=O)n(CC#C)c1=O
COc1ccc(CCN2CCCn3c2nc2n(C)c(=O)n(CC#C)c(=O)c32)cc1
Cn1c2nc3N(CCc4ccc(O)cc4)CCCn3c2c(=O)n(CC#C)c1=O
Cn1c2nc3N(Cc4cccnc4)CCCn3c2c(=O)n(CC#C)c1=O
COc1ccc(CN2CCCn3c2nc2n(C)c(=O)n(CC#C)c(=O)c32)cc1
CC(C)c1ccc(cc1)N1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21
Cn1c2nc3N(CCCn3c2c(=O)n(CC#C)c1=O)c1cccc(Br)c1
Cn1c2nc3N(CCCn3c2c(=O)n(CC#C)c1=O)c1ccc(F)cc1
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)c1ccc(F)cc1
CCCn1c2nc3N(CCC(=O)N4CCN(Cc5ccc(Cl)cc5)CC4)CCCn3c2c(=O)n(CCC)c1=O
CCCn1c2nc3N(CC(=O)N4CCN(Cc5ccc(OC)cc5)CC4)CCCn3c2c(=O)n(CCC)c1=O
CCCn1c2nc3N(CC(=O)N4CCN(Cc5ccc(cc5)C(F)(F)F)CC4)CCCn3c2c(=O)n(CCC)c1=O
CCCn1c2nc3N(CC(=O)N4CCN(CC4)c4ccc(Cl)cc4)CCCn3c2c(=O)n(CCC)c1=O
COc1ccc(CN2CCN(CC2)C(=O)CN2CCCn3c2nc2n(C)c(=O)n(C)c(=O)c32)cc1
Cn1c2nc3N(CC(=O)N4CCN(Cc5ccc(cc5)C(F)(F)F)CC4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCc4ccc(Cl)c(Cl)c4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(Cl)c(Cl)c4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)c1ccc(Cl)c(Cl)c1
CCn1c2nc3N(CCc4cc(OC)c(OC)c(OC)c4)CCCn3c2c(=O)n(CC)c1=O
CCn1c2nc3N(CCCn3c2c(=O)n(CC)c1=O)c1cccc(OC)c1
Cn1c2nc3N(CCCn3c2c(=O)n(CC#C)c1=O)C1CCN(Cc2ccccc2)CC1
COc1cc(CCN2CCCn3c2nc2n(C)c(=O)n(CC#C)c(=O)c32)cc(OC)c1OC
Cn1c2nc3N(Cc4cccs4)CCCn3c2c(=O)n(CC#C)c1=O
COc1cccc(CN2CCCn3c2nc2n(C)c(=O)n(CC#C)c(=O)c32)c1
COc1cccc(c1)N1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21
CCn1c2nc3N(CCCn3c2c(=O)n(CC)c1=O)c1ccc(F)cc1
CCn1c2nc3N(CCN4CCCCC4)CCCn3c2c(=O)n(CC)c1=O
Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CC4CCCO4)CCCn3c2c(=O)n(CC#C)c1=O
Cn1c2nc3N(CCc4cccc(Cl)c4)CCCn3c2c(=O)n(C)c1=O
COc1cc(OC)cc(c1)N1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21
FC(F)(F)c1ccc(cc1)C(=O)Nc1nc(Cl)c2cn(CCc3ccccc3)nc2n1
Cn1cc2c(Cl)nc(NC(=O)c3ccccc3)nc2n1
CC(C)(C)Cn1cc2c(Cl)nc(NC(=O)c3ccc(F)cc3)nc2n1
CC(C)n1cc2c(Cl)nc(N)nc2n1
CCOC(=O)c1nc(NC(=O)c2ccc(C)cc2)nc2nn(CC(C)(C)C)cc12
Clc1nc(NC(=O)Cc2ccccc2)nc2nn(CCc3ccccc3)cc12
Cn1cc2c(Cl)nc(NC(=O)Cc3ccccc3)nc2n1
Clc1nc(nc2nn(CCc3ccccc3)cc12)N(C(=O)c1ccccc1)C(=O)c1ccccc1
Cc1ccc(cc1)C(=O)Nc1nc(Cl)c2cn(CCc3ccccc3)nc2n1
Fc1ccc(cc1)C(=O)Nc1nc(Cl)c2cn(CCc3ccccc3)nc2n1
CC(C)(C)Cn1cc2c(Cl)nc(NC(=O)c3ccc(cc3)C(F)(F)F)nc2n1
CC(C)n1cc2c(Cl)nc(NC(=O)c3ccc(cc3)C(F)(F)F)nc2n1
CC(C)n1cc2c(Cl)nc(NC(=O)c3ccccc3)nc2n1
Cc1ccc(cc1)C(=O)Nc1nc(Cl)c2cn(C)nc2n1
Nc1nc(Cl)c2cn(CCc3ccccc3)nc2n1
CC(C)n1cc2c(Cl)nc(NC(=O)Cc3ccccc3)nc2n1
Cc1ccc(cc1)C(=O)Nc1nc(Cl)c2cn(CC(C)(C)C)nc2n1
CC(C)n1cc2c(Cl)nc(NC(=O)c3ccc(C)cc3)nc2n1
Cn1cc2c(Cl)nc(NC(=O)c3ccc(F)cc3)nc2n1
CCOC(=O)c1nc(NC(=O)c2ccc(cc2)C(F)(F)F)nc2nn(CC(C)(C)C)cc12
CC(C)(C)Cn1cc2c(Cl)nc(nc2n1)N(C(=O)c1ccccc1)C(=O)c1ccccc1
Clc1nc(NC(=O)c2ccccc2)nc2nn(CCc3ccccc3)cc12
CC(C)n1cc2c(Cl)nc(NC(=O)c3ccc(F)cc3)nc2n1
CC(C)(C)Cn1cc2c(Cl)nc(N)nc2n1
Cn1cc2c(Cl)nc(NC(=O)c3ccc(cc3)C(F)(F)F)nc2n1
Cn1cc2c(Cl)nc(nc2n1)N(C(=O)c1ccccc1)C(=O)c1ccccc1
Cn1cc2c(Cl)nc(N)nc2n1
CC(C)n1cc2c(Cl)nc(nc2n1)N(C(=O)c1ccccc1)C(=O)c1ccccc1
CC(C)(C)Cn1cc2c(Cl)nc(NC(=O)Cc3ccccc3)nc2n1
Cn1c2nc(Cc3ccc(OCCCn4ccnc4)cc3)[nH]c2c(=O)n(C)c1=O
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCCN2CCCC2)cc1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCCCCl)cc1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCCC2CCNCC2)cc1
Cn1c2nc(Cc3ccc(OCCCN4CCC5(CC4)OCCO5)cc3)[nH]c2c(=O)n(C)c1=O
CN(C)CCOc1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCCCn2ccnc2)cc1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OC2CCCC2)cc1
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCCCN2CCN(Cc3ccccc3Cl)CC2)cc1
Cn1c2nc(Cc3ccc(OCCCCl)cc3)[nH]c2c(=O)n(C)c1=O
Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCCN2CCOCC2)cc1
Cn1c2nc(Cc3ccc(OCCCN4CCOCC4)cc3)[nH]c2c(=O)n(C)c1=O
CCN(CC)CCOc1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
COc1ccc(cc1OC)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
CC(C)(C)c1cc(ccc1O)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
NCCC(=O)Nc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)C=C)cc1
CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)NCCC(=O)Nc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Nc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
COc1ccc(c(OC)c1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
COc1c(C)cc(cc1C)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
COc1c(cc(cc1C(C)(C)C)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1)C(C)(C)C
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1cc(O)c(O)c(O)c1
Cc1cc(cc(C)c1O)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCC#N)cc1
NCCOc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)NCCOc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCCNC(=O)CCCCC2CCSS2)cc1
COc1cc(cc(OC)c1OC)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCNC(=O)CCCCC2CCSS2)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCCCC2CCSS2)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc2OCOc2c1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(O)c(O)c1
NC(=O)COc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
COc1cc(O)ccc1-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Cc1nc(NC(=O)c2ccccc2)c2nc(sc2n1)-c1ccccc1
Nc1nc(nc2sc(nc12)-c1ccccc1)-c1cccc(O)c1
Cc1ccc(o1)-c1nc(N)c2nc(sc2n1)-c1ccccc1
Nc1nc(nc2sc(nc12)-c1ccccc1)-c1ccco1
Nc1nc(nc2sc(nc12)-c1ccccc1)-c1cccc(c1)C#N
COc1ccc(cc1)-c1nc(N)c2nc(sc2n1)-c1ccccc1
Nc1nc(nc2sc(nc12)-c1ccccc1)-c1ccc(CO)cc1
Nc1nc(nc2sc(nc12)-c1ccccc1)-c1cccc(CO)c1
Nc1nc(nc2sc(nc12)-c1ccco1)-c1ccc(CO)cc1
COc1cccc(c1)-c1nc(N)c2nc(sc2n1)-c1ccco1
Nc1nc(nc2sc(nc12)-c1ccco1)-c1cccc(c1)C#N
Nc1nc(nc2sc(nc12)-c1ccco1)-c1ccco1
Cc1ccc(o1)-c1nc(N)c2nc(sc2n1)-c1ccco1
Cc1nc(NC(=O)c2ccc(Cl)cc2)c2nc(sc2n1)-c1ccccc1
O=C(Nc1nc(nc2sc(nc12)-c1ccccc1)-c1ccccc1)c1ccco1
O=C(Nc1nc(nc2sc(nc12)-c1ccco1)-c1ccccc1)c1ccco1
Cc1nc(N)c2nc(sc2n1)-c1ccccc1
COc1ccc(cc1)-c1nc(N)c2nc(sc2n1)-c1ccco1
COc1ccc(cc1)C(=O)Nc1nc(C)nc2sc(nc12)-c1ccccc1
Nc1nc(nc2sc(nc12)-c1ccccc1)-c1ccccc1
Nc1nc(nc2sc(nc12)-c1ccco1)-c1cccc(CO)c1
O=C(Nc1nc(nc2sc(nc12)-c1ccco1)-c1ccccc1)c1ccccc1
COc1cccc(c1)-c1nc(N)c2nc(sc2n1)-c1ccccc1
Nc1nc(nc2sc(nc12)-c1ccco1)-c1ccccc1
Nc1nc(nc2sc(nc12)-c1ccco1)-c1cccc(O)c1
O=C(Nc1nc(nc2sc(nc12)-c1ccccc1)-c1ccccc1)c1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(OCCOCCOC)cc2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(Br)cc1
CCCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(C)c1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N(C)C
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cccc(F)c1
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(OC)c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(C)c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(cc2)N=[N+]=[N-])CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(OCCO)cc2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cc(F)cc(OC)c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(F)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccccc1Cl
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cccc(Br)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(I)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(C)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccccc1C
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(C)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(OC)c(F)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)c(OC)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(O)c(Cl)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1F
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N(C)CCc1ccccc1
O=C(Nc1nc2nn(CCCc3ccccc3)cc2c2nc(nn12)-c1ccco1)c1cccc2ccccc12
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(OC)c(F)c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cccc(Cl)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(O)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2cccc(Br)c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(cc2)C(O)=O)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(Br)c(F)c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccccc1F
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccccc1Br
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(OC)c(Cl)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(C(C)C1)c1ccccc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(F)c(OC)c2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cccc(OC)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(OCCO)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(Cc2ccc(Br)cc2)CC1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)c(O)c1
CC(=O)Oc1ccc(cc1OC(C)=O)-c1cc2ccc(OC(C)=O)c(OC(C)=O)c2oc1=O
Cc1ccc(cc1)-c1cc2cccc(C)c2oc1=O
CC(=O)Oc1ccc(cc1OC(C)=O)-c1cc2cccc(OC(C)=O)c2oc1=O
CCOc1cccc2cc(-c3ccc(Br)cc3)c(=O)oc12
COc1ccc(cc1OC)-c1cc2cccc(C)c2oc1=O
CC(=O)COc1cccc2cc(-c3ccccc3)c(=O)oc12
CCOc1cccc2cc(-c3ccccc3)c(=O)oc12
Oc1cccc2cc(-c3ccc(Br)cc3)c(=O)oc12
CCOc1cccc2cc(-c3ccc(OC)c(OC)c3)c(=O)oc12
CCOc1cccc2cc(-c3ccc(OC)cc3OC)c(=O)oc12
CCOc1cccc2cc(-c3cc(OC)c(OC)c(OC)c3)c(=O)oc12
COc1cc(cc(OC)c1OC)-c1cc2cccc(C)c2oc1=O
COc1cccc2cc(-c3ccc(cc3)[N+]([O-])=O)c(=O)oc12
CC(=O)Oc1ccc2cc(-c3ccccc3)c(=O)oc2c1OC(C)=O
CC(=O)Oc1ccc(cc1)-c1cc2ccc(OC(C)=O)c(OC(C)=O)c2oc1=O
Oc1cccc2cc(-c3ccccc3)c(=O)oc12
Oc1ccc2cc(-c3ccccc3)c(=O)oc2c1O
Oc1ccc(cc1O)-c1cc2ccc(O)c(O)c2oc1=O
CCOc1cccc2cc(-c3ccc(C)cc3)c(=O)oc12
Cc1cccc2cc(-c3ccccc3)c(=O)oc12
Cc1cccc2cc(-c3ccc(cc3)[N+]([O-])=O)c(=O)oc12
COc1ccc(cc1)-c1cc2cccc(OC)c2oc1=O
Oc1ccc(cc1O)-c1cc2cccc(O)c2oc1=O
CCOc1cccc2cc(-c3ccc(cc3)[N+]([O-])=O)c(=O)oc12
Cc1cccc2cc(-c3cc(O)c(O)c(O)c3)c(=O)oc12
CC(=O)COc1cccc2cc(-c3ccc(Br)cc3)c(=O)oc12
Oc1ccc(cc1)-c1cc2ccc(O)c(O)c2oc1=O
CCOc1cccc2cc(-c3ccc(OC)cc3)c(=O)oc12
CC(=O)COc1cccc2cc(-c3ccc(C)cc3)c(=O)oc12
CC(=O)Oc1cccc2cc(-c3ccccc3)c(=O)oc12
Oc1cccc(c1)-c1nc(N2CCCCC2)c2[nH]cnc2n1
Clc1cccc(c1)-c1nc(N2CCCCC2)c2nc[nH]c2n1
Oc1ccc(cc1)-c1nc(N2CCCCC2)c2nc[nH]c2n1
Nc1nc(SCCO)c(C#N)c(-c2ccco2)c1C#N
CC(=O)Nc1nc(SCCO)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(NCCO)c(C#N)c(-c2cccs2)c1C#N
COC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3ccco3)c2C#N)c1
Nc1nc(SCc2cccc(CO)c2)c(C#N)c(-c2ccco2)c1C#N
OCCSc1nc(NCc2ccccc2)c(C#N)c(-c2ccco2)c1C#N
OCCSc1nc(NC2CCCC2)c(C#N)c(-c2ccco2)c1C#N
COC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3cccnc3)c2C#N)c1
Nc1nc(NCCO)c(C#N)c(-c2cccnc2)c1C#N
COC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3cccs3)c2C#N)c1
COC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3ccoc3)c2C#N)c1
Nc1nc(SCc2ccccn2)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(SCc2cccnc2)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(SCc2ccncc2)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(SCc2cccc(c2)C(O)=O)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(SCC(=O)OCc2ccccc2)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(SCC#N)c(C#N)c(-c2ccco2)c1C#N
COC(=O)CSc1nc(N)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(OCCO)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(SCCO)c(C#N)c(-c2cccnc2)c1C#N
NC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3ccco3)c2C#N)c1
OCCSc1nc(NC2CC2)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(SCCO)c(C#N)c(-c2cccs2)c1C#N
Nc1nc(SCc2cccc(c2)C#N)c(C#N)c(-c2ccco2)c1C#N
NC(=O)CSc1nc(N)c(C#N)c(-c2ccco2)c1C#N
OCCSc1nc(Nc2ccc(I)cc2)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(SCCO)c(C#N)c(-c2ccsc2)c1C#N
Nc1nc(SCCO)c(C#N)c(-c2ccoc2)c1C#N
COC(=O)c1ccc(CSc2nc(N)c(C#N)c(-c3ccco3)c2C#N)o1
Nc1nc(SCC(=O)c2ccccc2)c(C#N)c(-c2ccco2)c1C#N
Nc1nc(NCCO)c(C#N)c(-c2ccco2)c1C#N
CC1=C(C(c2ccoc2)n2c(N1)nc1ccccc21)C(=O)OCC(F)(F)F |t:1|
CC1=C(C(NC(=O)N1)c1ccoc1)C(=O)OCC(F)(F)F |t:1|
CCOC(=O)C1=C(Nc2nc3ccccc3n2[C@@H]1c1ccoc1)C(F)(F)F |r,t:5|
CC(OC(=O)C1=C(C)NC(=O)NC1c1ccoc1)C(F)(F)F |c:5|
CCn1c2nc([nH]c2c(=O)n(CC)c1=O)C1CCCC1
CCOC(=O)C1=C(NC(=O)NC1c1ccoc1)C(F)(F)F |t:5|
CC(C)OC(=O)C1=C(NC(=O)NC1c1ccco1)C(F)(F)F |t:6|
CC(OC(=O)C1=C(C)NC(=O)NC1c1ccco1)C(F)(F)F |c:5|
CCOC(=O)C1=C(Nc2nc3ccccc3n2C1c1ccco1)C(F)(F)F |t:5|
CCOC(=O)C1=C(Nc2nc3ccccc3n2C1c1ccsc1)C(F)(F)F |t:5|
CC1=C(C(c2ccco2)n2c(N1)nc1ccccc21)C(=O)OCC(F)(F)F |t:1|
CC(OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccoc1)C(F)(F)F |c:5|
C[C@H](OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1)C(F)(F)F |r,c:5|
C[C@H](OC(=O)C1=C(C)Nc2nc3ccccc3n2[C@@H]1c1ccco1)C(F)(F)F |r,c:5|
C[C@@H](OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1)C(F)(F)F |r,c:5|
CCOC(=O)C1=C(NC(=O)NC1c1ccsc1)C(F)(F)F |t:5|
CC1=C(C(NC(=O)N1)c1ccco1)C(=O)OCC(F)(F)F |t:1|
CC(OC(=O)C1=C(C)NC(=O)NC1c1ccsc1)C(F)(F)F |c:5|
CC(C)OC(=O)C1=C(Nc2nc3ccccc3n2C1c1ccoc1)C(F)(F)F |t:6|
CC(OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1)C(F)(F)F |c:5|
C[C@@H](OC(=O)C1=C(C)Nc2nc3ccccc3n2[C@@H]1c1ccco1)C(F)(F)F |r,c:5|
CC(C)OC(=O)C1=C(NC(=O)NC1c1ccsc1)C(F)(F)F |t:6|
CCOC(=O)C1=C(Nc2nc3ccccc3n2C1c1ccoc1)C(F)(F)F |t:5|
CC1=C([C@@H](c2ccco2)n2c(N1)nc1ccccc21)C(=O)OCC(F)(F)F |r,t:1|
Cc1csc2n(Cc3cnc[nH]3)c(=O)n(CCc3ccccc3)c(=O)c12
COCCn1c2sc(C(N)=O)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2scc(C)c2c(=O)n(CCc2cccnc2)c1=O
COCCn1c2scc(C)c2c(=O)n(CCN2CCS(=O)(=O)CC2)c1=O
COCCn1c2sc(C(=O)c3cn(C)cn3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
Cc1csc2n(Cc3nc[nH]c3C)c(=O)n(CCc3ccccc3)c(=O)c12
CCn1c(=O)n(CCC(F)(F)F)c2sc(C(=O)N3CCC(O)CC3)c(C)c2c1=O
Cc1csc2n(CC3CCCO3)c(=O)n(CCc3ccccc3)c(=O)c12
COCCn1c2scc(C)c2c(=O)n(CCc2ccccc2F)c1=O
CCn1c(=O)n(CCOC)c2scc(C)c2c1=O
COCCn1c2scc(C)c2c(=O)n(CC2(CC2)c2ccccc2)c1=O
[#6]-[#8]-[#6]-[#6]-n1c2scc(-[#6])c2c(=O)n(-[#6]\[#6]=[#6](\F)F)c1=O
COCCn1c2scc(C)c2c(=O)n(CCC2CCOCC2)c1=O
COCCn1c2scc(C)c2c(=O)n(Cc2ccccc2)c1=O
COCCn1c2sccc2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(COC3CCCC3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(C(O)=O)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(C(=O)N(C)OC)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(C(=O)N3CC(O)C3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(C(O)C3CC3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(c(C)c2c(=O)n(CCc2ccccc2)c1=O)-c1ccccc1
COCCn1c2sc(Cc3ccccc3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
Cc1csc2n(CCC(F)(F)F)c(=O)n(CCc3ccccc3)c(=O)c12
Cc1csc2n(Cc3ncc[nH]3)c(=O)n(CCc3ccccc3)c(=O)c12
Cc1csc2n(CCF)c(=O)n(CCc3ccccc3)c(=O)c12
COCCn1c2scc(C)c2c(=O)n(CCc2ccccc2)c1=O
Cc1csc2[nH]c(=O)n(CCc3ccccc3)c(=O)c12
Cc1csc2n(Cc3nc4cc(ccc4o3)S(N)(=O)=O)c(=O)n(CCc3ccccc3)c(=O)c12
Cc1csc2n(CCC(F)(F)F)c(=O)n(CCc3cccnc3)c(=O)c12
Cc1csc2n(CCC(F)(F)F)c(=O)n(CCc3ccccc3F)c(=O)c12
COCCn1c2sc(C(=O)c3ccccc3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(c(C)c2c(=O)n(CCc2ccccc2)c1=O)C(F)(F)c1ccccc1
COCCn1c2sc(Cc3nc[nH]c3C)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(CN3CCCC3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
CCn1c(=O)n(CCC(F)(F)F)c2sc(C(=O)N3CC(O)C3)c(C)c2c1=O
CCN(CC(C)(C)O)C(=O)c1sc2n(CCC(F)(F)F)c(=O)n(CC)c(=O)c2c1C
CCN(CCO)C(=O)c1sc2n(CCC(F)(F)F)c(=O)n(CC)c(=O)c2c1C
COCCn1c2sc(Cn3ccnc3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
CCN(CC)C(=O)c1sc2n(CCC(F)(F)F)c(=O)n(CCOC)c(=O)c2c1C
CCn1c(=O)n(CCOC)c2sc3CCCc3c2c1=O
COCCn1c2sc3CCCCc3c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(CO)c(C)c2c(=O)n(CCc2ccccc2)c1=O
CCN(CC)C(=O)c1sc2n(CCOC)c(=O)n(CCc3ccccc3)c(=O)c2c1C
COCCn1c2sc(C(=O)C3CC3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2scc(C)c2c(=O)n(CC(C)(C)C)c1=O
COCCn1c2sc(C(=O)N3CCCC3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(c(C)c2c(=O)n(CCc2ccccc2)c1=O)C(C)(O)c1cncn1C
Cc1csc2n(CC(=O)Nc3cc(Cl)ccc3C(O)=O)c(=O)n(CCc3ccccc3)c(=O)c12
COCCn1c2sc3CCCc3c2c(=O)n(CCc2ccccc2)c1=O
Cc1csc2n(CC#N)c(=O)n(CCc3ccccc3)c(=O)c12
Cc1csc2n(Cc3nccn3C)c(=O)n(CCc3ccccc3)c(=O)c12
Cc1csc2n(CCc3ccc(cc3)S(N)(=O)=O)c(=O)n(CCc3ccccc3)c(=O)c12
CCn1c(=O)n(CCOC)c2sc(C)c(C)c2c1=O
COCCn1c2sc(CN3CCOCC3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
CCN(CC)C(=O)c1sc2n(C)c(=O)n(C)c(=O)c2c1N
CCn1c(=O)n(CCOC)c2sc3CCCCc3c2c1=O
COCCn1c2sc(C)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2scc(C)c2c(=O)n(CC(F)(F)c2ccccc2)c1=O
COCCn1c2scc(C)c2c(=O)[nH]c1=O
COCCn1c2sc(Cl)c(C)c2c(=O)n(CCc2ccccc2)c1=O
CCOC(=O)c1sc2n(CCOC)c(=O)n(CCc3ccccc3)c(=O)c2c1C
COCCn1c2sc(c(C)c2c(=O)n(CCc2ccccc2)c1=O)C(C)(O)C1CC1
COCCn1c2sc(C(O)c3ccccc3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
COCCn1c2sc(Cc3c[nH]c(C)n3)c(C)c2c(=O)n(CCc2ccccc2)c1=O
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)c1cccc(F)c1
Cn1c2nc3CN(CCc4ccccc4F)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)C1CCc2ccccc12
Cc1sc(nc1CN1CCn2c(C1)nc1n(C)c(=O)n(C)c(=O)c21)-c1ccc(cc1)C(F)(F)F
COc1ccc(Br)cc1CCN1CCn2c(C1)nc1n(C)c(=O)n(C)c(=O)c21
Cn1c2nc3CN(CCCc4cccc(Br)c4)CCn3c2c(=O)n(C)c1=O
COc1cccc(CCN2CCn3c(C2)nc2n(C)c(=O)n(C)c(=O)c32)c1
Cn1c2nc3CN(CCCn4cccc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)C1Cc2ccccc2C1
Cn1c2nc3CN(Cc4csc(n4)-c4ccc(Cl)cc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)c1ccccc1
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)c1cccc(Cl)c1
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)c1ccc(Cl)cc1
COc1cccc(c1)N1CCn2c(C1)nc1n(C)c(=O)n(C)c(=O)c21
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)c1cccc2ccccc12
Cn1c2nc3CN(CCc4cccc(F)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4ccccc4Cl)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4cccc(Cl)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4cccc(Br)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4cccc(c4)C(F)(F)F)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4cccc(F)c4F)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4cc(ccc4F)C(F)(F)F)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4ccc(Cl)c(Cl)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4ccc(Cl)cc4Cl)CCn3c2c(=O)n(C)c1=O
COc1cccc(CCN2CCn3c(C2)nc2n(C)c(=O)n(C)c(=O)c32)c1OC
Cn1c2nc3CN(CC(O)c4ccccc4)CCn3c2c(=O)n(C)c1=O
CC(CN1CCn2c(C1)nc1n(C)c(=O)n(C)c(=O)c21)c1ccccc1
Cn1c2nc3CN(CCn4cccc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCCc4ccccc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCCc4ccc(Cl)cc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCOc4ccccc4F)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCOc4cccc(F)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)[C@@H]1CCCc2ccccc12 |r|
COc1cccc2C[C@H](CCc12)N1CCn2c(C1)nc1n(C)c(=O)n(C)c(=O)c21 |r|
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)[C@H]1CCc2ccccc12 |r|
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)C1CCN(Cc2ccccc2)CC1
Cn1c2nc3CN(Cc4nocc4-c4ccccc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(Cc4csc(n4)-c4cccc(Cl)c4)CCn3c2c(=O)n(C)c1=O
Cc1cc(CN2CCn3c(C2)nc2n(C)c(=O)n(C)c(=O)c32)n(C)n1
Cn1c2nc3CN(Cc4cn(nn4)-c4ccc(Cl)cc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CC#Cc4cccc(Cl)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CC#Cc4ccc(Cl)c(Cl)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(Cc4ccccc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)c1ccc(F)cc1
Cn1c2nc3CN(CCc4ccc(Cl)cc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4ccc(Cl)cc4C(F)(F)F)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCOc4ccccc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(Cc4csc(n4)-c4cccs4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)c1ccc(Br)cc1
Cn1c2nc3CN(CCc4ccccc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4ccccc4Br)CCn3c2c(=O)n(C)c1=O
COc1ccccc1CCN1CCn2c(C1)nc1n(C)c(=O)n(C)c(=O)c21
Cn1c2nc3CN(CCc4c(Cl)cccc4Cl)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4ccc5OCOc5c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCc4cccs4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCCn4ccnc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCOc4ccc(Cl)c(Cl)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CCn3c2c(=O)n(C)c1=O)[C@@H]1CCc2ccccc12 |r|
Cn1c2nc3CN(Cc4csc(n4)-c4ccc(cc4)C(F)(F)F)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3CN(CC#N)CCn3c2c(=O)n(C)c1=O
COc1cccc(c1)C#CCN1CCn2c(C1)nc1n(C)c(=O)n(C)c(=O)c21
COc1ccc(CCN2CCn3c(C2)nc2n(C)c(=O)n(C)c(=O)c32)cc1OC
Cn1c2nc3CN(Cc4ccc(Cl)c(Cl)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4cc(ccc4Cl)C(F)(F)F)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4cccc(Br)c4)CCCCn3c2c(=O)n(C)c1=O
COc1ccccc1CN1CCn2c1nc1n(C)c(=O)n(C)c(=O)c21
Cn1c2nc3N(CCc4ccncc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4cccc(Br)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccccc4Br)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(F)c(Br)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(Cl)cc4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(Cl)c(F)c4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCc4cccnc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4cc(F)c(F)c(F)c4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4cccs4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4cc(Br)ccc4F)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(Cl)cc4F)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(Br)cc4F)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccccc4Br)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(Cl)c(c4)C(F)(F)F)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(cc4)C(C)(C)C)CCCn3c2c(=O)n(C)c1=O
Cc1cccc(CN2CCCn3c2nc2n(C)c(=O)n(C)c(=O)c32)c1
Cn1c2nc3N(Cc4c(F)cccc4Cl)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccccc4Cl)CCCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccccc4F)CCCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(Cl)c(Cl)c4)CCCCn3c2c(=O)n(C)c1=O
COc1ccccc1CN1CCCCn2c1nc1n(C)c(=O)n(C)c(=O)c21
Cn1c2nc3N(Cc4ccc(Cl)cc4Cl)CCCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(Cl)c(Cl)c4)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccccc4F)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(F)cc4Cl)CCCn3c2c(=O)n(C)c1=O
COc1ccc(CN2CCCn3c2nc2n(C)c(=O)n(C)c(=O)c32)cc1Cl
Cn1c2nc3N(Cc4cccc(Br)c4)CCCn3c2c(=O)n(C)c1=O
Cc1ccccc1CN1CCCn2c1nc1n(C)c(=O)n(C)c(=O)c21
Cn1c2nc3N(Cc4cc(Cl)ccc4Cl)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccccc4Br)CCCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(Cc4ccc(F)c(Br)c4)CCCn3c2c(=O)n(C)c1=O
COc1ccc(Cl)c(CN2CCCn3c2nc2n(C)c(=O)n(C)c(=O)c32)c1F
Cn1c2nc3N(Cc4ccc(F)c(Br)c4)CCCCn3c2c(=O)n(C)c1=O
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cc[nH]c1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cc[nH]c1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccc[nH]1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccc[nH]1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccon1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccon1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cc[nH]n1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cc[nH]n1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cnoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cnoc1 |c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cnsc1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cn[nH]c1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cn[nH]c1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccno1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccno1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccns1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccns1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ncco1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ncco1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1nccs1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1nccs1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ncc[nH]1 |c:5|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cocn1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cocn1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cnco1 |c:5|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cncs1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cncs1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccccc3n2[C@@H]1c1cocn1 |r,c:5|
Nc1nc(NCc2ccc(cc2)S(N)(=O)=O)nc2sc(nc12)-c1ccco1
Nc1nc(NCCc2ccc(cc2)S(N)(=O)=O)nc2sc(nc12)-c1ccco1
Nc1nc(nc2sc(nc12)-c1ccco1)N1CCN(CC1)c1ccc(cc1)S(N)(=O)=O
Nc1nc(NCCN2CCN(CC2)c2ccc(cc2)S(N)(=O)=O)nc2sc(nc12)-c1ccco1
Nc1nc(NCC2CCN(CC(=O)Nc3ccc(cc3)S(N)(=O)=O)CC2)nc2sc(nc12)-c1ccco1
Nc1nc(NCC2CCN(CC(=O)NCc3ccc(cc3)S(N)(=O)=O)CC2)nc2sc(nc12)-c1ccco1
Nc1nc(NCC2CCN(CC(=O)NCCc3ccc(cc3)S(N)(=O)=O)CC2)nc2sc(nc12)-c1ccco1
Nc1nc(nc2sc(nc12)-c1ccco1)N1CCC(CNC(=O)c2ccc(cc2)S(N)(=O)=O)CC1
Nc1nc(nc2sc(nc12)-c1ccco1)N1CCC(CNC(=O)c2cccc(c2)S(N)(=O)=O)CC1
Nc1nc(nc2sc(nc12)-c1ccco1)N1CCC(CNC(=O)CN2C(=O)c3ccccc3S2(=O)=O)CC1
Nc1nc(nc2sc(nc12)-c1ccco1)N1CCC(CNC(=O)CCN2C(=O)c3ccccc3S2(=O)=O)CC1
CCOC(=O)c1ccc(cc1)N1CCN(CC1)c1nc(N)c2nc(sc2n1)-c1ccco1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCCO)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCCCl)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCCN2CCCC2)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCCN2CCCCC2)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCCN2CCOCC2)cc1
CN1CCN(CCOc2ccc(cc2)-c2cn3c(nn(-c4ccccc4)c3=O)c(N)n2)CC1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCC(O)CO)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCC(O)CN2CCCCC2)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCC(O)CN2CCOCC2)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCN2CCCC2)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCN2CCCCC2)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCN2CCOCC2)cc1
CN1CCN(CCC(=O)Nc2ccc(cc2)-c2cn3c(nn(-c4ccccc4)c3=O)c(N)n2)CC1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCN2CCN(CCO)CC2)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCN2CCN(CC2)c2ccccc2)cc1
NCC1CCN(CCC(=O)Nc2ccc(cc2)-c2cn3c(nn(-c4ccccc4)c3=O)c(N)n2)CC1
NC(=O)C1CCN(CCC(=O)Nc2ccc(cc2)-c2cn3c(nn(-c4ccccc4)c3=O)c(N)n2)CC1
CCOC(=O)CCCNc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
COC(=O)[C@@H]1CCCN1c1nc2nn(C)cc2c2nc(nn12)-c1ccco1 |r|
CCOC(=O)CC[C@H](Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1)C(=O)OCC |r|
CCOC(=O)C[C@H](Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1)C(=O)OCC |r|
CCOC(=O)C(Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1)C(O)c1ccccc1
CCOC(=O)[C@H](Cc1ccccc1)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1 |r|
CCOC(=O)[C@H](Cc1ccc(O)cc1)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1 |r|
CCOC(=O)C(CO)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCOC(=O)[C@@H](Cc1cc2ccccc2[nH]1)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1 |r|
CCOC(=O)C(Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1)c1ccccc1
CCCCC(Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1)C(=O)OCC
CCOC(=O)C(CC(C)C)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
CCOC(=O)C(Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1)C(C)C
CCOC(=O)C(C)Nc1nc2nn(C)cc2c2nc(nn12)-c1ccco1
COc1cc(cc(OC)c1OC)-c1nc(NC(C)=O)sc1-c1ccncc1
CCCOC(=O)c1c(CCC)c(C(=O)SCC)c(CC)nc1-c1ccccc1
CC[C@@H]1Cn2c(N1)c1nc(nc1n(C)c2=O)-c1ccccc1
CC[C@@H]1Cn2c(N1)c1nc(nc1n(C)c2=O)-c1cc(Cl)cc(Cl)c1Cl
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C12CC3CC1CC(C2)C3 |THB:22:21:18:24.23.25,22:23:18:21.20|
CCCCn1c(=O)n(CCCO)c2nc([nH]c2c1=O)C12CC3CC1CC(C2)C3 |TLB:22:21:26:23.24,THB:22:23:26:20.21.27,24:23:20:26.25.27,24:25:20:23.22|
Clc1ccc(cc1)-n1c(nc2ccccc2c1=O)-c1sc(NC(=O)c2ccco2)nc1-c1ccccc1
COc1ccc(cc1)-n1c(nc2ccccc2c1=O)-c1sc(NC(=O)c2ccco2)nc1-c1ccccc1
Cc1ccc(cc1)-n1c(nc2ccccc2c1=O)-c1sc(NC(=O)c2ccco2)nc1-c1ccccc1
O=C(Nc1nc(c(s1)-c1nc2ccccc2c(=O)n1-c1ccccc1)-c1ccccc1)c1ccco1
Fc1ccc(C(=O)c2sc(NC(=O)c3ccco3)nc2-c2ccccc2)c(F)c1
Cc1ccc(cc1)C(=O)c1sc(NC(=O)c2ccco2)nc1-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)-c1nc2ccccc2c(=O)n1-c1ccc(OC)cc1)-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)-c1nc2ccccc2c(=O)n1-c1ccc(C)cc1)-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)-c1nc2ccccc2c(=O)n1-c1ccccc1)-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1ccc(F)cc1F)-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1ccc(C)cc1)-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1ccc(OC)cc1)-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1ccc(Cl)cc1)-c1ccccc1
COc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1ccccc1)-c1ccccc1
Clc1ccc(cc1)-n1c(nc2ccccc2c1=O)-c1sc(NC(=O)c2ccccc2)nc1-c1ccccc1
COc1ccc(cc1)-n1c(nc2ccccc2c1=O)-c1sc(NC(=O)c2ccccc2)nc1-c1ccccc1
Cc1ccc(cc1)-n1c(nc2ccccc2c1=O)-c1sc(NC(=O)c2ccccc2)nc1-c1ccccc1
O=C(Nc1nc(c(s1)-c1nc2ccccc2c(=O)n1-c1ccccc1)-c1ccccc1)c1ccccc1
Clc1ccc(cc1)C(=O)c1sc(NC(=O)c2ccccc2)nc1-c1ccccc1
O=C(Nc1nc(c(s1)-c1ccccn1)-c1ccccc1)c1ccccc1
Fc1ccc(C(=O)c2sc(NC(=O)c3ccccc3)nc2-c2ccccc2)c(F)c1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC(c3ccccc3)c3ccccc3)ncnc12
Cc1cccnc1CNC(=O)c1cnc(nc1N)-c1ccco1
COc1nc(nc(N)c1C(=O)NCc1c(Cl)cccc1Cl)-c1ncco1
Cc1ccc(o1)-c1nc(N)nc2n(Cc3cccc(CO[C@H]4CCOC4)n3)nnc12 |r|
Nc1nc(nc(c1Br)-n1cccn1)-n1cccn1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccccc1O
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(cc1)S(N)(=O)=O
CN(C)c1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(cc1)S(N)(=O)=O
CCOC(=O)CNc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCC(O)=O)cc1
COc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
COc1ccc(cc1OC)C(=O)Nc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)c2ccc(O)cc2)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)c2ccc(O)c(O)c2)cc1
CCOC(=O)c1ccc(cc1)C(=O)Nc1ccc(cc1)-c1cn2c(nn(-c3ccccc3)c2=O)c(N)n1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)c2ccc(cc2)C(O)=O)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)c2ccc(cc2)C(=O)NO)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)c2ccc(cc2)S(N)(=O)=O)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)c2cccc(c2)S(N)(=O)=O)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NCc2ccc(cc2)S(N)(=O)=O)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NCC(=O)c2ccc(cc2)S(N)(=O)=O)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCNCCc2ccc(cc2)S(N)(=O)=O)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCNCc2ccc(cc2)S(N)(=O)=O)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCNC(=O)c2ccc(cc2)S(N)(=O)=O)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(NC(=O)CCNC(=O)c2cccc(c2)S(N)(=O)=O)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCCNCCc2ccc(cc2)S(N)(=O)=O)cc1
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCCNC(=O)c2ccc(cc2)S(N)(=O)=O)cc1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(CNC(=O)c4ccc(cc4)S(F)(=O)=O)cc3)ncnc12 |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(CN=C=S)cc3)ncnc12 |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(CNC(=S)Nc4ccc(cc4)N=C=S)cc3)ncnc12 |r|
CC(C)COC(=O)C1=C(C)NC(=O)NC1c1ccco1 |c:7|
CC1=C(C(NC(=O)N1)c1ccco1)C(=O)OCc1ccccc1 |t:1|
CCCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 |c:6|
CC(C)COC(=O)C1=C(C)NC(=O)NC1c1ccoc1 |c:7|
CC1=C(C(NC(=O)N1)c1ccoc1)C(=O)OC(C)(C)C |t:1|
CC1=C(C(NC(=O)N1)c1ccoc1)C(=O)OCc1ccccc1 |t:1|
CCCOC(=O)C1=C(C)NC(=O)NC1c1cccs1 |c:6|
CC(C)COC(=O)C1=C(C)NC(=O)NC1c1cccs1 |c:7|
CC1=C(C(NC(=O)N1)c1cccs1)C(=O)OCc1ccccc1 |t:1|
CCCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 |c:6|
CC(C)COC(=O)C1=C(C)NC(=O)NC1c1ccsc1 |c:7|
COC(=O)C1=C(C)N=C(S)NC1c1ccco1 |c:4,t:7|
CC1=C(C(NC(=S)N1)c1ccoc1)C(=O)OC(C)(C)C |t:1|
CN1C(=O)NC(c2ccsc2)C(C(=O)OCc2ccccc2)=C1C |c:23|
CC1=C(C(NC(=O)N1)c1ccco1)C(=O)C1CC1 |t:1|
CCCC(=O)C1=C(C)NC(=O)NC1c1ccco1 |c:5|
CC(C)CC(=O)C1=C(C)NC(=O)NC1c1ccco1 |c:6|
CC(C)CC(=O)C1=C(C)NC(=O)NC1c1ccoc1 |c:6|
CC(C)CC(=O)C1=C(C)NC(=O)NC1c1ccsc1 |c:6|
CC(C)SC(=O)C1=C(C)NC(=O)NC1c1ccoc1 |c:6|
Cc1cnc(o1)C1=C(C)NC(=O)NC1c1ccco1 |c:7|
Cc1cnc(o1)C1=C(C)NC(=O)NC1c1ccoc1 |c:7|
Cc1cnc(o1)C1=C(C)NC(=O)NC1c1ccsc1 |c:7|
CCC(C)OC(=O)C1=C(C)NC(=O)NC1c1ccco1 |c:7|
CC1=C(C(NC(=O)N1)c1ccco1)C(=O)OC1CCC1 |t:1|
CC1=C(C(NC(=O)N1)c1ccco1)C(=O)OC1CCCC1 |t:1|
CC1=C(C(NC(=O)N1)c1ccco1)C(=O)OCC1CC1 |t:1|
CC1=C(C(NC(=O)N1)c1ccco1)C(=O)OCC1CCC1 |t:1|
CCC(C)OC(=O)C1=C(C)NC(=O)NC1c1ccoc1 |c:7|
CC1=C(C(NC(=O)N1)c1ccoc1)C(=O)OC1CCC1 |t:1|
CC1=C(C(NC(=O)N1)c1ccoc1)C(=O)OC1CCCC1 |t:1|
CC1=C(C(NC(=O)N1)c1ccoc1)C(=O)OCC1CC1 |t:1|
CC1=C(C(NC(=O)N1)c1ccoc1)C(=O)OCC1CCC1 |t:1|
CC1=C(C(NC(=O)N1)c1cccs1)C(=O)OC1CCC1 |t:1|
CC1=C(C(NC(=O)N1)c1cccs1)C(=O)OCC1CC1 |t:1|
CC1=C(C(NC(=O)N1)c1cccs1)C(=O)OCC1CCC1 |t:1|
CC1=C(C(NC(=O)N1)c1ccsc1)C(=O)OC1CCC1 |t:1|
CC1=C(C(NC(=O)N1)c1ccsc1)C(=O)OC1CCCC1 |t:1|
CC1=C(C(NC(=O)N1)c1ccsc1)C(=O)OCC1CC1 |t:1|
CC1=C(C(NC(=O)N1)c1ccsc1)C(=O)OCC1CCC1 |t:1|
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccsc1 |r,c:5|
CC(C)OC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccco1 |r,c:6|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCCCCc3ccccc3)ncnc12 |r|
CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCCCCc3ccccc3)ncnc12 |r|
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccccc1
Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)[nH]c2)c2nc(Cc3ccc(F)cn3)nn12
Nc1nc(-c2ccccc2)c(-c2ccnnc2)c2nc(Cc3ncccc3F)nn12
COc1ccc(Cc2nc3c(-c4ccc(=O)n(C)c4)c(nc(N)n3n2)-c2ccccc2)nc1
Nc1nc(-c2ccccc2)c(-c2ccc(=O)[nH]c2)c2nc(Cc3ncc(F)cc3Cl)nn12
Nc1nc(-c2ccccc2)c(-c2ccnnc2)c2nc(CC3CCCO3)nn12
Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)[nH]c2)c2nc(CCC(F)(F)F)nn12
Cc1cc(c[nH]c1=O)-c1c(nc(N)n2nc(CN3CCCCC3)nc12)-c1ccc(F)cc1
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(nc12)[C@H](O)c1ncccc1F)-c1ccccc1 |r|
Cn1cc(ccc1=O)-c1c(nc(N)n2nc(nc12)[C@H](O)c1ncccc1F)-c1ccc(F)cc1 |r|
Nc1ccccc1NC(=O)c1ccc(CCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1
Nc1nc-2c(Cc3ccccc-23)c(n1)-c1ccc(OCCCN2CCCCC2)cc1
Nc1nc-2c(Cc3cc(OCCCN4CCCC4)ccc-23)c(n1)-c1ccccc1
Nc1nc-2c(Cc3cc(OCCCN4CCCCC4)ccc-23)c(n1)-c1ccc(OCCCN2CCCCC2)cc1
Nc1nc-2c(Cc3ccc(OCCCN4CCCC4)cc-23)c(n1)-c1ccccc1
Nc1nc-2c(Cc3cc(OCCCN4CCCCC4)ccc-23)c(n1)-c1ccccc1
Nc1nc-2c(Cc3ccc(OCCCN4CCCCC4)cc-23)c(n1)-c1ccccc1
Nc1nc2-c3ccccc3C(=O)c2c(n1)-c1ccc(OCCCN2CCCCC2)cc1
Nc1nc2-c3ccc(OCCCN4CCCC4)cc3C(=O)c2c(n1)-c1ccccc1
Nc1nc2-c3ccc(OCCCN4CCCCC4)cc3C(=O)c2c(n1)-c1ccc(OCCCN2CCCCC2)cc1
Nc1nc2-c3cc(OCCCN4CCCC4)ccc3C(=O)c2c(n1)-c1ccccc1
Nc1nc2-c3ccc(OCCCN4CCCCC4)cc3C(=O)c2c(n1)-c1ccccc1
Nc1nc2-c3cc(OCCCN4CCCCC4)ccc3C(=O)c2c(n1)-c1ccccc1
O=C(C1CC1)c1ccc(OCCCN2CCCCC2)cc1
O=C(C1CC1)c1ccc(OCCCc2c[nH]cn2)cc1
Nc1nc2-c3cc(OCCN4CCOCC4)ccc3C(=O)c2c(n1)-c1ccccc1
CCC(=O)Nc1cc(nc(n1)-c1ccc(OC)cc1)-c1ccc(OC)cc1
CCCCn1c(=O)n(CCCNC(=O)c2ccc(cc2)S(F)(=O)=O)c2[nH]c(nc2c1=O)C12CCC(CC1)(CC2)C(=O)NCCCCC#C
CCCCn1c(=O)n(CCCNC(=O)c2ccc(cc2)S(F)(=O)=O)c2[nH]c(nc2c1=O)C12CCC(CC1)(CC2)C(=O)NCCOCCOCCOCCN=[N+]=[N-]
CCCCn1c(=O)n(CCCNC(=O)c2ccc(cc2)S(F)(=O)=O)c2[nH]c(nc2c1=O)C12CCC(CC1)(CC2)C(=O)NCCOCCOCCN=[N+]=[N-]
CCCCn1c(=O)n(CCCNC(=O)c2ccc(cc2)S(F)(=O)=O)c2[nH]c(nc2c1=O)C12CCC(CC1)(CC2)C(=O)NCCCCCCCCN=[N+]=[N-]
CCCCn1c(=O)n(CCCNC(=O)c2ccc(cc2)S(F)(=O)=O)c2[nH]c(nc2c1=O)C12CCC(CC1)(CC2)C(=O)NCCCCN=[N+]=[N-]
CCCn1c(=O)n(CCCNC(=O)c2ccc(cc2)S(F)(=O)=O)c2[nH]c(nc2c1=O)C12CCC(CC1)(CC2)C(=O)NCCCN=[N+]=[N-]
CCCCn1c(=O)n(CCCNC(=O)c2ccc(cc2)S(F)(=O)=O)c2[nH]c(nc2c1=O)C12CCC(CC1)(CC2)C(=O)NCCCN=[N+]=[N-]
Nc1nc(SCc2ncc[nH]2)cc(-c2ccccc2)c1C#N
Cc1cc(C)cc(c1)-c1nc(NC(=O)c2cccnc2)sc1-c1ccncc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C12CCC(CC1)(CC2)C(=O)NCCNC(=O)CCNC(=O)CCNC(=O)CCCCCNC(=O)COc1ccc(\C=C\C2=[N+]3C(C=C2)=Cc2ccc(-c4cccs4)n2[B-]3(F)F)cc1 |c:66,68,t:63|
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C12CCC(CC1)(CC2)C(=O)NCCNC(=O)CCNC(=O)CCNC(=O)CCCCC[N+]1=C(\C=C\C=C\C=C2\N(C)c3ccc(cc3C2(C)C)S(O)(=O)=O)C(C)(C)c2cc(ccc12)S([O-])(=O)=O |c:52|
CCCn1c(=O)n(CCCNC(=O)c2ccc(cc2)C(=O)NCCNC(=O)CCNC(=O)CCCCCNC(=O)COc2ccc(\C=C\C3=[N+]4C(C=C3)=Cc3ccc(-c5cccs5)n3[B-]4(F)F)cc2)c2nc([nH]c2c1=O)C12CC3CC(CC(C3)C1)C2 |c:52,54,t:49,TLB:79:80:77.78.83:84,THB:81:80:77:83.82.84,81:82:77:85.79.80,79:78:84:85.80.81|
Nc1nc(-c2ccco2)c(C#N)c(n1)-c1ccc(F)cc1
CCNc1nc(-c2ccccc2)c(C#N)c(n1)-c1cccc(c1)C#N
N#Cc1c(nc(Nc2ccccc2)nc1-c1ccccc1)-c1ccco1
N#Cc1cccc(c1)-c1nc(Nc2ccccc2)nc(-c2ccccc2)c1C#N
COc1cccc(c1)-c1nc(N)nc(-c2ccccc2)c1C#N
CNc1nc(-c2ccccc2)c(C#N)c(n1)-c1cccc(c1)C#N
Nc1nc(-c2cccs2)c(C#N)c(n1)-c1ccccc1
COc1cc(OC)cc(c1)-c1nc(N)nc(-c2ccccc2)c1C#N
CNc1nc(-c2ccccc2)c(C#N)c(n1)-c1ccccc1F
Nc1nc(-c2ccccc2)c(C#N)c(n1)-c1cccc(O)c1
Fc1ccc(cc1)-c1nc(Nc2ccccc2)nc(-c2ccccc2)c1C#N
CNc1nc(-c2ccccc2)c(C#N)c(n1)-c1cc(OC)cc(OC)c1
Nc1nc(-c2cccc(Cl)c2)c(C#N)c(n1)-c1cccc(Cl)c1
Fc1ccccc1-c1nc(Nc2ccccc2)nc(-c2ccccc2)c1C#N
Nc1nc(-c2ccccc2)c(C#N)c(n1)-c1cccc(Cl)c1
Nc1nc(-c2ccccc2)c(C#N)c(n1)-c1cccc(F)c1
COc1ccc(cc1)-c1nc(Nc2ccccc2)nc(-c2ccccc2)c1C#N
N#Cc1c(nc(Nc2ccccc2)nc1-c1ccc2OCOc2c1)-c1ccccc1
CCNc1nc(-c2ccccc2)c(C#N)c(n1)-c1ccc2OCOc2c1
CNc1nc(-c2ccccc2)c(C#N)c(n1)-c1cccc(F)c1
Nc1nc(-c2ccc3OCOc3c2)c(C#N)c(n1)-c1cccc(Cl)c1
CNc1nc(-c2ccccc2)c(C#N)c(n1)-c1ccc(C)cc1
Nc1nc(-c2ccco2)c(C#N)c(n1)-c1ccccc1
N#Cc1c(nc(Nc2ccccc2)nc1-c1cccnc1)-c1ccccc1
Nc1nc(-c2ccccc2)c(C#N)c(n1)-c1ccc2OCOc2c1
COc1cc(OC)cc(c1)-c1nc(Nc2ccccc2)nc(-c2ccccc2)c1C#N
Cn1cc(ccc1=O)-c1cnc(N)n2nc(nc12)-c1ccco1
Cn1cc(ccc1=O)-c1cnc(N)n2nc(nc12)-c1ccccn1
Cn1cc(ccc1=O)-c1cnc(N)n2nc(nc12)-c1nccs1
Cc1cnc(s1)-c1nc2c(cnc(N)n2n1)-c1ccc(=O)n(C)c1
Cc1ccc(o1)-c1nc2c(cnc(N)n2n1)-c1ccc(=O)n(C)c1
Cc1csc(n1)-c1nc2c(cnc(N)n2n1)-c1ccc(=O)n(C)c1
Cn1ccc(n1)-c1nc2c(cnc(N)n2n1)-c1ccc(=O)n(C)c1
Cc1cccc(n1)-c1nc2c(cnc(N)n2n1)-c1ccc(=O)n(C)c1
Cn1nccc1-c1nc2c(cnc(N)n2n1)-c1ccc(=O)n(C)c1
Cn1cc(ccc1=O)-c1cnc(N)nc1-c1ccco1
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3OCc3ccccc3Cl)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3OCc3cccc(OC)c3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3OCc3ccccc3Cl)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3OCc3cccc(Cl)c3)ncnc12 |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3ccccc3)ncnc12 |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3cccc(Br)c3)ncnc12 |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3ccccc3Cl)ncnc12 |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3cccc(Cl)c3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3ccccc3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3ccc(cc3)C(C)(C)C)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3cccc(OC)c3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3cccc(Br)c3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3ccccc3Cl)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3cccc(Cl)c3)ncnc12 |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3ccc(Cl)cc3)ncnc12 |r|
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cccc(c1)S(F)(=O)=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)S(F)(=O)=O
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cccc(OS(F)(=O)=O)c1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OS(F)(=O)=O)cc1
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cccc(c1)N=C=S
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(cc1)N=C=S
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cccc(c1)S(F)(=O)=O
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(F)(=O)=O
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cccc(OS(F)(=O)=O)c1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(OS(F)(=O)=O)cc1
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1cccc(c1)N=C=S
CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)N=C=S
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccc(cc1)C(=O)NCCCc1ccc(Nc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |r|
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccc(cc1)C(=O)NCCC#Cc1ccc(Nc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |r|
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccc(cc1)C(=O)NCCc1ccc(CCNc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |r|
Nc1sc(c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F)-c1ccc(cc1)-c1cn(CCCCCCNc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)nn1 |r|
Nc1sc(CCC(=O)NCCCCCCNc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(CCCCNC(=O)c4ccccc4)cc3)ncnc12 |r|
Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1
Nc1nsc(n1)-c1ccccc1
Cc1nn(nc1C(N)=O)-c1ccccc1
O=C(NCc1ccccc1)c1ccc2nonc2c1
O=C(Nc1ccc2ccccc2n1)c1ccco1
Nc1ccc2nnc(-c3ccccc3)n2n1
CC(C)n1ncc2cc(cnc12)C(=O)NCc1ccco1
O=c1cc(NCc2ccccc2)nc2ccccn12
Nc1nc(ns1)-c1ccccc1
Cn1c(=O)[nH]c2ccccc2c1=O
CC(C)NC(=O)c1cc([nH]n1)-c1ccccc1
Nc1nc(N)nc(n1)-c1ccccc1
Nc1nsc(n1)-c1ccc(Cl)cc1
CS(=O)(=O)c1ccc(cc1)C(=O)Nc1cccc(Cl)c1
O=C(Nc1ccccc1)Nc1ccccn1
CCCCC#Cc1nc(N)c2nc(-c3cccs3)n([C@@H]3OC[C@@H](O)[C@H]3O)c2n1 |r|
Nc1nc(cn2c1nc1ccccc21)C(=O)NCc1ccccn1
Cc1cc(cc(Cl)n1)-c1nnc(N)nc1-c1ccc(F)cc1
Nc1nc(-c2ccco2)c2cnn(CCc3ccc(cc3)C(=O)Nc3ccccc3N)c2n1
Nc1nc(-c2ccco2)c2cnn(Cc3cccc(OCCCCCCC(=O)NO)c3)c2n1
Nc1nc(-c2ccco2)c2cnn(Cc3cccc(OCCCCCCC(=O)NO)n3)c2n1
[H][C@@]12C[C@]1([C@H](O)[C@H](O)[C@H]2CO)n1cnc2c(N)ncnc12
[H][C@]12C[C@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(N)ncnc12 |r|
CCOC(=O)C1=C(C)Nc2nc3cc(F)c(F)cc3n2C1c1ccco1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(F)c(F)cc3n2C1c1ccco1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(F)c(F)cc3n2C1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(F)c(F)cc3n2C1c1ccoc1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(F)c(F)cc3n2C1c1ccsc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Cl)c(Cl)cc3n2C1c1ccco1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(Cl)c(Cl)cc3n2C1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Cl)c(Cl)cc3n2C1c1ccsc1 |c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Br)c(Br)cc3n2C1c1ccco1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccc(F)cc3n2C1c1ccco1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccc(F)cc3n2C1c1ccco1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccc(F)cc3n2C1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccc(F)cc3n2C1c1ccoc1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccc(F)cc3n2C1c1ccsc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccc(F)cc3n2C1c1ccsc1 |c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3ccc(Cl)cc3n2C1c1ccco1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccc(Cl)cc3n2C1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccc(Br)cc3n2C1c1ccco1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccc(Br)cc3n2C1c1ccoc1 |c:5|
CCOC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2C1c1ccco1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2C1c1ccco1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2C1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2C1c1ccoc1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2C1c1cccs1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2C1c1cccs1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2C1c1ccsc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2C1c1ccsc1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2C1c1ccco1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2C1c1ccco1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2C1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2C1c1ccoc1 |c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2C1c1cccs1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2C1c1ccsc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2C1c1ccsc1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(Br)ccc3n2C1c1ccco1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Br)ccc3n2C1c1ccco1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(Br)ccc3n2C1c1ccoc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Br)ccc3n2C1c1ccoc1 |c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Br)ccc3n2C1c1cccs1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(Br)ccc3n2C1c1ccsc1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Br)ccc3n2C1c1ccsc1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccc(F)cc3n2C1c1cocn1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccc(F)cc3n2C1c1cocn1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3ccc(Cl)cc3n2C1c1cocn1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3ccc(Cl)cc3n2C1c1cocn1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2C1c1cocn1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2C1c1cocn1 |c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2C1c1cocn1 |c:5|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2C1c1cocn1 |c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3ccccc3n2[C@@H]1c1ccco1 |r,c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(F)ccc3n2[C@@H]1c1ccco1 |r,c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2[C@@H]1c1ccco1 |r,c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2[C@@H]1c1ccoc1 |r,c:6|
CC(C)OC(=O)C1=C(C)Nc2nc3cc(Br)ccc3n2[C@@H]1c1ccco1 |r,c:6|
CCOC(=O)C1=C(C)Nc2nc3cc(Br)ccc3n2[C@@H]1c1ccoc1 |r,c:5|
CCOC(=O)C1=C(C)Nc2nc3cc(Cl)ccc3n2[C@@H]1c1cocn1 |r,c:5|
CCCCC#Cc1nc(N)c2nc(-c3ccco3)n([C@@H]3OC[C@@H](O)[C@H]3O)c2n1 |r|
CCCCC#Cc1nc(N)c2nc(-c3ccco3)n([C@@H]3SC[C@@H](O)[C@H]3O)c2n1 |r|
Nc1nc(NCCc2ccc(O)cc2)nc2n([C@@H]3SC[C@@H](O)[C@H]3O)c(nc12)-c1ccco1 |r|
CNc1nc(NCCc2ccc(O)cc2)nc2n([C@@H]3SC[C@@H](O)[C@H]3O)c(nc12)-c1ccco1 |r|
Nc1nc(NCCc2ccc(O)cc2)nc2n([C@@H]3SC[C@@H](O)[C@H]3O)c(nc12)-c1cccs1 |r|
CNc1nc(NCCc2ccc(O)cc2)nc2n([C@@H]3SC[C@@H](O)[C@H]3O)c(nc12)-c1cccs1 |r|
COc1cccc2c3nc(nn3c(N)nc12)[C@H]1C[C@@H](C1)c1ncc(cc1Cl)C(C)(C)N |r,wU:18.23,wD:16.19,(9.46,1.16,;9.46,-.38,;8.13,-1.15,;8.13,-2.7,;6.8,-3.46,;5.47,-2.7,;5.47,-1.16,;4.13,-.39,;2.67,-.86,;1.76,.38,;2.67,1.63,;4.13,1.15,;5.47,1.92,;5.47,3.46,;6.8,1.15,;6.8,-.39,;.22,.38,;-.87,1.47,;-1.97,.37,;-.89,-.72,;-3.51,.37,;-4.29,-.97,;-5.82,-.97,;-6.59,.37,;-5.83,1.7,;-4.29,1.71,;-3.52,3.04,;-8.13,.37,;-9.46,1.14,;-8.9,-.97,;-8.13,1.91,)|
COc1cccc2c3nc(nn3c(N)nc12)C1CCC(C1)c1ccc(cn1)C(C)(C)N
CCCCC#Cc1nc2c(N)nc(-c3ccco3)nc2n1[C@@H]1SC[C@@H](O)[C@H]1O
CCCCC#Cc1nc2c(N)nc(-c3ccco3)nc2[nH]1
CCCCC#Cc1nc2c(NC)nc(-c3ccco3)nc2[nH]1
CCCCC#Cc1nc(N)c2nc(-c3ccco3)[nH]c2n1
Nc1nc(-c2ccco2)nc2c1nc(-c1ccco1)n2[C@@H]1OC[C@@H](O)[C@H]1O
Nc1nc(-c2ccco2)nc2[nH]c(-c3ccco3)nc12
Nc1nc(-c2cccs2)nc2[nH]c(-c3cccs3)nc12
CCCCC#Cc1nc2c(N)nc(-c3cccs3)nc2[nH]1
Nc1nc2c3ccccc3nc(-c3cccs3)n2n1
Nc1nc2c3cc(Br)ccc3nc(-c3ccccc3)n2n1