Compound Name

SMILES String

Nc1nc(Nc2ccccc2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|

CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NCC)c2n1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccco2)-n2cccn2)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccco2)-c2nccs2)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccco2)-n2nc(C)cc2C)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2cccn2)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nccc2C)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-c2nccs2)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2cccs2)-c2ccccn2)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-n2cccn2)-n2cccn2)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-n2nc(C)cc2C)-c2nccs2)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-n2nc(C)cc2C)-c2cnco2)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-n2nc(C)cc2C)-c2ocnc2C)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2nccs2)-n2cccn2)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccccn2)-n2cccn2)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccccn2)-n2nc(C)cc2C)CC1

CN1CCN(CC(=O)Nc2cc(nc(n2)-c2nccs2)-n2nc(C)cc2C)CC1

Nc1nc(NCCc2ccc(O)cc2)nc2nc(nn12)-c1ccco1

CCN1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)CC1

CN1CCCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)CC1

CN(C)C[C@H]1CCCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

CN(C)C[C@@H]1CCCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

CN(C)CC1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)CC1

CC(=O)N1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)CC1

Cc1cc(C)n(n1)-c1cc(NC(=O)CN2CCOCC2)nc(n1)-c1ccc(C)o1

Cc1cc(C)n(n1)-c1cc(NC(=O)CN2CCCOCC2)nc(n1)-c1ccc(C)o1

COC1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)CC1

CN1CCC(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)CC1

Cc1cc(C)n(n1)-c1cc(NC(=O)CN2CCCC2)nc(n1)-c1ccc(C)o1

CN(C)[C@H]1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

CN(C)[C@@H]1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

CC(C)O[C@H]1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

CCN[C@@H]1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

CCN[C@H]1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

CCN(CC)[C@H]1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

CN(C)C[C@H]1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

CN(C)C[C@@H]1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

CN(C)CCC(=O)Nc1cc(nc(n1)-c1ccc(C)o1)-n1nc(C)cc1C

CN(C)[C@H]1CCN(CCC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1 |r|

c1ccc(nc1)-c1nnc([nH]1)-c1ccccn1

Clc1cc(n[nH]1)-c1nc2ccccc2[nH]c1=O

c1ccc2[nH]c(nc2c1)-c1cnc2ccccc2n1

CCSc1cccc2nc([nH]c12)-c1cnc2ccccc2n1

Cc1cccc2[nH]c(nc12)-c1cnc2ccccc2n1

Cc1nc2c([nH]1)c1nc(C)[nH]c1c1nc(C)[nH]c21

CC1CSc2nc3nn[nH]c3c(=O)n12

CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C1CCCC1

CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12

CNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2nc(nc3NCc4cccc(c4)I)Cl)O)O

COc1cc(NC(C)=O)nc(SC)n1

CCC(=O)Nc1cc(OC)nc(SC)n1

CCCOc1cc(NC(C)=O)nc(SC)n1

CCCOc1cc(NC(=O)CC)nc(SC)n1

CCCSc1nc(NC(C)=O)cc(OC)n1

CCCSc1nc(NC(=O)CC)cc(OC)n1

CCCOc1cc(NC(C)=O)nc(SCCC)n1

CCCOc1cc(NC(=O)CC)nc(SCCC)n1

CCCOc1cc(NC(C)=O)nc(SCc2ccccc2)n1

CCCSc1nc(NC(C)=O)cc(OCc2ccccc2)n1

CCCSc1nc(NC(C)=O)cc(OCc2ccccc2Cl)n1

CCCSc1nc(NC(C)=O)cc(OCc2cccc(Cl)c2)n1

CCCSc1nc(NC(C)=O)cc(OCc2ccc(Cl)cc2)n1

CCCSc1nc(NC(C)=O)cc(OCc2ccc(Cl)cc2Cl)n1

CCCSc1nc(NC(C)=O)cc(OCc2ccc(OC)cc2)n1

CCCSc1nc(NC(C)=O)cc(OCCc2ccccc2)n1

CCCSc1nc(NC(C)=O)cc(OCC2CCCCC2)n1

CCSc1nc(NC(C)=O)cc(OCc2ccc(Cl)cc2)n1

CC(=O)Nc1cc(OCc2ccc(Cl)cc2)nc(SC(C)(C)C)n1

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1ccccc1

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cccnc1

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1ccncc1

COc1cccc(c1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C

COc1cccc(c1F)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C

COc1cc(OC)cc(c1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C

COc1cncc(c1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cncc(O)c1

COCCOc1cncc(c1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C

COc1cncc(c1)-c1cc(NC(=O)CN2CCOCC2)nc(n1)-n1nc(C)cc1C

CCC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cncc(OC)c1

COC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cncc(OC)c1

CCOC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cncc(OC)c1

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cc(ccn1)N1CCOCC1

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cncc(c1)N1CCOCC1

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1ccnc(c1)N1CCOCC1

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cccc(n1)N1CCOCC1

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cccc(N)n1

CN(C)c1cccc(n1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cccc(n1)N1CCCC1

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cccc(n1)N1CCCCC1

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cccc(n1)N1CCCOCC1

CN1CCN(CC1)c1cccc(n1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C

COCCN(C)c1cccc(n1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C

COC1CN(C1)c1cccc(n1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C

COC1CCN(CC1)c1cccc(n1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C

CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cccc(n1)N1CCC(O)CC1

Nc1nc(nc(n1)-c1ccco1)C(=O)NCc1ccccc1Cl

Cc1ccccc1CNC(=O)c1nc(N)nc(n1)-c1ccco1

Cc1cccc(CNC(=O)c2nc(N)nc(n2)-c2ccco2)c1

COc1ccccc1CNC(=O)c1nc(N)nc(n1)-c1ccco1

Nc1nc(nc(n1)-c1ccco1)C(=O)NCc1ccccn1

Nc1nc(nc(n1)-c1ccco1)C(=O)NCc1cccnc1

Nc1nc(nc(n1)-c1ccco1)C(=O)NCc1ccncc1

Cc1cccnc1CNC(=O)c1nc(N)nc(n1)-c1ccco1

COCc1cccc(CNC(=O)c2nc(N)nc(n2)-c2ccco2)n1

Cc1cccnc1CNC(=O)c1cc(N)nc(c1)-c1ccco1

Cc1cccnc1CNC(=O)c1cc(nc(N)n1)-c1ccco1

Nc1nc(cc(n1)-c1ccco1)C(=O)NCc1ccccn1

Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1ccccn1

Cc1csc(n1)-c1cc(nc(N)n1)C(=O)NCc1ccccn1

Nc1nc(cc(n1)-c1ccccc1)C(=O)NCc1ccccn1

Nc1nc(cc(n1)-c1ccccc1F)C(=O)NCc1ccccn1

Nc1nc(cc(n1)-c1cccc(F)c1)C(=O)NCc1ccccn1

Nc1nc(cc(n1)-c1ccccc1Cl)C(=O)NCc1ccccn1

Nc1nc(cc(n1)-c1cccc(Cl)c1)C(=O)NCc1ccccn1

Cc1ccccc1-c1cc(nc(N)n1)C(=O)NCc1ccccn1

Cc1cccc(c1)-c1cc(nc(N)n1)C(=O)NCc1ccccn1

Cc1ccc(cc1)-c1cc(nc(N)n1)C(=O)NCc1ccccn1

COc1ccccc1-c1cc(nc(N)n1)C(=O)NCc1ccccn1

COc1cccc(c1)-c1cc(nc(N)n1)C(=O)NCc1ccccn1

COc1ccc(cc1)-c1cc(nc(N)n1)C(=O)NCc1ccccn1

CCc1ccccc1-c1cc(nc(N)n1)C(=O)NCc1ccccn1

CCOc1ccccc1-c1cc(nc(N)n1)C(=O)NCc1ccccn1

Nc1nc(cc(n1)-c1ccccc1C#N)C(=O)NCc1ccccn1

Nc1nc(cc(n1)-c1cccc(c1)C#N)C(=O)NCc1ccccn1

COc1cc(nc(N)n1)C(=O)NCc1ccccn1

Cc1cccnc1CNC(=O)c1cc(nc(N)n1)-c1ccccc1F

Cc1cccnc1CNC(=O)c1cc(nc(N)n1)-c1cccc(F)c1

Cc1cccnc1CNC(=O)c1cc(nc(N)n1)-c1ccccc1Cl

Cc1cccnc1CNC(=O)c1cc(nc(N)n1)-c1cccc(Cl)c1

Cc1cccnc1CNC(=O)c1cc(nc(N)n1)-c1ccccc1C

Cc1cccc(c1)-c1cc(nc(N)n1)C(=O)NCc1ncccc1C

Cc1ccc(cc1)-c1cc(nc(N)n1)C(=O)NCc1ncccc1C

COc1ccccc1-c1cc(nc(N)n1)C(=O)NCc1ncccc1C

COc1cccc(c1)-c1cc(nc(N)n1)C(=O)NCc1ncccc1C

COc1ccc(cc1)-c1cc(nc(N)n1)C(=O)NCc1ncccc1C

CCc1ccccc1-c1cc(nc(N)n1)C(=O)NCc1ncccc1C

CCOc1ccccc1-c1cc(nc(N)n1)C(=O)NCc1ncccc1C

Cc1cccnc1CNC(=O)c1cc(nc(N)n1)-c1ccccc1C#N

Cc1cccnc1CNC(=O)c1cc(nc(N)n1)-c1cccc(c1)C#N

COc1cc(nc(N)n1)C(=O)NCc1ncccc1C

Cc1ccc(o1)-c1nc(N)nc(C(=O)NCc2ccccn2)c1C

CCc1c(nc(N)nc1-c1ccc(C)o1)C(=O)NCc1ccccn1

Cc1ccc(o1)-c1nc(N)nc(C(=O)NCc2ncccc2C)c1C

CCc1c(nc(N)nc1-c1ccc(C)o1)C(=O)NCc1ncccc1C

Cc1ccc(o1)-c1cc(ncn1)C(=O)NCc1ccccn1

Cc1ccc(o1)-c1cc(nc(C)n1)C(=O)NCc1ccccn1

CC(C)c1nc(cc(n1)-c1ccc(C)o1)C(=O)NCc1ccccn1

CNc1nc(cc(n1)-c1ccc(C)o1)C(=O)NCc1ccccn1

CN(C)c1nc(cc(n1)-c1ccc(C)o1)C(=O)NCc1ccccn1

Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1cccc(C)n1

Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1nc(C)ccc1C

Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1cc(C)cc(C)n1

Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1ccc(C)c(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)NCc1ncccc1C

Cc1cccnc1CNC(=O)c1cc(nc(N)n1)-c1nccs1

Cc1cccnc1CNC(=O)c1cc(nc(N)n1)-c1ccccc1

Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1ccc(C)n1C

Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1ncc[nH]1

CCn1ccnc1CNC(=O)c1cc(nc(N)n1)-c1ccc(C)o1

CCCn1ccnc1CNC(=O)c1cc(nc(N)n1)-c1ccc(C)o1

CC(C)n1ccnc1CNC(=O)c1cc(nc(N)n1)-c1ccc(C)o1

Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1cc(C)on1

Cc1ccc(o1)-c1cc(nc(N)n1)C(=O)NCc1csc(C)n1

c1cc(oc1)c2nc3c4cc(ccc4nc(n3n2)N)Cl

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|

Cc1ccccc1CNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

Nc1nc(Cl)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|

CSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)nc(F)nc12 |r|

Nc1nc(F)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

Nc1ncnc2n(cnc12)[C@@H]1O[C@H](Cl)[C@@H](O)[C@H]1O |r|

CSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)ncnc12 |r|

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(NC3CCCCC3)ncnc12

OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)nc(Cl)nc12 |r|

O[C@@H]1[C@@H](Cl)O[C@H]([C@@H]1O)n1cnc2c(NC3CCCC3)ncnc12 |r|

OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)ncnc12

c1(c(nc(c(n1)Cl)N)N)C(=O)NC(=N)N

NC(NC(=O)c1nc(Cl)c(N)nc1N)=NCc1ccccc1 |w:14.15|

NC(=N)NC(=O)c1nc(Cl)c(nc1N)N1CCCCCC1

CCNC(=O)[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCc3ccccc3)nc12

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(NC3CCCCC3)ncnc12

Nc1nc(Nc2ccccc2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@H](O)C1O

CCn1c2nc([nH]c2c(=O)n(CC)c1=O)-c1ccccc1

Cn1c2nc[nH]c2c(=O)n(C)c1=O

CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NCCN)cc1

CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(O)cc1

Cn1cnc2c1C(=O)NC(=O)N2C

CC(=O)Oc1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1

Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(O)cc1

Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccccc1

Cn1cnc2c1C(=O)N(C(=O)N2C)C

CN1c2c(n(cn2)C[C@@H](CO)O)C(=O)N(C1=O)C

CCCN1c2c([nH]cn2)C(=O)NC1=O

CCN(CC)CCn1cnc2n(C)c(=O)n(C)c(=O)c12

Cn1c2ncn(CCO)c2c(=O)n(C)c1=O

O=c1[nH]cnc2nc[nH]c12

CC(C)Cn1c2nc[nH]c2c(=O)n(C)c1=O

CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(Cl)cc1N

Cn1cnc2[nH]c(=O)n(C)c(=O)c12

CC(=O)CCCCN1C(=O)c2c(ncn2C)N(C1=O)C

CC(O)Cn1c(=O)n(C)c2ncn(C)c2c1=O

CC(O)Cn1cnc2n(C)c(=O)n(C)c(=O)c12

O=c1[nH]c2nc[nH]c2c(=O)[nH]1

CCn1c2nc[nH]c2c(=O)n(CC)c1=O

CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccccc1

CCCn1c2nc[nH]c2c(=O)n(CCC)c1=O

OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c1[nH]c(=O)n1ccnc21 |r|

CCCCn1c(=O)n(C)c2ncn(C)c2c1=O

CCn1c(=O)n(C)c2ncn(C)c2c1=O

Cn1c(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2nc1=O |r|

Cn1c(=O)[nH]c2nc[nH]c2c1=O

CNc1ncnc2n(cnc12)[C@H]1C[C@H](O)[C@@H](CO)O1 |r|

COc1ccc(cc1)-c1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|

CSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(Cl)nc12 |r|

C1=NC2=C(NC(=O)N=C2N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N

Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CI)[C@@H](O)[C@H]1O |r|

CSC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)O

CC(=O)OCC1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|

Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CON(=O)=O)[C@@H](O)[C@H]1O |r|

OC[C@H]1S[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cc(ccc3O)N(=O)=O)ncnc12 |r|

CN1c2c(n(cn2)CCCl)C(=O)N(C1=O)C

Nc1nccc2N(CSc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|

CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(N)cc1N

Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccccc1N

Cn1c2[nH]cnc2c(=O)n(C)c1=O

Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1cccs1

Cn1c2[nH]c(nc2c(=O)n(C)c1=O)C1CCOC1

Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(N)cc1

Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)C(O)=O

Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(Cl)cc1

COc1ccc(cc1)-c1nc2n(C)c(=O)n(C)c(=O)c2[nH]1

Cn1c2[nH]c(nc2c(=O)n(C)c1=O)-c1ccc(cc1)N(=O)=O

Cn1c2nc([nH]c2c(=O)n(C)c1=O)C1CCCC1

CCCc1nc2n(C)c(=O)n(C)c(=O)c2[nH]1

Cn1c2nc([nH]c2c(=O)n(C)c1=O)-c1ccc(cc1)S(O)(=O)=O

CN(C)CCCNS(=O)(=O)c1ccc(Cc2nc3n(C)c(=O)n(C)c(=O)c3[nH]2)cc1

Nc1nccc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|

NC(=O)CCOC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|

NC(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|

Nc1ncnc2n(cnc12)[C@@H]1O[C@H](NC(=O)C2CCCCC2)[C@@H](O)[C@H]1O |r|

Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CNC(=O)C2CC2)[C@@H](O)[C@H]1O |r|

CCC(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|

CC(=O)N[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|

O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1

CCCCNc1c(cnc2n(CC)ncc12)C(=O)OCC

Nc1nc(NCCO)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|

Nc1nc(NCCCO)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|

c1ccc(cc1)CNc2c3c(ncn2)n(cn3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O

OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCCC3)ncnc12 |r|

Nc1nc(NC2CCCC2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

Nc1ncnc2n(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|

C[C@@H](Cc1ccccc1)Nc1ncnc2n(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(NC34CCC(CC3)CC4c3ccc(Cl)cc3)ncnc12 |r,wU:7.8,5.5,wD:2.1,4.9,(5.66,1.76,;4.18,2.16,;3.15,1.02,;1.61,1.18,;.99,-.23,;2.13,-1.26,;1.97,-2.79,;3.47,-.49,;4.87,-1.12,;-.52,-.55,;-1.14,-1.96,;-2.68,-1.8,;-3,-.29,;-4.33,.48,;-5.66,-.29,;-5.66,-1.83,;-4.33,-2.6,;-4.33,-4.14,;-5.66,-4.91,;-6.1,-3.91,;-5.12,-3.14,;-7,-4.14,;-7,-2.6,;-8.18,-2.14,;-8.18,-.6,;-9.51,.17,;-10.85,-.6,;-12.05,.27,;-10.85,-2.14,;-9.51,-2.91,;-4.33,2.02,;-3,2.79,;-1.66,2.02,;-1.66,.48,)|

CCCCNc1c(C(=O)OCC)c(C)nc2n(CC)ncc12

OC[C@H]1CC[C@@H](O1)n1cnc2c(NC3CCCCC3)ncnc12 |r|

OC[C@@H]1CC[C@@H](O1)n1cnc2c(NC3CCCCC3)ncnc12 |r|

OCC1OC(C(O)C1O)n1cnc2c(NC3CCCC3)nc(Cl)nc12

CC(Cc1ccccc1)Nc1ncnc2n(cnc12)C1OC(CO)C(O)C1O

CN1CCC[C@H]1c1cc(C)no1 |r|

Cn1cc(C(=O)OCC2CCN(CCNS(C)(=O)=O)CC2)c2ccccc12

NC1=Nc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(N1)Sc1ccc(cc1)[N+]([O-])=O |r,t:1|

CCCCN1CN(CCCC)C2=NCN([C@H]3O[C@@H](CO)[C@H](O)[C@@H]3O)C2C1N |r,t:11|

O=c1n(C2CCCCC2)c2nc[nH]c2c(=O)n1C1CCCCC1

CCCN1CN(CCC)C2=NCN([C@H]3O[C@@H](CO)[C@H](O)[C@@H]3O)C2C1N |r,t:9|

Cn1cnc2c1[nH]c(=O)n(C)c2=O

c1nc(c2c(n1)n(cn2)[C@H]3C[C@@H]([C@H](O3)CO)O)N

CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc12

CCCn1c2nc[nH]c2c(=O)[nH]c1=S

c1nc(c2c(n1)n(cn2)[C@H]3[C@@H](C[C@H](O3)CO)O)N

Cn1cnc2c1n(C)c(=O)[nH]c2=O

NCC1OC(C(O)C1O)n1cnc2c(N)ncnc12

CC(C)CSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|

C[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)O

Nc1nc2n(cnc2c(=S)[nH]1)C1OC(CO)C(O)C1O

Cn1cnc2[nH]c(=O)[nH]c(=O)c12

Nc1ncnc2n(C3OC(CO)C(O)C3O)c(Br)nc12

Clc1nc2[nH]c(=O)[nH]c(=O)c2[nH]1

CCCn1c(=O)[nH]c2nc([nH]c2c1=O)C1CCCC1

CN1CNc2c1[nH]c(=O)[nH]c2=O

Nc1ncnc2n(c[n+]([O-])c12)C1OC(CO)C(O)C1O

c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N

Nc1ncnc2n(cnc12)[C@@]1(CO)O[C@H](CO)[C@@H](O)[C@H]1O |r|

Nc1ncnc2n(cnc12)[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O |r|

Nc1ccn([C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)c(=O)n1

CCCCCC[C@H]([C@H](C)O)n1cnc2c1ncnc2N

c1nc2c(n1[C@@H]3[C@H]([C@H]([C@@H](O3)COP(=O)(O)O)O)O)N=C(NC2=O)N

c1nc2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N=CNC2=O

CN(Cc1ccccc1)c1nc2n(cnc2c(=O)[nH]1)[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(NCc3ccccc3)N(O)C=Nc12 |r,c:26|

CCNC(=O)OC[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccccc3)ncnc12

CCNC(=O)OC[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2C(N)N(O)C=Nc12 |c:23|

CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c1nc[nH]c2=O |r|

C[S+](CC[C@H](N)C([O-])=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)O

OC1C(O)C(OC1COP([O-])(=O)OP(O)([O-])=O)n1ccc(=O)[nH]c1=O

OC1C(COP(O)(O)=O)OC(C1O)n1cnc2c1[nH]c(=O)[nH]c2=O

C(Oc1cccnc1)[C@@H]1CCN1 |r|

CCN1CCCC1CNC(=O)c1cc(c(N)cc1OC)S(=O)(=O)CC

CN1CCN(CC1)C1=c2ccccc2=Nc2ccc(Cl)cc2N1 |c:8,15|

c1cc(ccc1C(=O)CCCN2CCC(CC2)(c3ccc(cc3)Cl)O)F

Cc1ccc(Cn2nc(cc2-c2ccc(Cl)c(C)c2)C(=O)NC2[C@@]3(C)CCC(C3)C2(C)C)cc1 |r,TLB:21:22:28:26.25|

CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@@H]([C@H](O)C3O)C(=O)NCC)c2n1

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#CC(O)c1ccccc1

CCNC(=O)[C@H]1OC([C@@H](O)[C@H]1O)n1cnc2c(N)nc(nc12)C#CC(O)c1ccccc1

CCNC(=O)[C@@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)C#CC(O)c1ccccc1

CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccc(N)c(I)c3)ncnc12

CNC(=O)C1OC(C(O)C1O)n1cnc2c(NCc3cccc(I)c3)ncnc12

Nc1nc2n(CCc3ccccc3)ncc2c2nc(nn12)-c1ccco1

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#Cc1ccco1

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#Cc1nccs1

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#CC1=CCCCC1 |t:27|

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#Cc1ccc(cc1)C(N)=O

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#Cc1ccc(CCC(O)=O)cc1

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#CCCCC#N

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#CCCCc1ccccc1

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#CCC(C)O

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#CC(C)O

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)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#C[C@H](O)c1ccccc1 |r|

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#CC(C)(O)c1ccccc1

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#CCOc1ccccc1

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#Cc1ccccc1

CCCn1c(=O)n(Cc2ccc(N)c(I)c2)c2nc([nH]c2c1=O)-c1ccc(OCC(O)=O)cc1

CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(OC)cc1)n1nc(nc21)-c1ccco1

COc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(C)=O

CCc1c(nn(c1-c1ccc(Br)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1

ONC=Nc1ccc(N2CCOCC2)c(Cl)c1 |w:3.3|

CN1C2C(N(C)C(=O)N(C)C2=O)c2ccncc12

CN1C2C(Nc3cnccc23)C(=O)N(C)C1=O

CN1C2C(Nc3cccnc23)C(=O)N(C)C1=O

CN1C2C(N(C)C(=O)N(C)C2=O)c2ncccc12

Oc1c(Br)cc2[nH]c3cnccc3c2c1Br

CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(NCCc3ccc(CCC(O)=O)cc3)nc12

Nc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1

Fc1ccccc1Cn1nnc2c(NC(=O)C3CC3)nc(nc12)-c1ccccc1

Fc1ccccc1Cn1nnc2c(NC(=O)C3CCC3)nc(nc12)-c1ccccc1

Fc1ccccc1Cn1nnc2c(NC(=O)C3CCCC3)nc(nc12)-c1ccccc1

Fc1ccccc1Cn1nnc2c(NC(=O)C3CCCCC3)nc(nc12)-c1ccccc1

Fc1ccccc1Cn1nnc2c(NC(=O)c3ccco3)nc(nc12)-c1ccccc1

Fc1ccccc1Cn1nnc2c(NC(=O)c3ccoc3)nc(nc12)-c1ccccc1

Fc1ccccc1Cn1nnc2c(NC(=O)c3cccc(Cl)c3)nc(nc12)-c1ccccc1

Fc1cccc(c1)C(=O)Nc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1

[O-][N+](=O)c1cccc(c1)C(=O)Nc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1

[O-][N+](=O)c1ccc(cc1)C(=O)Nc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1

Fc1ccccc1Cn1nnc2c(NC(=O)c3ccc(I)cc3)nc(nc12)-c1ccccc1

Nc1ccc(cc1)C(=O)Nc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1

Cn1c(\C=C\c2ccc(Cl)cc2)nc2n(C)c(=O)n(C)c(=O)c12

Cn1c(\C=C\c2ccc(Cl)c(Cl)c2)nc2n(C)c(=O)n(C)c(=O)c12

Cn1c(\C=C\c2cccc(Br)c2)nc2n(C)c(=O)n(C)c(=O)c12

Cn1c(\C=C\c2ccc(Br)cc2)nc2n(C)c(=O)n(C)c(=O)c12

Cn1c(\C=C\c2cccc(c2)C(F)(F)F)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c(\C=C\c2cccc(Cl)c2)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c(\C=C\c2ccc(Cl)cc2)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c(\C=C\c2ccc(Cl)c(Cl)c2)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c(\C=C\c2cccc(Br)c2)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c(\C=C\c2ccc(Br)cc2)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c(\C=C\c2cccc(c2)C(F)(F)F)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c2nc(\C=C\c3cccc(Cl)c3)n(C)c2c(=O)n(CC)c1=O

CCn1c2nc(\C=C\c3cccc(Br)c3)n(C)c2c(=O)n(CC)c1=O

CCn1c2nc(\C=C\c3ccc(Br)cc3)n(C)c2c(=O)n(CC)c1=O

CCn1c2nc(\C=C\c3cccc(c3)C(F)(F)F)n(C)c2c(=O)n(CC)c1=O

CCn1c(\C=C\c2cccc(Cl)c2)nc2n(CC)c(=O)n(CC)c(=O)c12

CCn1c(\C=C\c2ccc(Cl)cc2)nc2n(CC)c(=O)n(CC)c(=O)c12

CCn1c(\C=C\c2ccc(Cl)c(Cl)c2)nc2n(CC)c(=O)n(CC)c(=O)c12

CCn1c(\C=C\c2cccc(Br)c2)nc2n(CC)c(=O)n(CC)c(=O)c12

CCn1c(\C=C\c2ccc(Br)cc2)nc2n(CC)c(=O)n(CC)c(=O)c12

CCn1c(\C=C\c2cccc(c2)C(F)(F)F)nc2n(CC)c(=O)n(CC)c(=O)c12

Cn1c(COc2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c(COc2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c2nc(COc3ccccc3)n(C)c2c(=O)n(CC)c1=O

CCn1c(COc2ccccc2)nc2n(CC)c(=O)n(CC)c(=O)c12

Cn1c(CCCc2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c(CCCc2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12

CCn1c2nc(CCCc3ccccc3)n(C)c2c(=O)n(CC)c1=O

CCn1c(CCCc2ccccc2)nc2n(CC)c(=O)n(CC)c(=O)c12

Nc1nc(nc(c1Br)-n1cccn1)-n1cccn1

Nc1nc(nc(N2CCCC2)c1Br)-n1cccn1

Nc1nc(nc(NC2CCCC2)c1Br)-n1cccn1

Nc1nc(nc(N2CCCCC2)c1Br)-n1cccn1

Nc1nc(nc(NC2CC2)c1Br)-n1cccn1

Nc1nc(nc(N2CCC2)c1Br)-n1cccn1

Nc1nc(nc(NC2CCC2)c1Br)-n1cccn1

CN(C)c1nc(nc(N)c1Br)-n1cccn1

COC[C@H]1CCCN1c1nc(nc(N)c1Br)-n1cccn1

CNc1nc(nc(N)c1Br)-n1cccn1

Nc1nc(nc(NCC2CC2)c1Br)-n1cccn1

CCSc1nc(nc(N)c1Br)-n1cccn1

CC(C)Sc1nc(nc(N)c1Br)-n1cccn1

Nc1nc(nc(OCC(F)(F)F)c1Br)-n1cccn1

Nc1nc(nc(c1Cl)-n1cccn1)-n1cccn1

Nc1nc(nc(c1C#N)-n1cccn1)-n1cccn1

Nc1nc(nc(-c2nccs2)c1Br)-c1nccs1

O=C1NC(=O)c2cc(SCc3ccccc3)ccc12

O=C1NC(=O)c2cc(SCCc3ccccc3)ccc12

Fc1ccc(CSc2ccc3C(=O)NC(=O)c3c2)cc1

C=CC(=O)Nc1cc2ccccc2oc1=O

Oc1c(NC(=O)C=C)c(=O)oc2ccccc12

O=C(Nc1cc2ccccc2oc1=O)c1ccccc1

Oc1c(NC(=O)c2ccccc2)c(=O)oc2ccccc12

O=C(Nc1cc2ccccc2oc1=O)c1cccnc1

O=C(Nc1cc2ccccc2oc1=O)c1cccs1

O=C(Nc1cc2ccccc2oc1=O)c1ccco1

OC1CS[C@H]([C@H]1O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12 |r|

OC1CS[C@H]([C@H]1O)n1cnc2c(NCc3ccccc3Cl)nc(Cl)nc12 |r|

COc1ccc(Cl)cc1CNc1nc(Cl)nc2n(cnc12)[C@@H]1SCC(O)[C@@H]1O |r|

OC1CS[C@H]([C@H]1O)n1cnc2c(NCc3cccc(F)c3)ncnc12 |r|

OC1CS[C@H]([C@H]1O)n1cnc2c(NCc3cccc(Cl)c3)ncnc12 |r|

OC1CS[C@H]([C@H]1O)n1cnc2c(NCc3cccc(Br)c3)ncnc12 |r|

OC1CS[C@H]([C@H]1O)n1cnc2c(NCc3cccc(I)c3)ncnc12 |r|

OC1CS[C@H]([C@H]1O)n1cnc2c(NCc3cccc(F)c3)nc(Cl)nc12 |r|

OC1CS[C@H]([C@H]1O)n1cnc2c(NCc3cccc(Cl)c3)nc(Cl)nc12 |r|

OC1CS[C@H]([C@H]1O)n1cnc2c(NCc3cccc(Br)c3)nc(Cl)nc12 |r|

COc1ccccc1CNc1nc(Cl)nc2n(cnc12)[C@@H]1SCC(O)[C@@H]1O |r|

OC1CS[C@H]([C@H]1O)n1cnc2c(NCc3cccc4ccccc34)nc(Cl)nc12 |r|

CNc1nc(Cl)nc2n(cnc12)[C@@H]1SCC(O)[C@@H]1O |r|

OC1CO[C@H]([C@H]1O)n1cnc2c(NCc3cccc(Br)c3)nc(Cl)nc12 |r|

OC1CO[C@H]([C@H]1O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12 |r|

CCN(C1CCCCC1)C(=O)c1ccc(cc1)C(=O)c1cnc2ccc(cn12)[N+]#[C-]

CCN(C1CCCCC1)C(=O)c1ccc(cc1)C(=O)c1cnc2ccc(Br)cn12

Fc1ccc2ncc(C(=O)c3ccc(cc3)C(=O)N3CCCCCC3)n2c1

CCN(C1CCCCC1)C(=O)c1ccc(nc1)C(=O)c1cnc2ccccn12

CCN(C1CCCCC1)C(=O)c1ccc(cc1Cl)C(=O)c1cnc2ccc(F)cn12

Nc1cc(ccc1C(=O)c1cnc2ccc(F)cn12)C(=O)N1CCCCCC1

O=C(N(C1CCCCC1)C1CCCCC1)c1ccc(cc1)C(=O)c1cnc2ccccn12

CCN(C(=O)c1ccc(cc1)C(=O)c1cnc2ccccn12)c1ccccc1

O=C(N1CCCc2ccccc12)c1ccc(cc1)C(=O)c1cnc2ccccn12

Cn1nc(-c2cnc3ccc(F)cn23)c2ccc(cc12)C(=O)N1CCCCCC1

Cn1nc(-c2cnc3ccc(cn23)C(F)(F)F)c2ccc(cc12)C(=O)N1CCCCCC1

Cn1nc(-c2cnc3ccc(F)cn23)c2ccc(cc12)C(=O)N1CCCCCCC1

COC[C@H]1CCCN1C(=O)c1ccc2c(nn(C)c2c1)-c1cnc2ccc(cn12)C#N |r|

Fc1ccc2ncc(-c3nn(Cc4ccccc4)c4cc(ccc34)C(=O)N3CCCCCC3)n2c1

CN1CCN(CC1)C(=O)n1nc(-c2cnc3ccc(F)cn23)c2ccc(cc12)C(=O)N1CCCCCC1

Fc1ccc2ncc(-c3noc4cc(ccc34)C(=O)N3CCCCCC3)n2c1

O=C(N1CCOCC1)c1ccc2c(noc2c1)-c1cnc2ccc(cn12)[N+]#[C-]

CCN(C1CCCCC1)C(=O)c1ccc2nc(oc2c1)-c1cnc2ccccn12

Fc1ccc2ncc(-n3nnc4cc(ccc34)C(=O)N3CCCCCC3)n2c1

Fc1ccc2ncc(-c3c[nH]c4cc(ccc34)C(=O)N3CCCCCC3)n2c1

Nc1nc(-c2cnc3ccc(F)cn23)c2ccc(cc2n1)C(=O)N1CCCCCC1

CCN(C1CCCCC1)C(=O)c1ccc(cc1)C(=O)c1cnc2ccc(Cl)nn12

Cn1cc2c(n1)nc(NC(=O)CCCc1cn(CCCCCCNC(=O)c3ccc(c(c3)C([O-])=O)-c3c4ccc(N)c(c4oc4c(c(=[NH2+])ccc34)S([O-])(=O)=O)S([O-])(=O)=O)nn1)n1nc(nc21)-c1ccco1 |(-14.96,-7.91,;-14.19,-6.57,;-12.7,-6.18,;-12.62,-4.64,;-13.96,-3.87,;-15.03,-5.28,;-13.96,-2.33,;-12.62,-1.56,;-12.62,-.02,;-11.29,.75,;-11.29,2.29,;-9.95,-.02,;-8.62,.75,;-7.29,-.02,;-5.95,.75,;-4.49,.28,;-3.58,1.52,;-2.1,1.12,;-1.7,-.36,;-.16,-.36,;.61,.97,;-.16,2.3,;.61,3.64,;2.15,3.64,;2.92,2.3,;2.15,.97,;4.46,2.3,;5.23,3.64,;6.77,3.64,;7.54,2.3,;6.77,.97,;5.23,.97,;7.54,-.36,;6.21,-1.13,;8.88,-1.13,;9.08,2.3,;9.85,3.64,;9.08,4.97,;9.85,6.3,;11.39,6.3,;12.16,7.64,;12.16,4.97,;11.39,3.64,;12.16,2.3,;11.39,.97,;12.16,-.36,;11.39,-1.7,;12.16,-3.03,;9.85,-1.7,;9.08,-.36,;9.85,.97,;13.7,-.36,;15.04,-1.13,;14.47,.97,;13.7,-1.9,;13.7,4.97,;15.04,4.2,;14.47,6.3,;13.7,3.43,;-4.49,2.77,;-5.95,2.29,;-11.29,-2.33,;-9.82,-1.85,;-8.92,-3.1,;-9.82,-4.34,;-11.29,-3.87,;-7.38,-3.1,;-6.47,-4.34,;-5.01,-3.87,;-5.01,-2.33,;-6.47,-1.85,)|

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

Cn1c(nc2c(N)nc(CCCCO)nc12)-n1nccn1

CC(O)CCc1nc(N)c2nc(-n3nccn3)n(C)c2n1

C[C@H](O)CCc1nc(N)c2nc(-n3nccn3)n(C)c2n1

C[C@@H](O)CCc1nc(N)c2nc(-n3nccn3)n(C)c2n1

CCCC(O)c1nc(N)c2nc(-n3nccn3)n(C)c2n1

CCCC(=O)c1nc(N)c2nc(-n3nccn3)n(C)c2n1

CC(=O)CCc1nc(N)c2nc(-n3nccn3)n(C)c2n1

Nc1nc(Cl)nc2n(cnc12)[C@]12C[C@H]1[C@@H](O)[C@@H](O)C2 |r|

O[C@H]1C[C@]2(C[C@H]2[C@H]1O)n1cnc2c(NC3CC3)nc(Cl)nc12 |r|

O[C@H]1C[C@]2(C[C@H]2[C@H]1O)n1cnc2c(NC3CCC3)nc(Cl)nc12 |r|

O[C@H]1C[C@]2(C[C@H]2[C@H]1O)n1cnc2c(NC3CCCCC3)nc(Cl)nc12 |r|

O[C@H]1C[C@]2(C[C@H]2[C@H]1O)n1cnc2c(NC3CCCCCC3)nc(Cl)nc12 |r|

O[C@H]1C[C@]2(C[C@H]2[C@H]1O)n1cnc2c(NC3CC4CCC3C4)nc(Cl)nc12 |r,TLB:13:14:18.17:20|

O[C@H]1C[C@]2(C[C@H]2[C@H]1O)n1cnc2c(NC3CC4CCC3C4)nc(Cl)nc12 |r,THB:13:14:18.17:20|

CCC(CC)Nc1nc(Cl)nc2n(cnc12)[C@]12C[C@H]1[C@@H](O)[C@@H](O)C2 |r|

O[C@H]1C[C@]2(C[C@H]2[C@H]1O)n1cnc2c(NCC3CC3)nc(Cl)nc12 |r|

O[C@H]1C[C@]2(C[C@H]2[C@H]1O)n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12 |r|

OCc1cc(F)c(F)cc1CNc1nc(Cl)nc2n(cnc12)[C@]12C[C@H]1[C@@H](O)[C@@H](O)C2 |r|

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

CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@H](CCl)[C@@H](O)[C@H]3O)c2n1 |r|

CCCCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|

CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NC3CC3)c2n1 |r|

CCCCC#Cc1nc(N)c2ncn(C3O[C@H](CNC(C)=O)[C@@H](O)[C@H]3O)c2n1 |r|

CCCCC#Cc1nc(N)c2ncn(C3O[C@H](CNC(=O)NC)[C@@H](O)[C@H]3O)c2n1 |r|

CCCCC#Cc1nc(N)c2ncn(C3O[C@H](CNS(C)(=O)=O)[C@@H](O)[C@H]3O)c2n1 |r|

CCCCC#Cc1nc(N)c2ncn(C3O[C@H](CNC(=S)NC)[C@@H](O)[C@H]3O)c2n1 |r|

CCCCC#Cc1nc(N)c2ncn(C3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NC)c2n1 |r|

CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NC(C)C)c2n1 |r|

COc1cc(OC)cc(c1)C(CNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccccc1C |r|

CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1

CCCCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)C#CCCCC |r|

CCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)O

CNC(=O)C1OC(C(O)C1O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12

CCCOc1cc(N)nc(SCc2ccccc2)n1

CC(C)COc1cc(N)nc(SCc2ccccc2)n1

Nc1cc(OCc2ccccc2)nc(SCc2ccccc2)n1

c1cnc2c(c1N)ncn2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O

Nc1nc(=O)[nH]c2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|

Cn1cc2c(n1)nc(NNC(=S)Nc1ccc(c(c1)C([O-])=O)-c1c3ccc(O)cc3oc3cc(=O)ccc13)n1nc(nc21)-c1ccco1 |(-8.77,7.25,;-7.29,7.65,;-6.09,6.68,;-4.8,7.52,;-5.2,9.01,;-6.73,9.09,;-4.11,10.1,;-2.62,9.7,;-1.53,10.79,;-.04,10.8,;1.54,11.35,;1.8,13.1,;2.92,10.3,;4.46,10.3,;5.23,11.63,;6.77,11.63,;7.54,10.3,;6.77,8.97,;5.23,8.97,;7.54,7.63,;6.77,6.3,;8.88,6.86,;9.08,10.3,;9.85,11.63,;9.08,12.97,;9.85,14.3,;11.39,14.3,;12.16,15.63,;12.16,12.97,;11.39,11.63,;12.16,10.3,;11.39,8.97,;12.16,7.63,;11.39,6.3,;12.16,4.96,;9.85,6.3,;9.08,7.63,;9.85,8.97,;-2.22,8.21,;-.85,7.51,;-1.09,5.99,;-2.61,5.75,;-3.31,7.12,;-0,4.9,;-.24,3.38,;1.13,2.68,;2.22,3.77,;1.52,5.14,)|

Cn1cc2c(n1)nc(NCCCNC(=S)Nc1ccc(c(c1)C([O-])=O)-c1c3ccc(O)cc3oc3cc(=O)ccc13)n1nc(nc21)-c1ccco1 |(-12.31,7.32,;-10.82,7.71,;-9.63,6.75,;-8.34,7.58,;-8.73,9.07,;-10.27,9.15,;-7.65,10.16,;-6.16,9.76,;-5.07,10.85,;-3.78,9.94,;-2.65,10.93,;-.85,10.43,;-.08,11.76,;1.46,11.76,;1.55,13.35,;2.92,10.22,;4.46,10.3,;5.23,11.63,;6.77,11.63,;7.54,10.3,;6.77,8.97,;5.23,8.97,;7.54,7.63,;6.77,6.3,;8.88,6.86,;9.08,10.3,;9.85,11.63,;9.08,12.97,;9.85,14.3,;11.39,14.3,;12.16,15.63,;12.16,12.97,;11.39,11.63,;12.16,10.3,;11.39,8.97,;12.16,7.63,;11.39,6.3,;12.16,4.96,;9.85,6.3,;9.08,7.63,;9.85,8.97,;-5.76,8.27,;-4.39,7.58,;-4.63,6.05,;-6.15,5.81,;-6.85,7.19,;-3.54,4.97,;-3.78,3.44,;-2.41,2.75,;-1.32,3.83,;-2.02,5.21,)|

Cn1cc2c(n1)nc(NCCCCNC(=S)Nc1ccc(c(c1)C([O-])=O)-c1c3ccc(O)cc3oc3cc(=O)ccc13)n1nc(nc21)-c1ccco1 |(-13.71,11.93,;-12.17,11.93,;-11.27,10.68,;-9.8,11.16,;-9.8,12.7,;-11.27,13.17,;-8.47,13.47,;-7.13,12.7,;-5.67,13.94,;-4.49,12.57,;-2.83,13.27,;-1.87,12.04,;-.48,12.72,;.61,11.63,;2.15,11.63,;2.55,13.12,;2.92,10.3,;4.46,10.3,;5.23,11.63,;6.77,11.63,;7.54,10.3,;6.77,8.97,;5.23,8.97,;7.54,7.63,;6.77,6.3,;8.88,6.86,;9.08,10.3,;9.85,11.63,;9.08,12.97,;9.85,14.3,;11.39,14.3,;12.16,15.63,;12.16,12.97,;11.39,11.63,;12.16,10.3,;11.39,8.97,;12.16,7.63,;11.39,6.3,;12.16,4.96,;9.85,6.3,;9.08,7.63,;9.85,8.97,;-7.13,11.16,;-5.99,10.12,;-6.62,8.72,;-8.15,8.88,;-8.47,10.39,;-5.85,7.38,;-6.47,5.98,;-5.33,4.95,;-3.99,5.72,;-4.31,7.22,)|

Cn1cc2c(n1)nc(NCCCCCNC(=S)Nc1ccc(c(c1)C([O-])=O)-c1c3ccc(O)cc3oc3cc(=O)ccc13)n1nc(nc21)-c1ccco1 |(-9.19,22.76,;-8.42,21.43,;-9.05,20.02,;-7.9,18.99,;-6.57,19.76,;-6.89,21.26,;-5.24,18.99,;-5.24,17.45,;-3.9,16.68,;-4.19,14.81,;-2.9,14.11,;-3.35,12.53,;-2.26,11.44,;-.93,12.21,;.16,11.13,;1.7,11.76,;1.88,13.43,;3.01,10.22,;4.46,10.3,;5.23,11.63,;6.77,11.63,;7.54,10.3,;6.77,8.97,;5.23,8.97,;7.54,7.63,;6.77,6.3,;8.88,6.86,;9.08,10.3,;9.85,11.63,;9.08,12.97,;9.85,14.3,;11.39,14.3,;12.16,15.63,;12.16,12.97,;11.39,11.63,;12.16,10.3,;11.39,8.97,;12.16,7.63,;11.39,6.3,;12.16,4.96,;9.85,6.3,;9.08,7.63,;9.85,8.97,;-6.57,16.68,;-6.89,15.17,;-8.42,15.01,;-9.05,16.42,;-7.9,17.45,;-9.19,13.68,;-10.72,13.52,;-11.04,12.01,;-9.71,11.24,;-8.57,12.27,)|

Cn1cc2c(n1)nc(NCCCOCCOOCCCCCNC(=S)Nc1ccc(c(c1)C([O-])=O)-c1c3ccc(O)cc3oc3cc(=O)ccc13)n1nc(nc21)-c1ccco1 |(-23.37,6.89,;-21.88,7.29,;-20.69,6.32,;-19.4,7.16,;-19.79,8.65,;-21.33,8.73,;-18.7,9.74,;-17.22,9.34,;-16.13,10.43,;-15.04,9.34,;-13.95,10.43,;-12.86,9.34,;-11.77,10.43,;-10.68,9.34,;-9.35,10.11,;-8.26,9.02,;-6.93,9.79,;-5.59,8.85,;-4.5,10.02,;-3.25,9.02,;-2,9.93,;-.67,8.59,;.67,9.36,;2.15,8.97,;2.15,7.43,;2.92,10.3,;4.46,10.3,;5.23,11.63,;6.77,11.63,;7.54,10.3,;6.77,8.97,;5.23,8.97,;7.54,7.63,;6.77,6.3,;8.88,6.86,;9.08,10.3,;9.85,11.63,;9.08,12.97,;9.85,14.3,;11.39,14.3,;12.16,15.63,;12.16,12.97,;11.39,11.63,;12.16,10.3,;11.39,8.97,;12.16,7.63,;11.39,6.3,;12.16,4.96,;9.85,6.3,;9.08,7.63,;9.85,8.97,;-16.82,7.85,;-15.45,7.15,;-15.69,5.63,;-17.21,5.39,;-17.91,6.76,;-14.6,4.54,;-14.84,3.02,;-13.47,2.32,;-12.38,3.41,;-13.08,4.78,)|

Nc1nc2cccc(Cl)c2c2nc(nn12)-c1ccco1

Clc1cccc2nc(NC(=O)CCCC#C)n3nc(nc3c12)-c1ccco1

Nc1ccc2c(-c3ccc(cc3C([O-])=O)C(=O)NCCCCCCn3cc(CCCC(=O)Nc4nc5ccc(Cl)cc5c5nc(nn45)-c4ccco4)nn3)c3ccc(=[NH2+])c(c3oc2c1S([O-])(=O)=O)S([O-])(=O)=O |(12.16,7.64,;11.39,6.3,;9.85,6.3,;9.08,4.97,;9.85,3.64,;9.08,2.3,;7.54,2.3,;6.77,3.64,;5.23,3.64,;4.46,2.3,;5.23,.97,;6.77,.97,;7.54,-.36,;6.21,-1.13,;8.88,-1.13,;2.92,2.3,;2.15,.97,;2.15,3.64,;.61,3.64,;-.16,2.3,;.61,.97,;-.16,-.36,;-1.7,-.36,;-2.1,1.12,;-3.58,1.52,;-4.49,.28,;-5.95,.75,;-7.29,-.02,;-8.62,.75,;-9.95,-.02,;-11.29,.75,;-11.29,2.29,;-12.62,-.02,;-12.62,-1.56,;-13.96,-2.33,;-13.96,-3.87,;-15.29,-4.64,;-15.29,-6.18,;-13.96,-6.95,;-13.96,-8.49,;-12.62,-6.18,;-12.62,-4.64,;-11.29,-3.87,;-9.82,-4.34,;-8.92,-3.1,;-9.82,-1.85,;-11.29,-2.33,;-7.38,-3.1,;-6.47,-4.34,;-5.01,-3.87,;-5.01,-2.33,;-6.47,-1.85,;-5.95,2.29,;-4.49,2.77,;9.85,.97,;9.08,-.36,;9.85,-1.7,;11.39,-1.7,;12.16,-3.03,;12.16,-.36,;11.39,.97,;12.16,2.3,;11.39,3.64,;12.16,4.97,;13.7,4.97,;15.04,4.2,;14.47,6.3,;13.7,3.43,;13.7,-.36,;15.04,-1.13,;14.47,.97,;13.7,-1.9,)|

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(O)=O)cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCC(=O)OC(C)(C)C)cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCCC(=O)OC(C)(C)C)cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCCCC(=O)OC(C)(C)C)cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCOOCCCCC(=O)OC(C)(C)C)cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCOCCOOCCCCCNC(=O)OC(C)(C)C)cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCC[NH3+])cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCC[NH3+])cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCCC[NH3+])cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCOOCCCC[NH3+])cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCOCCOOCCCCC[NH3+])cc1)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCNC(=S)Nc3ccc(c(c3)C([O-])=O)-c3c4ccc(O)cc4oc4cc(=O)ccc34)cc1)n1nc(nc21)-c1ccco1 |(-13.81,8.24,;-12.32,8.64,;-11.12,7.67,;-9.83,8.51,;-10.23,10,;-11.77,10.08,;-9.14,11.09,;-7.65,10.69,;-6.56,11.78,;-4.83,11.02,;-4.83,9.48,;-3.82,12.08,;-2.28,12.08,;-2.28,13.62,;-.95,14.39,;.39,13.62,;1.49,13.8,;1.87,15.06,;1,16.09,;3.21,15.83,;4.54,15.06,;5.87,15.83,;7.21,15.06,;8.3,16.15,;9.39,15.06,;9.39,13.52,;10.48,16.15,;11.56,15.06,;12.9,15.83,;14.23,15.06,;14.23,13.52,;12.9,12.75,;11.56,13.52,;12.9,11.21,;14.44,11.21,;13.99,12.3,;15.57,12.75,;15.57,11.21,;14.23,10.44,;14.23,8.9,;15.57,8.13,;15.57,6.59,;16.9,8.9,;16.9,10.44,;18.23,11.21,;18.23,12.75,;19.57,13.52,;19.57,15.06,;20.66,16.15,;18.23,15.83,;16.9,15.06,;16.9,13.52,;.39,12.08,;-.95,11.31,;-7.25,9.2,;-5.88,8.5,;-6.12,6.98,;-7.64,6.74,;-8.34,8.11,;-5.03,5.89,;-5.27,4.37,;-3.9,3.67,;-2.81,4.76,;-3.51,6.13,)|

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCCNC(=S)Nc3ccc(c(c3)C([O-])=O)-c3c4ccc(O)cc4oc4cc(=O)ccc34)cc1)n1nc(nc21)-c1ccco1 |(-13.81,8.24,;-12.32,8.64,;-11.12,7.67,;-9.83,8.51,;-10.23,10,;-11.77,10.08,;-9.14,11.09,;-7.65,10.69,;-6.56,11.78,;-4.83,11.02,;-4.83,9.48,;-3.82,12.08,;-2.28,12.08,;-2.28,13.62,;-.95,14.39,;.39,13.62,;1.49,13.8,;1.87,15.06,;1.3,16.17,;3.5,14.88,;4.1,16.23,;5.24,15.44,;6.24,16.34,;7.13,15.43,;8.3,16.15,;9.39,15.06,;9.39,13.52,;10.48,16.15,;11.56,15.06,;12.9,15.83,;14.23,15.06,;14.23,13.52,;12.9,12.75,;11.56,13.52,;12.9,11.21,;14.44,11.21,;13.99,12.3,;15.57,12.75,;15.57,11.21,;14.23,10.44,;14.23,8.9,;15.57,8.13,;15.57,6.59,;16.9,8.9,;16.9,10.44,;18.23,11.21,;18.23,12.75,;19.57,13.52,;19.57,15.06,;20.66,16.15,;18.23,15.83,;16.9,15.06,;16.9,13.52,;.39,12.08,;-.95,11.31,;-7.25,9.2,;-5.88,8.5,;-6.12,6.98,;-7.64,6.74,;-8.34,8.11,;-5.03,5.89,;-5.27,4.37,;-3.9,3.67,;-2.81,4.76,;-3.51,6.13,)|

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCCCNC(=S)Nc3ccc(c(c3)C([O-])=O)-c3c4ccc(O)cc4oc4cc(=O)ccc34)cc1)n1nc(nc21)-c1ccco1 |(-13.81,8.24,;-12.32,8.64,;-11.12,7.67,;-9.83,8.51,;-10.23,10,;-11.77,10.08,;-9.14,11.09,;-7.65,10.69,;-6.56,11.78,;-4.83,11.02,;-4.83,9.48,;-3.82,12.08,;-2.28,12.08,;-2.28,13.62,;-.95,14.39,;.39,13.62,;.54,15.04,;1.87,15.06,;2.69,13.75,;2.84,16.56,;4.39,16.16,;4.94,17.64,;6.91,16.97,;8.07,18.25,;9.48,17.48,;10.86,18.35,;11.95,17.26,;11.95,15.72,;13.04,18.35,;14.13,17.26,;15.46,18.03,;16.8,17.26,;16.8,15.72,;15.46,14.95,;14.13,15.72,;15.46,13.41,;17,13.41,;16.55,14.5,;18.13,14.95,;18.13,13.41,;16.8,12.64,;16.8,11.1,;18.13,10.33,;18.13,8.79,;19.47,11.1,;19.47,12.64,;20.8,13.41,;20.8,14.95,;22.13,15.72,;22.13,17.26,;23.22,18.35,;20.8,18.03,;19.47,17.26,;19.47,15.72,;.39,12.08,;-.95,11.31,;-7.25,9.2,;-5.88,8.5,;-6.12,6.98,;-7.64,6.74,;-8.34,8.11,;-5.03,5.89,;-5.27,4.37,;-3.9,3.67,;-2.81,4.76,;-3.51,6.13,)|

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCOOCCCCNC(=S)Nc3ccc(c(c3)C([O-])=O)-c3c4ccc(O)cc4oc4cc(=O)ccc34)cc1)n1nc(nc21)-c1ccco1 |(-13.81,8.24,;-12.32,8.64,;-11.12,7.67,;-9.83,8.51,;-10.23,10,;-11.77,10.08,;-9.14,11.09,;-7.65,10.69,;-6.56,11.78,;-4.83,11.02,;-4.83,9.48,;-3.82,12.08,;-2.28,12.08,;-2.28,13.62,;-.95,14.39,;.39,13.62,;1.49,13.8,;1.87,15.06,;1,16.09,;3.21,15.83,;4.54,14.84,;5.87,15.83,;7.4,14.96,;8.46,15.79,;9.79,15.02,;11.12,15.79,;12.36,15,;13.74,16.01,;15.58,14.84,;16.66,13.75,;16.66,12.21,;17.75,14.84,;18.84,13.75,;20.18,14.52,;21.51,13.75,;21.51,12.21,;20.18,11.44,;18.84,12.21,;20.18,9.9,;21.72,9.9,;21.27,10.99,;22.84,11.44,;22.84,9.9,;21.51,9.13,;21.51,7.59,;22.84,6.82,;22.84,5.28,;24.18,7.59,;24.18,9.13,;25.51,9.9,;25.51,11.44,;26.84,12.21,;26.84,13.75,;27.93,14.84,;25.51,14.52,;24.18,13.75,;24.18,12.21,;.39,12.08,;-.95,11.31,;-7.25,9.2,;-5.88,8.5,;-6.12,6.98,;-7.64,6.74,;-8.34,8.11,;-5.03,5.89,;-5.27,4.37,;-3.9,3.67,;-2.81,4.76,;-3.51,6.13,)|

Cn1cc2c(n1)nc(NC(=O)Nc1ccc(CC(=O)NCCCOCCOOCCCCCNC(=S)Nc3ccc(c(c3)C([O-])=O)-c3c4ccc(O)cc4oc4cc(=O)ccc34)cc1)n1nc(nc21)-c1ccco1 |(-13.81,8.24,;-12.32,8.64,;-11.12,7.67,;-9.83,8.51,;-10.23,10,;-11.77,10.08,;-9.14,11.09,;-7.65,10.69,;-6.56,11.78,;-4.83,11.02,;-4.83,9.48,;-3.82,12.08,;-2.28,12.08,;-2.28,13.62,;-.95,14.39,;.39,13.62,;1.49,13.8,;1.87,15.06,;1,16.09,;3.21,15.83,;4.42,14.72,;5.68,15.41,;6.86,14.5,;8.57,15.56,;10.55,14.77,;12.03,15.83,;14.15,14.81,;15.2,15.65,;16.54,14.88,;17.87,15.65,;19.1,14.85,;20.78,15.65,;22.11,14.88,;23.57,15.8,;24.66,14.71,;24.66,13.17,;25.75,15.8,;26.84,14.71,;28.17,15.48,;29.5,14.71,;29.5,13.17,;28.17,12.4,;26.84,13.17,;28.17,10.86,;29.71,10.86,;29.26,11.94,;30.84,12.4,;30.84,10.86,;29.5,10.09,;29.5,8.55,;30.84,7.78,;30.84,6.24,;32.17,8.55,;32.17,10.09,;33.5,10.86,;33.5,12.4,;34.84,13.17,;34.84,14.71,;35.93,15.8,;33.5,15.48,;32.17,14.71,;32.17,13.17,;.39,12.08,;-.95,11.31,;-7.25,9.2,;-5.88,8.5,;-6.12,6.98,;-7.64,6.74,;-8.34,8.11,;-5.03,5.89,;-5.27,4.37,;-3.9,3.67,;-2.81,4.76,;-3.51,6.13,)|

Cn1cc2c(n1)nc(NC(=O)CCC#C)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)CCCC#C)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)CCCCC#C)n1nc(nc21)-c1ccco1

Cn1cc2c(n1)nc(NC(=O)CCCCCC#C)n1nc(nc21)-c1ccco1

C1CCC(C1)c1nc2c(Nc3ccccc3)nc3ccccc3c2[nH]1

Cc1ccc(Nc2nc3ccccc3c3[nH]c(nc23)C2CCCC2)cc1

COc1ccc(Nc2nc3ccccc3c3[nH]c(nc23)C2CCCC2)cc1

Clc1ccc(Nc2nc3ccccc3c3[nH]c(nc23)C2CCCC2)cc1Cl

Clc1ccc(Nc2nc3ccccc3c3[nH]c(nc23)C2CCCC2)cc1

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

COc1cccc2c(nc(N)nc12)C(=O)NCc1nc(ccc1C)C(C)(C)O

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(n1)C(C)(O)C(F)(F)F |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(n1)C1(O)CCC1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(n1)C(C)C

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(n1)C1CCC1

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(n1)C1CC1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(n1)-c1cccc(O)c1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(n1)C(C)(C)O

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(n1)-c1ccccn1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1nc(C)ccc1C |$;;;;;;;;;;;;;;;HN;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc2cccnc12

CCn1cccc(CNC(=O)c2nc(N)nc3c(OC)cccc23)c1=O |$;;;;;;;;HN;;;;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(CO)n1

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(C)n1

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc2ccncc12 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(C)c1 |$;;;;;;;;;;;;;;;HN;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(n1)C(F)(F)F

COc1cccc2c(nc(N)nc12)C(=O)NCc1ncccc1C(F)(F)F |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1nc(C)ccc1F |$;;;;;;;;;;;;;;;HN;;;;;;;;;$|

COc1cccc(CNC(=O)c2nc(N)nc3c(OC)cccc23)n1

COc1ccc(CNC(=O)c2nc(N)nc3c(OC)cccc23)nc1

COc1cccnc1CNC(=O)c1nc(N)nc2c(OC)cccc12

COc1cccc2c(nc(N)nc12)C(=O)NCc1ncccc1C |$;;;;;;;;;;;;;;;HN;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1ncccc1F |$;;;;;;;;;;;;;;;HN;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1ccc(F)cn1 |$;;;;;;;;;;;;;;;HN;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(F)n1

COc1cccc2c(nc(N)nc12)C(=O)NCc1ncc(C)cc1C |$;;;;;;;;;;;;;;;HN;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1ncc(F)cc1F |$;;;;;;;;;;;;;;;HN;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1ccc2ccccc2n1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1nc(c(C)o1)-c1ccccc1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCC1Cc2cccnc2C1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)N[C@@H]1CCc2ccccc12 |r,$;;;;;;;;;;;;;;;HN;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NC1CCc2ccccc2C1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)N[C@H]1CCCc2cccnc12 |r|

COc1cccc2c(nc(N)nc12)C(=O)N[C@@H](CO)c1ccccc1 |r,$;;;;;;;;;;;;;;;HN;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)N[C@@H](CO)c1ccc2ccccc2n1 |r,$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1ncccn1 |$;;;;;;;;;;;;;;;HN;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NC(C)(C)c1ccccn1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NC1(CC1)c1ccccn1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1ccccc1-c1cccnc1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc2OC(F)(F)Oc12 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1ccccc1-c1ccccn1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(COc2ccccc2F)n1

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(COc2ccc(F)cc2)n1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc(COc3ccccn3)n2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc(COc3ccc(cc3)C#N)n2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(COC2CCCC2)n1

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(COCC2CCCC2)n1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(COCC2CC2)n1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(COCC(C)C)n1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(CO[C@H]2CCOC2)n1 |r,$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(CN2CCOCC2)c1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(COc2cccc(F)c2)n1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(CSc2ccc(F)cc2)n1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(CSc2nc3ccccc3[nH]2)n1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc(CO)n2)c2cccc(F)c2n1

[2H]C([2H])(NC(=O)c1nc(N)nc2c(OC)cccc12)c1cccc(Oc2cncc(OC)c2)n1 |$;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|

[2H]C([2H])(NC(=O)c1nc(N)nc2c(F)cccc12)c1cccc(Oc2ccc(OCCOC)cc2)n1 |$;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|

[2H]C([2H])(NC(=O)c1nc(N)nc2c(OC)cccc12)c1cccc(n1)N1CCN(CC1)c1ccc(OCCOC)cc1 |$;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccn(C)c1=O |$;;;;;;;;;;;;;;;HN;;;;;;;;;$|

Nc1nc(C(=O)NCc2ccccc2-n2cccn2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc(n2)-c2ccccn2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2ccccc2-c2ncccn2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;;$|

CC(C)c1cccc(c1)-c1cccc(CNC(=O)c2nc(N)nc3c(F)cccc23)n1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;$|

CC(C)Oc1cccc(c1)-c1cccc(CNC(=O)c2nc(N)nc3c(F)cccc23)n1 |$;;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2ncccc2-c2ncccn2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;;$|

Cc1ccc(nc1)-c1cccnc1CNC(=O)c1nc(N)nc2c(F)cccc12 |$;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;$|

Cc1csc(n1)-c1cccc(CNC(=O)c2nc(N)nc3c(F)cccc23)n1 |$;;;;;;;;;;;;HN;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc(n2)-c2cnco2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc(n2)C(F)F)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;$|

Cc1ccc(CNC(=O)c2nc(N)nc3c(F)cccc23)nc1 |$;;;;;;HN;;;;;;;;;;;;;;;;$|

Cc1ccc(CCNC(=O)c2nc(N)nc3c(F)cccc23)nc1 |$;;;;;;;HN;;;;;;;;;;;;;;;;$|

COC(=O)c1ccccc1CNC(=O)c1nc(N)nc2c(F)cccc12 |$;;;;;;;;;;;HN;;;;;;;;;;;;;;$|

COC(=O)c1cccc(CNC(=O)c2nc(N)nc3c(F)cccc23)n1 |$;;;;;;;;;;HN;;;;;;;;;;;;;;;$|

Cc1ccc(F)c(CNC(=O)c2nc(N)nc3c(F)cccc23)n1 |$;;;;;;;;HN;;;;;;;;;;;;;;;$|

COc1ccc(C)c(CNC(=O)c2nc(N)nc3c(F)cccc23)n1 |$;;;;;;;;;HN;;;;;;;;;;;;;;;$|

CC(C)Oc1cccc(CNC(=O)c2nc(N)nc3c(F)cccc23)n1 |$;;;;;;;;;;HN;;;;;;;;;;;;;;;$|

CC1(O)CCN(CC1)c1cccc(CNC(=O)c2nc(N)nc3c(F)cccc23)n1 |$;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc3cncn23)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;$|

Cc1cccn2cc(CNC(=O)c3nc(N)nc4c(F)cccc34)nc12 |$;;;;;;;;;HN;;;;;;;;;;;;;;;;$|

CC(C)c1nc(CNC(=O)c2nc(N)nc3c(F)cccc23)cs1 |$;;;;;;;HN;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cc(on2)C2CC2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc3NCCOc23)c2cccc(F)c2n1

Nc1nc(C(=O)NCC23CC4CC(CC(C4)C2)C3)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;$,TLB:7:8:11.10.15:13,11:12:16:9.10.15,THB:9:8:11.10.15:13,9:10:13:8.16.17,11:10:16:13.12.17|

Nc1nc(C(=O)NCC2CCN(CC2)c2ncc(F)cn2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCC2CC3CCC2C3)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;$|

C[C@@H](NC(=O)c1nc(N)nc2c(F)cccc12)c1cccc2cccnc12 |r|

Nc1nc(C(=O)NCc2nccc3ccccc23)c2cccc(F)c2n1

Nc1nc(C(=O)NCc2cccc3CCCNc23)c2cccc(F)c2n1

Nc1nc(C(=O)NCc2cccc3cccnc23)c2cccc(Cl)c2n1

Nc1nc(C(=O)NCc2cccc3cccnc23)c2cccc(c2n1)C(F)(F)F

Cc1cccc(CNC(=O)c2nc(N)nc3c(Cl)cc(Cl)cc23)n1 |$;;;;;;;HN;;;;;;;;;;;;;;;;$|

CSc1cccc2c(nc(N)nc12)C(=O)NCc1cccc2cccnc12

CS(=O)(=O)c1cccc2c(nc(N)nc12)C(=O)NCc1cccc2cccnc12

Nc1nc(C(=O)NCc2cccc3cccnc23)c2cccc(Br)c2n1

Nc1nc(C(=O)NCc2cccc3cccnc23)c2cccc(-c3cncnc3)c2n1

Cc1ccc(F)c(CNC(=O)c2nc(N)nc3c(cccc23)-c2ncco2)n1 |$;;;;;;;;HN;;;;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2ncccn2)c2cccc(I)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc3cccnc23)c2cccc(C#N)c2n1

Nc1nc(C(=O)NCc2cccc3cccnc23)c2cccc(OC(F)(F)F)c2n1

Nc1nc(C(=O)NCc2cccc(Cc3ccc(F)c(F)c3)n2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(Cc2ccccc2)n1 |$;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;$|

COc1cccc2c(nc(N)nc12)C(=O)NCc1cccc(Cc2cccnc2)n1

[2H]C([2H])(NC(=O)c1nc(N)nc2c(OC)cccc12)c1cccc(n1)C([2H])([2H])c1ccc(nc1)N1CCOCC1 |$;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|

[2H]C([2H])(NC(=O)c1nc(N)nc2c(OC)cccc12)c1cccc(n1)C([2H])([2H])c1cccc(OCCOC)c1 |$;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|

[2H]C([2H])(NC(=O)c1nc(N)nc2c(OC)cccc12)c1cccc(n1)C([2H])([2H])c1cncc(OCCOC)c1

[2H]C([2H])(NC(=O)c1nc(N)nc2c(OC)cccc12)c1cccc(n1)C([2H])([2H])c1cncc(c1)-c1ncco1 |$;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|

[2H]C([2H])(NC(=O)c1nc(N)nc2c(OC)cccc12)c1cccc(n1)C([2H])([2H])c1ccc(nc1)C(C)(C)OCOC |$;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|

[2H]C([2H])(NC(=O)c1nc(N)nc2c(OC)cccc12)c1cccc(n1)C([2H])([2H])c1cncc(c1)N1CCOCC1 |$;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc(Cc3ccccc3F)n2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;$|

Nc1nc(C(=O)NCc2cccc(Cc3ccncc3)n2)c2cccc(F)c2n1 |$;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;$|

O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NCCc3ccccc3)nccn12

O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NCc3cccc(F)c3)nccn12

O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NC3CC3c3ccccc3)nccn12

CN1CCN(CC1)Nc1nccn2c(nnc12)[C@@H]1SC[C@@H](O)[C@H]1O

O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NN3CCOCC3)nccn12

C[C@H](Nc1nccn2c(nnc12)[C@@H]1SC[C@@H](O)[C@H]1O)c1cccc(Cl)c1

O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NCc3ccccc3Cl)nccn12

O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NCc3ccc(Cl)cc3)nccn12

O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NCCc3ccccc3F)nccn12

O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NCc3cc(Cl)cc(Cl)c3)nccn12

O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NCc3cc(Cl)ccc3Cl)nccn12

O[C@@H]1CS[C@H]([C@@H]1O)c1nnc2c(NCc3cccs3)nccn12

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

Cc1ccc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cn1

OCc1ccc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cn1

COc1ccc(Nc2nnc(-c3ccncc3F)c(-c3ccccc3F)n2)cn1

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

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

CCOC(=O)c1cnn(c1)-c1nc(N)c2ncn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|

Nc1nc(nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O)-n1cc(cn1)-c1ccc(Cl)cc1 |r|

Nc1nc(nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O)-n1cc(cn1)-c1ccc(CO)cc1 |r|

Cc1ccc(cc1)-c1cnn(c1)-c1nc(N)c2ncn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|

CNC(=O)c1cnn(c1)-c1nc(N)c2ncn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1

Nc1nc(nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O)-n1cc(cn1)C(O)=O |r|

CN(C)C(=O)c1cnn(c1)-c1nc(N)c2ncn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|

CCNC(=O)c1cnn(c1)-c1nc(N)c2ncn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|

NC(=O)c1cnn(c1)-c1nc(N)c2ncn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r|

Nc1nc(nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O)-n1cc(cn1)C(=O)NC1CCCC1 |r|

Nc1nc(nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O)-n1cc(cn1)C(=O)NCc1ccc(Cl)cc1 |r|

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

CNC(=O)[C@]12CC1[C@H]([C@H](O)C2O)n1cnc2cnc(nc12)C#Cc1ccccc1 |r|

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

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CCC(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC(C(F)(F)F)C(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CCN(C)C)C1 |r|

CCN1CCC[C@H](C1)c1nc2c3cccc(OC)c3nc(N)n2n1 |r|

COCCN1CCC[C@H](C1)c1nc2c3cccc(OC)c3nc(N)n2n1 |r|

CCCCN1CCC[C@H](C1)c1nc2c3cccc(OC)c3nc(N)n2n1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC(C)C)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C(C)(C)C#C |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC2(C)CC2)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CCC(F)(F)C(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CCCN(CCC(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCNC1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CCC2CC2)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CCN2CCOCC2)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CCCC(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC2CC(F)(F)C2)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC2(C)COC2)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1nnc(C)s1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1nncs1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1ncns1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1ncc(C)s1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C[C@@H](C2CC2)C(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C[C@H](C2CC2)C(F)(F)F)C1 |r|

Nc1nc2c(OC(F)F)cccc2c2nc(nn12)[C@@H]1CCCN(CC(F)F)C1 |r|

Nc1nc2cc(Cl)ccc2c2nc(nn12)[C@@H]1CCCN(CC(F)F)C1 |r|

Nc1nc2c(Cl)cccc2c2nc(nn12)C1CCCN(CCC(F)(F)F)C1

Nc1nc2ccccc2c2nc(nn12)[C@@H]1CCCN(CC(F)F)C1 |r|

Nc1nc2c(O)cccc2c2nc(nn12)[C@H]1CCC[C@@H](CCC(F)(F)F)C1 |r|

Nc1nc2c(O)cccc2c2nc(nn12)[C@H]1CCC[C@H](CCC(F)(F)F)C1 |r|

Nc1nc2c(O)cccc2c2nc(nn12)[C@@H]1CCC[C@@H](CCC(F)(F)F)C1 |r|

Nc1nc2c(O)cccc2c2nc(nn12)[C@@H]1CCC[C@H](CCC(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CCC[C@@H](N)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CCC[C@H](N)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCC[C@@H](N)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCC[C@H](N)C1 |r|

CCC(C)(C)N1CCC[C@H](C1)c1nc2c3cccc(OC)c3nc(N)n2n1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CCCCN(CC(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCCN(CC(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)C1CNCC(F)(F)C1

COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CNCC(F)(F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CN(CC(F)F)CC(F)(F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CC2CC[C@@H]1N(CC(F)(F)F)C2 |r,THB:23:22:16.17:20.19|

COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CC2CC[C@H]1N(CC(F)(F)F)C2 |r,THB:23:22:16.17:20.19|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CC2CC[C@@H]1N(CC(F)(F)F)C2 |r,THB:23:22:16.17:20.19|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CC2CC[C@H]1N(CC(F)(F)F)C2 |r,THB:23:22:16.17:20.19|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)S(=O)(=O)c1ccccc1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C(=O)c1ccccc1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C(=O)C(C)(C)C |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C(=O)c1cccs1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C(=O)c1ocnc1C |r|

COc1cccc(c1)C(=O)N1CCC[C@H](C1)c1nc2c3cccc(OC)c3nc(N)n2n1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C(=O)C(C)(C)F |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC(C)(C)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC2CCOCC2)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(Cc2cccnc2)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(Cc2cc(F)cc(c2)C(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC2CCCC2)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(Cc2cnc(C)s2)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C1CCC(F)(F)CC1 |r|

COc1cccc2c3nc(nn3c(N)nc12)C1CCCN(C1)c1ccccc1

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1ccccc1 |r|

COc1cccc2c3nc(nn3c(N)nc12)C1CCN(C1)c1cccc(F)c1

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C1CC1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCN(CC(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CN(CCO1)C1CCC(F)(F)CC1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CC(F)(F)CCO1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CC(F)(F)CCO1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@H]1CCCN(CCC(F)(F)F)C1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@@H]1CCCN(CCC(F)(F)F)C1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CC(F)(F)CN1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCC(F)(F)CN1 |r|

COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CCC(F)(F)CN1 |r|

Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1

Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)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

Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ncco1

Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ncco1

Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-n1nccn1

Nc1nc(-c2ncco2)c(-c2ccc3nccn3c2)c2nc(Cc3ncccc3F)nn12

Nc1nc(-c2ccc(F)cc2)c(-c2ccc3nccn3c2)c2nc(Cc3ncccc3F)nn12

CCn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1

Nc1cccc(Cc2nc3c(-c4ccc5nccn5c4)c(nc(N)n3n2)-c2ccc(F)cc2)n1

Cn1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(cc1)C(F)F

CC(C)n1cc(ccc1=O)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)-c1ccc(F)cc1

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

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(Cc3ncccc3F)nc12)-c1cccc(Cl)c1

COc1cccc(c1)-c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc(=O)n(C)c1

Nc1nc(-c2ncco2)c(-c2ccnc(OC(F)F)c2)c2nc(Cc3c(F)cccc3F)nn12

Nc1nc(-c2ncco2)c(-c2ccnc(OC(F)F)c2)c2nc(Cc3ncccc3F)nn12

Nc1nc(c(-c2ccc3nccn3c2)c2nc(Cc3ncccc3F)nn12)-n1nccn1

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

COc1cc(ccn1)-c1c(nc(N)n2nc(Cc3c(F)cccc3F)nc12)-c1ccc(F)cc1

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

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

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

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

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

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(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

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

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(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

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

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(-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]3CCCO3)nc12)-c1ncco1 |r|

Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(C[C@H]3CCCO3)nc12)-c1ncco1 |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|

CN1CCN(CC1)c1nc(N)n2nc(Cc3c(F)cccc3F)nc2c1-c1ccc2ncc(C)n2c1

COC1CN(C1)c1nc(N)n2nc(Cc3c(F)cccc3F)nc2c1-c1ccc2ncc(C)n2c1

Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)N1CCC2(COC2)C1

C[C@@H]1CN(CCO1)c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc2ncc(C)n2c1 |r|

C[C@H]1CN(CCO1)c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc2ncc(C)n2c1 |r|

C[C@H]1COCCN1c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc2ncc(C)n2c1 |r|

C[C@@H]1COCCN1c1nc(N)n2nc(Cc3ncccc3F)nc2c1-c1ccc2ncc(C)n2c1 |r|

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

Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)N1CC2(COC2)C1

Cc1cnc2ccc(cn12)-c1c(nc(N)n2nc(Cc3ncccc3F)nc12)N1CCC1

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

CN1CCC[C@@H]1Cc1nc2c(-c3ccc4ncc(C)n4c3)c(nc(N)n2n1)-c1ccc(F)cc1 |r|

COCCc1nc2c(-c3ccc4ncc(C)n4c3)c(nc(N)n2n1)-c1ncco1

Cn1cc(ccc1=O)-c1nc(C(=O)NCc2c(F)cccc2F)c(N)nc1-c1ncco1

Cn1cc(ccc1=O)-c1nc(C(=O)NCc2ncccc2F)c(N)nc1-c1ncco1

CN(C)c1cccnc1CNC(=O)c1nc(-c2ccc(=O)n(C)c2)c(nc1N)-c1ncco1

Cn1cc(ccc1=O)-c1nc(C(=O)NCc2ncccc2OC(F)F)c(N)nc1-c1ncco1

Cc1scnc1CNC(=O)c1nc(-c2ccc(=O)n(C)c2)c(nc1N)-c1ncco1

CNc1cccc(CNC(=O)c2nc(-c3ccc(=O)n(C)c3)c(nc2N)-c2ncco2)n1

Cn1cc(ccc1=O)-c1nc(C(=O)NCc2cccc(N)n2)c(N)nc1-c1ncco1

Cn1cc(ccc1=O)-c1nc(C(=O)NCc2c(F)cccc2F)c(N)nc1-c1ccc(F)cc1

Nc1nc(-c2ncco2)c(nc1C(=O)NCc1c(F)cccc1F)-c1ccc2nncn2c1

Cn1cc(ccc1=O)-c1nc(C(=O)NCc2c(F)cccc2F)c(N)nc1-n1nccn1

Cn1nc(ccc1=O)-c1nc(C(=O)NCc2c(F)cccc2F)c(N)nc1-c1ncco1

CC(NC(=O)c1nc(-c2ccc(=O)n(C)c2)c(nc1N)-c1ncco1)c1c(F)cccc1F

Nc1nc(-c2ncco2)c(nc1C(=O)NCc1c(F)cccc1F)-c1ccc(=O)n(CCO)c1

Nc1nc(-c2ncco2)c(nc1C(=O)NCc1ncccc1F)-c1ccc2nccn2c1

Nc1nc(-c2ncco2)c(nc1C(=O)NCc1ncccc1F)-c1ccc2[nH]cnc2c1

Nc1cccc(CNC(=O)c2nc(-c3ccc4nccn4c3)c(nc2N)-c2ncco2)n1

Cn1cc(ccc1=O)-c1nc(C(=O)NCc2nc(N)ccc2F)c(N)nc1-c1ncco1

Cn1cnc2ccc(cc12)-c1nc(C(=O)NCc2ncccc2F)c(N)nc1-c1ncco1

COc1ccccc1CNC(=O)c1nc(-c2cc(C)nc(C)c2)c(nc1N)-c1ccc(C)o1

Cc1cc(cc(C)n1)-c1nc(C(=O)NCc2ccccc2OC(F)(F)F)c(N)nc1-c1ccc(F)cc1

Cn1cc(ccc1=O)-c1nc(CNC(=O)c2c(F)cccc2F)c(N)nc1-c1ccc(F)cc1

Cn1cc(ccc1=O)-c1nc(C(=O)NC(CO)c2c(F)cccc2F)c(N)nc1-c1ncco1

Nc1nc(-c2ncco2)c(nc1C(=O)NCc1ncccc1F)-c1ccc2ncnn2c1

Cc1cnc2ccc(cn12)-c1nc(C(=O)NCc2ncccc2F)c(N)nc1-c1ncco1

Nc1nc(c(nc1C(=O)NCc1ncccc1F)-c1ccc2nccn2c1)-n1nccn1

CNCCOc1cccnc1CNC(=O)c1nc(-c2ccc3ncn(C)c3c2)c(nc1N)-c1ccc(F)cc1

CN1CCCC1CNC(=O)c1nc(-c2ccc3ncc(C)n3c2)c(nc1N)-c1ncco1

Cc1cnc2ccc(cn12)-c1nc(C(=O)NC[C@H]2CCCO2)c(N)nc1-c1ncco1 |r|

Cc1cnc2ccc(cn12)-c1nc(C(=O)NC[C@@H]2CCCO2)c(N)nc1-c1ncco1 |r|

CC(C)NC(=O)c1nc(-c2ccc3ncc(C)n3c2)c(nc1N)-c1ncco1

Cc1cnc2ccc(cn12)-c1nc(C(=O)NCC2CCO2)c(N)nc1-c1ncco1

Cc1cnc2ccc(cn12)-c1nc(C(=O)NC[C@H]2CCOC2)c(N)nc1-c1ncco1 |r|

Cc1cnc2ccc(cn12)-c1nc(C(=O)NC[C@@H]2CCOC2)c(N)nc1-c1ncco1 |r|

CN1CCC[C@@H]1CNC(=O)c1nc(-c2ccc3ncc(C)n3c2)c(nc1N)-c1ccc(F)cc1 |r|

CN1CCC[C@H]1CNC(=O)c1nc(-c2ccc3ncc(C)n3c2)c(nc1N)-c1ccc(F)cc1 |r|

COCCNC(=O)c1nc(-c2ccc3ncc(C)n3c2)c(nc1N)-c1ncco1

COC[C@H](C)NC(=O)c1nc(-c2ccc3ncc(C)n3c2)c(nc1N)-c1ncco1 |r|

Cc1cnc2ccc(cn12)-c1nc(C(=O)NC2CCC2)c(N)nc1-c1ncco1

Nc1nnc(-c2cccc(Cl)c2)c(n1)-c1ccccc1

Nc1nnc(-c2cccc(c2)C(F)(F)F)c(n1)-c1ccccc1

Nc1nnc(-c2cc(Cl)cc(Cl)c2)c(n1)-c1ccccc1

Nc1nnc(-c2ccc(F)c(Cl)c2)c(n1)-c1ccccc1

Nc1nnc(-c2ccc3cc[nH]c3c2)c(n1)-c1ccccc1

COc1cc(OC)cc(c1)-c1nnc(N)nc1-c1ccccc1

Cc1cc(C)cc(c1)-c1nnc(N)nc1-c1ccccc1

Nc1nnc(-c2ccc3occc3c2)c(n1)-c1ccccc1

Cc1cc(cc(C)c1O)-c1nnc(N)nc1-c1ccccc1

Nc1nnc(-c2ccc(O)c(Cl)c2)c(n1)-c1ccccc1

Nc1nnc(-c2ccnc(Cl)c2)c(n1)-c1ccccc1

Cc1cc(Cl)cc(c1)-c1nnc(N)nc1-c1ccccc1

Cc1cc(cc(Cl)n1)-c1nnc(N)nc1-c1ccccc1

Nc1nnc(-c2ccc3ccccc3c2)c(n1)-c1ccccc1

Cc1cc(cc(C)n1)-c1nnc(N)nc1-c1ccccc1

Nc1nnc(-c2ccnc(c2)C2CC2)c(n1)-c1ccccc1

CC1(C)CC(=CC(C)(C)O1)c1nnc(N)nc1-c1ccccc1 |c:4|

Cc1cc(cc(Cl)n1)-c1nnc(N)nc1-c1cccc(F)c1

Cc1cc(cc(Cl)n1)-c1nnc(N)nc1-c1ccc(F)cc1

Nc1nnc(-c2cnn(Cc3ccccc3)c2)c(n1)-c1ccccc1

Cc1cc(cc(C)c1C#N)-c1nnc(N)nc1-c1ccc(OC(F)F)cc1

Cc1cc(cc(C)n1)-c1nnc(N)nc1-c1cc(F)cc(F)c1

Cc1cc(cc(C)n1)-c1nnc(N)nc1-c1cccc(F)c1

Cc1cc(cc(C)n1)-c1nnc(N)nc1-c1ccc(Cl)cc1

Nc1nnc(-c2cc(Cl)nc(c2)C(F)(F)F)c(n1)-c1ccc(F)cc1

Cc1cc(cc(n1)C(F)(F)F)-c1nnc(N)nc1-c1ccc(F)cc1

Cc1cc(cc(Cl)n1)-c1nnc(N)nc1-c1ccccc1F

Cc1cc(cc(n1)C(F)F)-c1nnc(N)nc1-c1ccccc1

Nc1nnc(-c2cc(Cl)nc(c2)C(F)F)c(n1)-c1ccccc1

Nc1nnc(-c2cc(Cl)nc(CF)c2)c(n1)-c1ccccc1

Cc1cc(cc(n1)C(F)(F)F)-c1nnc(N)nc1-c1ccccc1F

Nc1nnc(-c2cc(Cl)cc(Cl)c2)c(n1)-c1ccccn1

Cc1cc(cc(n1)C(F)(F)F)-c1nnc(N)nc1-c1ccccc1

CN(C)c1cc(ccn1)-c1nnc(N)nc1-c1ccccc1

Cc1cc(cc(Br)n1)-c1nnc(N)nc1-c1ccccc1

Cc1cc(cc(C)[n+]1[O-])-c1nnc(N)nc1-c1ccccc1

Nc1nnc(-c2cc(Cl)cc(c2)C(F)(F)F)c(n1)-c1ncccn1

CC1CCCN(C1)c1nnc(N)nc1-c1ccccc1

CC1CN(CC(C)O1)c1nnc(N)nc1-c1ccccc1

CC1(C)CCCN(C1)c1nnc(N)nc1-c1ccccc1

Cc1csc(Nc2nnc(N)nc2-c2ccccc2)n1

Nc1nnc(N2CCOC(CO)C2)c(n1)-c1ccccc1

Nc1nnc(Oc2ccccc2)c(n1)-c1ccccc1

Nc1nnc(Oc2cccc(c2)C(F)(F)F)c(n1)-c1ccccc1

Nc1nnc(c(n1)-c1ccccc1)-n1ccc(=O)cc1

Cc1ncccc1Oc1nnc(N)nc1-c1ccccc1

Cn1nc(cc1Oc1nnc(N)nc1-c1ccccc1)C(F)(F)F

Cc1ccc(Sc2nnc(N)nc2-c2ccccc2)cc1

Nc1nnc(-c2cc(Cl)cc(OS(=O)(=O)C(F)(F)F)c2)c(n1)-c1ccccc1

CC(=O)Nc1cc(ccc1O)-c1nnc(N)nc1-c1ccccc1

Cc1cn(cc(C)c1=O)-c1nnc(N)nc1-c1ccccc1

Cc1cc(cc(n1)N1CCC1)-c1nnc(N)nc1-c1ccccc1

Cc1cc(cc(n1)N1CCC1)-c1nnc(N)nc1-c1ccc(F)cc1

Nc1cnc(-c2ccc(O)c(Cl)c2)c(n1)-c1ccccc1

Cc1ccn(n1)-c1nc(N)cnc1-c1cc(Cl)c2ncccc2c1

Cc1ccn(n1)-c1nc(N)c(nc1-c1cc(Cl)c2ncccc2c1)C#N

Cc1ncc(s1)-c1nc(N)cnc1-c1ccc2ncccc2c1

Cc1ccn(n1)-c1nc(N)c(nc1-c1ccc2ncccc2c1)C#N

Cc1ccn(n1)-c1nc(N)cnc1-c1cc(Cl)c2[nH]ncc2c1

Cn1ccc(n1)-c1nc(N)cnc1-c1cc(Cl)c2ncccc2c1

Cn1ccc(n1)-c1nc(N)cnc1-c1cc(Cl)c2[nH]ncc2c1

Nc1cnc(-c2cc(Cl)c3ncccc3c2)c(n1)-n1ccccc1=O

Cn1ccc(n1)-c1nc(N)c(nc1-c1cc(Cl)c2ncccc2c1)C#N

Cn1ccc(n1)-c1nc(N)cnc1-c1ccc2c(cc[nH]c2=O)c1

Cc1ncc(s1)-c1nc(N)cnc1-c1cc(Cl)c2ncccc2c1

Nc1nc2C(Cc3ccccc3F)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccc(Cl)cc3F)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccc(C#N)c(F)c3)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccc(cc3)C#N)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccccc3)OC(=O)c2c(n1)-c1ccco1

Nc1nc2[C@@H](Cc3ccccc3)OCc2c(n1)-c1ccco1

Nc1nc2C(Cc3ccc(F)cc3F)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccc(F)cc3Cl)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccccc3Cl)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccc(Cl)c(F)c3)OC(=O)c2c(n1)-c1ccco1

CS(=O)(=O)c1ccc(CC2OC(=O)c3c2nc(N)nc3-c2ccco2)cc1

NC(=O)c1ccc(CC2OC(=O)c3c2nc(N)nc3-c2ccco2)cc1

Nc1nc2C(Cc3ccc(cc3)C(F)(F)F)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccccc3C(F)(F)F)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3c(F)cccc3Cl)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3cccc(Cl)c3F)OC(=O)c2c(n1)-c1ccco1

Cc1ccccc1CC1OC(=O)c2c1nc(N)nc2-c1ccco1

Nc1nc2C(Cc3cc(cc(c3)C(F)(F)F)C(F)(F)F)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccc(OC(F)(F)F)cc3)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3c(F)cccc3F)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccccc3OC(F)(F)F)OC(=O)c2c(n1)-c1ccco1

Nc1nc2C(Cc3ccccc3)OC(=O)c2c(n1)-c1ccccn1

Nc1nc2C(Cc3ccc(F)cc3F)OC(=O)c2c(n1)-c1ccc(Br)o1

Cc1ccc(o1)-c1nc(N)nc2C(Cc3ccc(F)cc3F)OC(=O)c12

Cc1ccc(o1)-c1nc(N)nc2C(Cc3ccccc3F)OC(=O)c12

Cc1ccc(o1)-c1nc(N)nc2C(Cc3ccccc3C(F)(F)F)OC(=O)c12

Cc1ccc(o1)-c1nc(N)nc2C(Cc3cc(F)ccc3F)OC(=O)c12

Cc1ccc(o1)-c1nc(N)nc2C(Cc3cc(Cl)ccc3F)OC(=O)c12

Cc1ccc(o1)-c1nc(N)nc2C(Cc3c(F)cccc3Cl)OC(=O)c12

Cc1ccc(o1)-c1nc(N)nc2C(Cc3ccc(F)cc3C(F)(F)F)OC(=O)c12

Nc1nc2[C@H](Cc3ccccc3)OCc2c(n1)-c1ccco1

Nc1nc(-c2ccco2)c2[nH]c(=O)n(Cc3ccc(F)cc3F)c2n1

Cn1c2c(nc(N)nc2n(Cc2ccc(F)cc2F)c1=O)-c1ccco1

Cc1ccc(o1)-c1nc(N)nc2n(Cc3ccccc3OC(F)(F)F)c(=O)n(C)c12

Nc1nc2C(Cc3ccccc3OC(F)(F)F)OC(=O)c2c(n1)-c1ccc(Br)o1

CN1C(=O)c2c(nc(N)nc2-c2ccco2)C1=Cc1ccccc1F |w:17.20|

Cc1ccc(o1)-c1nc(N)nc2C(Cc3ccccc3OC(F)F)OC(=O)c12

Cn1c2c(nc(N)nc2n(Cc2ccccc2F)c1=O)-c1ccco1

Cc1ccc(o1)-c1nc(N)nc2c1C(=O)OC2(C)Cc1ccccc1F

CN1C(Cc2ccccc2F)c2nc(N)nc(-c3ccco3)c2C1=O

CN1C(Cc2ccccc2OC(F)(F)F)c2nc(N)nc(-c3ccco3)c2C1=O

CN1C(=O)c2c(nc(N)nc2-c2ccco2)C1=Cc1ccc(F)cc1F |w:17.20|

CN1C(Cc2ccc(F)cc2F)c2nc(N)nc(-c3ccco3)c2C1=O

CN1C(=O)c2c(nc(N)nc2-c2ccc(C)o2)C1=Cc1ccc(F)cc1F |w:18.21|

CN1C(Cc2ccc(F)cc2F)c2nc(N)nc(-c3ccc(C)o3)c2C1=O

CN1C(=O)c2c(nc(N)nc2-c2ccc(C)o2)C1=Cc1ccccc1F |w:18.21|

CN1C(=O)c2c(nc(N)nc2-c2ccc(C)o2)C1=Cc1ccccc1C(F)(F)F |w:18.21|

CN1C(=O)c2c(nc(N)nc2-c2ccc(C)o2)C1=Cc1ccccc1OC(F)(F)F |w:18.21|

CN1C(Cc2ccccc2OC(F)(F)F)c2nc(N)nc(-c3ccc(C)o3)c2C1=O

CN1C(Cc2ccccc2C(F)(F)F)c2nc(N)nc(-c3ccc(C)o3)c2C1=O

CN1C(Cc2ccccc2F)c2nc(N)nc(-c3ccc(C)o3)c2C1=O

CN1C(=O)c2c(nc(N)nc2-c2ccc(C)o2)C1=Cc1ccc(F)cc1C(F)(F)F |w:18.21|

CN1C(Cc2ccc(F)cc2C(F)(F)F)c2nc(N)nc(-c3ccc(C)o3)c2C1=O

CN1C(Cc2cc[n+]([O-])cc2)c2nc(N)nc(-c3ccc(C)o3)c2C1=O

CN1C(Cc2ccncc2)c2nc(N)nc(-c3ccc(C)o3)c2C1=O

Cc1ccc(o1)-c1nc(N)nc2n(Cc3ccccc3C(F)(F)F)c(=O)[nH]c12

Cc1ccc(o1)-c1nc(N)nc2n(Cc3ccc(C)cc3C(F)(F)F)c(=O)[nH]c12

Cc1c(-c2nccs2)nc(N)c2nc(Cc3ccccc3)nn12

Cc1c(-c2ncccn2)nc(N)c2nc(Cc3ccccc3)nn12

Cc1nc2c(N)nc(-c3ncco3)cn2n1

Cc1c(-c2ncco2)nc(N)c2nc(CCN3CCn4c(cnc4C(C)C)C3)nn12

Cc1nc2c(o1)CN(CCc1nc3c(C)c(-c4ncco4)nc(N)n3n1)C2

Cc1nc2c(s1)CN(CCc1nc3c(C)c(-c4ncco4)nc(N)n3n1)CC2

Cc1nc2cc(-c3ncco3)nc(N)n2n1

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

Nc1nc(-c2ccccc2)cn2nc(Cc3ccccc3)nc12

Cc1nc2c(N)nc(-c3ccccc3)cn2n1

Cc1nc2c(N)nc(-c3ccc(F)cc3)cn2n1

Nc1nc(-c2cc(F)ccc2F)cn2nc(Cc3ccccc3)nc12

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

Cc1c(-c2ccc(F)cc2)nc(N)n2nc(CCN3CCn4c(cnc4C(C)C)C3)nc12

COc1ccccc1-c1cc2nc(CCN3CC(F)(F)C3)nn2c(N)n1

COc1cccc(-c2cc3nc(CCN4CC(F)(F)C4)nn3c(N)n2)c1

Nc1nc(-c2ccccc2F)cc2nc(CCN3CC(F)(F)C3)nn12

Nc1nc(-c2cccc(F)c2)cc2nc(CCN3CC(F)(F)C3)nn12

Nc1nc(-c2ccc(F)cc2)cc2nc(CCN3CC(F)(F)C3)nn12

Nc1nc(-c2ccccc2)cc2nc(CCN3CC(F)(F)C3)nn12

CC(C)n1nnc2c1CCN(CCc1nc3cc(-c4cccc(C#N)c4F)nc(N)n3n1)C2

Cc1nc2c(o1)CN(CCc1nc3c(C)c(-c4cnco4)nc(N)n3n1)C2

Cc1nc2c(s1)CN(CCc1nc3c(C)c(-c4cnco4)nc(N)n3n1)CC2

Cc1c(-c2cc(F)ccc2F)nc(N)c2nc(Cc3ccccc3)nn12

Cc1c(-c2ccccc2)nc(N)c2nc(Cc3ccccc3)nn12

Cc1c(-c2ccccc2F)nc(N)c2nc(Cc3ccccc3)nn12

COc1ccc(-c2nc(N)c3nc(Cc4ccccc4)nn3c2C)cc1Cl

COc1ccc(-c2nc(N)c3nc(Cc4ccccc4)nn3c2C)cc1F

Cc1c(-c2cncc(F)c2)nc(N)c2nc(Cc3ccccc3)nn12

Cc1c(-c2ccc(F)c(F)c2)nc(N)c2nc(Cc3ccccc3)nn12

COc1cccc(-c2nc(N)c3nc(Cc4ccccc4)nn3c2C)c1F

Cc1c(-c2ccc(Cl)c(Cl)c2)nc(N)c2nc(Cc3ccccc3)nn12

COc1ncc(-c2nc(N)c3nc(Cc4ccccc4)nn3c2C)cc1F

COc1ccc(-c2nc(N)c3nc(Cc4ccccc4)nn3c2C)c(F)c1

Cc1cc(-c2nc(N)c3nc(Cc4ccccc4)nn3c2C)ccn1

Cc1c(-c2ccc(Cl)c(F)c2)nc(N)c2nc(Cc3ccccc3)nn12

Cc1c(-c2ccc(F)cc2F)nc(N)c2nc(Cc3ccccc3)nn12

Cc1c(-c2ccc(Cl)cc2)nc(N)c2nc(Cc3ccccc3)nn12

Cc1c(-c2ccc(OC(F)F)cc2)nc(N)c2nc(Cc3ccccc3)nn12

Cc1c(-c2cccc(C(F)(F)F)n2)nc(N)c2nc(Cc3ccccc3)nn12

Cc1c(-c2ccc(Cl)cc2F)nc(N)c2nc(Cc3ccccc3)nn12

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

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(-c2cnn(C(F)(F)F)c2)nc(N)c2nc(Cc3ccccc3)nn12

Cc1c(-c2cc(C(F)(F)F)nn2C)nc(N)c2nc(Cc3ccccc3)nn12

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

Cc3c(c1cc(F)ccc1F)nc(N)c4nc(Cc2ccc(C(F)(F)F)cc2)nn34

Cc1c(-c2ncco2)nc(N)n2nc(Cc3cc[nH]n3)nc12

Cc1c(-c2ncco2)nc(N)n2nc(Cc3ccn(C)n3)nc12

Cc1c(-c2ncco2)nc(N)c2nc(Cc3ncccc3F)nn12

Cc1cccc(Cc2nc3c(C)c(-c4ncco4)nc(N)n3n2)n1

Cc1cccnc1Cc1nc2c(C)c(-c3ncco3)nc(N)n2n1

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

Nc1nc2c3OC(F)(F)Oc3ccc2c2ncnn12

Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(Cc3cccnc3Cl)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(Cc3cccnc3N3CC[C@H](C3)c3ccc(F)cc3)nn12 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(Cc3cccnc3N3CC[C@H](C3)c3ccc(cc3)C(F)(F)F)nn12 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3Cc4cccnc4C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3Cc4ccc(cc4C3)C(F)(F)F)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3Cc4ccc(F)cc4C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3Cc4cnc(nc4C3)C(F)(F)F)nn12

CCc1nnc2CN(CCc3nc4c5ccc6OC(F)(F)Oc6c5nc(N)n4n3)CCn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3Cc4ccncc4C3)nn12

Cc1nc2CCN(CCc3nc4c5ccc6OC(F)(F)Oc6c5nc(N)n4n3)Cc2o1

Cc1nc2CN(CCc3nc4c5ccc6OC(F)(F)Oc6c5nc(N)n4n3)CCc2s1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCc4nc(oc4C3)C3CC3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC(F)C3)nn12

CC1(F)CN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1

CCC1(F)CN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC(F)(C3)C3CC3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC(F)(F)C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC(O)(C3)C(F)(F)F)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC(F)(C3)C(F)(F)F)nn12

C[C@@H]1C[C@H](F)CN1CCc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3C[C@H](F)[C@@H](F)C3)nn12 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCC(F)(F)C3)nn12

C[C@@H]1CC(F)(F)CN1CCc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1 |r|

C[C@H]1CC(F)(F)CN1CCc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCC(F)CC3)nn12

CC1(F)CCN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CC1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCCC(F)(F)C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCC(F)(F)CC3)nn12

C[C@@H]1CC(F)(F)CCN1CCc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC4COCC(C3)C4(F)F)nn12 |TLB:18:19:27:22.24.23|

CC1(C)CN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1

C[C@@H]1CC[C@@H](C)N1CCc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC4CC4C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC[C@H](C3)c3ccccc3)nn12 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC[C@@H](C3)c3ccccc3)nn12 |r|

CC1CCN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CC1

CC1(C)CCCN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1

CO[C@@H]1CCCN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1 |r|

CC1=CCN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CC1 |t:1|

C[C@@H]1CN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CCO1 |r|

C[C@H]1COCCN1CCc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1 |r|

C[C@H]1CN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C[C@@H](C)O1 |r|

C[C@@H]1CN(CCN1CCc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)c1cnc(C)s1 |r|

C[C@@H]1CN(CCN1CCc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)c1nsnc1Cl |r|

CN1CCN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CC1=O

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCN(CC4CC4)C(=O)C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCN(C4CCCC4)C(=O)C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCN(C(=O)C3)c3cccc(F)c3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3C[C@H]4CCCN[C@H]4C3)nn12 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC4CNC[C@H]4C3)nn12 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCC4(C3)CCNCC4)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCC4(CCNCC4)CC3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCCC33CCNCC3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCCC4(CCNCC4)C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCNC3CC4(CNC4)C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCNC3(CCC3)C(F)(F)F)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCNCc3ccc(cc3)C(F)(F)F)nn12

Cc1csc(CN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CC2CC2)n1

Cc1ncc(CN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CC2CC2)s1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCCC(C3)C(F)(F)F)nn12

C[C@@H]1CN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C[C@@H](C)O1 |r|

CC1(F)CCCN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CC4CC3C(F)(F)C4)nn12

C[C@H]1N(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CCCC1(F)F |r|

C[C@@H]1N(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CCCC1(F)F |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCCC(O)(C3)C(F)(F)F)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCCC(F)(C3)C(F)(F)F)nn12

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1Cc2ccncc2C1 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2cccnc12 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2ccncc12 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2ccncc2C1 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2cccnc2C1 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2nc(C)oc2C1 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2nc(C)sc2C1 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2nc(oc2C1)C1CC1 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2sc(C)nc2C1 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCn2nc(C)cc2C1 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CC(C)(F)C1 |r|

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCCC(C)(F)C1 |r|

C[C@@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1Cc2ccncc2C1 |r|

C[C@@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CC(C)(F)C1 |r|

C[C@@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCCC(C)(F)C1 |r|

CC(Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1Cc2cccnc2C1

CC(Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CC(F)(F)C1

C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCCC(F)(F)C1 |r|

C[C@@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCCC(F)(F)C1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CC(C(F)F)N3Cc4cccnc4C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCn3cccn3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3Cc4ncccc4C3=O)nn12

CC(C)(Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CC(F)C1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CCN(CC33CC3)c3ccc(F)cc3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CCN(CC33CC3)c3ccc(F)cn3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CCN(CC33CC3)c3cccc(F)c3)nn12

COCCOc1ccc(cc1)N1CCN(Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C2(CC2)C1

C[C@@H]1CN(CCN1Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)c1ccc(F)cc1 |r|

C[C@@H]1CN(CCN1Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)c1cnc(C)s1 |r|

C[C@@H]1CN(CCN1Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)c1nsnc1Cl |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CC(F)(F)C3)nn12

CC1(C)CN(Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1

CC1(F)CN(Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1

CCC1(F)CN(Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CC(O)(C3)C(F)(F)F)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CC(F)(C3)C(F)(F)F)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3C[C@H](F)[C@@H](F)C3)nn12 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CCC(F)(F)C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CCC(CC3)Oc3ccc(F)cc3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CCCC(F)(F)C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CCC(F)(F)CC3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3Cc4ccc(F)cc4C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3Cc4cnc(nc4C3)C(F)(F)F)nn12

CCc1nnc2CN(Cc3nc4c5ccc6OC(F)(F)Oc6c5nc(N)n4n3)CCn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3Cc4ccc(cc4C3)C(F)(F)F)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CNCc3ccc(cc3)C(F)(F)F)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CNC3(CCC3)C(F)(F)F)nn12

CN(C)Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1

Cc1csc(CN(CC2CC2)Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)n1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(Cn3cccn3)nn12

Cc1cc(C)n(Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)n1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(Cn3nc(cc3C(F)(F)F)C(F)(F)F)nn12

CC(N1CC(F)(F)C1)c1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1

CC(N1C[C@H](F)[C@@H](F)C1)c1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1 |r|

C[C@@H](N1CCCC(F)(F)C1)c1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1 |r|

C[C@H](N1CCCC(F)(F)C1)c1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3Cc4cccnc4C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@@H]1CCCN(CC(F)(F)F)C1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@@H]1CCCN(CC(F)F)C1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)C1CCCN(CCC(F)(F)F)C1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)C1CCCN(C1)c1cccc(F)c1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)C1CCCN(C1)c1cc(F)cc(F)c1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@H]1CCCN(C1)c1cncnc1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@@H]1CCCN(C1)c1cncnc1 |r|

COC(=O)C(Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)C(=O)OC

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CC(CO)CO)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CC(CCl)CCl)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CC3CN(C3)C3CCC3)nn12

CC(F)(F)CN1CC(Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CC3CN(C3)c3ccccn3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CC3CCN(CCC(F)(F)F)C3)nn12

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CC3CCN(CC(F)F)C3)nn12

COCCN1CCC(Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1

N[C@@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)C1CC1 |r|

N[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)C1CC1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@H]1CC[C@@H](C1)N1CCCC(F)(F)C1 |r|

Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@H]1CC[C@H](C1)N1CCCC(F)(F)C1 |r|

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

Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4c(ncn4C4CCCC4)C3)nc12

Cc1c(-c2ncco2)nc(N)n2nc(CCN3CCc4ncn(C5CCCC5)c4C3)nc12

Nc1nc(-c2ncco2)cc2nc(CCN3CC(F)(F)C3)nn12

Nc1nc(-c2ncco2)cc2nc(CCN3CCc4[nH]ncc4C3)nn12

Cn1nc(C(F)(F)F)c2c1CCN(CCc1nc3cc(-c4ncco4)nc(N)n3n1)C2

Nc1nc(-c2ncco2)cc2nc(CCN3CCN(CC4CC4)C(=O)C3)nn12

Cc1cc2n(n1)CCN(CCc1nc3cc(-c4ncco4)nc(N)n3n1)C2

Nc1nc(-c2ncco2)cc2nc(CCN3CCc4nccnc4C3)nn12

CC(C)c1ncc2n1CCN(CCc1nc3c(N)nc(-c4ncco4)cn3n1)C2

Nc1nc(-c2ccccc2)cc2nc(CCN3CCn4c(cnc4C4CCC4)C3)nn12

Cc1c(-c2ccc(F)cc2)nc(N)c2nc(Cc3ccccc3)nn12

Nc1nc(-c2ncco2)c(C2CC2)n2nc(Cc3ccccc3)nc12

Nc1nc(-c2cc(F)ccc2F)c(C2CC2)n2nc(Cc3ccccc3)nc12

Nc1nc(-c2ccccc2)c(C2CC2)c2nc(CCN3CC(F)(F)C3)nn12

CCNC(=O)c1cc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccnn3CC)n2n1 |(8.16,-3.85,;7.39,-2.52,;5.85,-2.52,;5.08,-1.18,;5.85,.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,;2.57,2.4,;3.66,3.49,;1.17,-.41,;2.64,.06,)|

CCCn1nccc1-c1c(nc(N)c2cc(nn12)C(=O)NCC)-c1cccc(c1)C#N |(5.02,3.09,;3.53,3.49,;2.44,2.4,;.95,2.8,;.48,4.26,;-1.06,4.26,;-1.54,2.8,;-.29,1.9,;-.29,.36,;-1.63,-.41,;-1.63,-1.95,;-.29,-2.72,;-.29,-4.26,;1.04,-1.95,;2.5,-2.43,;3.41,-1.18,;2.5,.06,;1.04,-.41,;4.95,-1.18,;5.72,.15,;5.72,-2.52,;7.21,-2.12,;8.3,-3.21,;-2.96,.36,;-2.96,1.9,;-4.3,2.67,;-5.63,1.9,;-5.63,.36,;-4.3,-.41,;-6.96,-.41,;-8.3,-1.18,)|

CCNC(=O)c1cc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccc(=O)n(C)c3)n2n1

CCNC(=O)c1cc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncn3)n2n1

CCNC(=O)c1cc2c(N)nc(-c3cccc(c3)C#N)c(n2n1)C(C)(F)F

CCNC(=O)c1cc2c(N)nc(-c3cccc(c3)C#N)c(n2n1)C1(CC1)C(F)(F)F

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(cc12)C(=O)N1CCC1

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(cc12)C(=O)N1CCCC1

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(cc12)C(=O)N1CCCCC1

CCN(CC)C(=O)c1cc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncn3)n2n1

CCN(C)C(=O)c1cc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncn3)n2n1

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(cc12)C(=O)N1CC(O)C1

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(CN3CCC3)cc12

CCOC(=O)Nc1nc2c(N)nc(cn2n1)-c1cccc(c1)C#N

Nc1nc(-c2cccc(c2)C#N)c(-c2ccc(=O)[nH]c2)n2ncnc12

Nc1nc(cn2nc(Cc3ccccn3)cc12)-c1cccc(c1)C#N

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3ccccn3)cc12

CCn1nccc1-c1c(nc(N)c2cc(Cc3ccccn3)nn12)-c1cccc(c1)C#N |(3.66,3.95,;2.57,2.86,;1.09,3.26,;.61,4.73,;-.93,4.73,;-1.41,3.26,;-.16,2.36,;-.16,.82,;-1.49,.05,;-1.49,-1.49,;-.16,-2.26,;-.16,-3.8,;1.17,-1.49,;2.64,-1.97,;3.54,-.72,;5.08,-.72,;5.85,-2.06,;5.08,-3.39,;5.85,-4.73,;7.39,-4.73,;8.16,-3.39,;7.39,-2.06,;2.64,.52,;1.17,.05,;-2.83,.82,;-2.83,2.36,;-4.16,3.13,;-5.5,2.36,;-5.5,.82,;-4.16,.05,;-6.83,.05,;-8.16,-.72,)|

NC(=O)N1CCC(=CC1)c1c(nc(N)c2cc(Cc3ccccc3F)nn12)-c1cccc(c1)C#N |c:6|

Nc1nc(-c2cccc(c2)C#N)c(C#N)n2nc(Cc3ccccc3F)cc12

Nc1nc(cn2nc(Cc3ccccc3F)c(C#N)c12)-c1cccc(c1)C#N

Nc1nc(-c2cccc(c2)C#N)c(Br)n2nc(cc12)C(O)c1ccccc1F

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(cc12)C(O)c1ccccc1F

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(cc12)C1=CCOCC1 |t:28|

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncc2)n2nc(Nc3ccccc3)cc12

CN1CCN(CC1)c1cc(ccn1)-c1cc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncc3)n2n1

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3ccccn3)nc12

Cn1cc(ccc1=O)-c1c(nc(N)c2nc(Cc3ccccn3)nn12)-c1cccc(c1)C#N

Cn1nc(ccc1=O)-c1c(nc(N)c2nc(Cc3ccccn3)nn12)-c1cccc(c1)C#N

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3c(F)cccc3CN3CC[C@@H](C3)C(O)=O)nc12 |r|

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3c(F)cccc3CN3CC(C3)C(O)=O)nc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cn3ccc4cccnc34)nc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cn3cccc4ccnc34)nc12

CC(O)c1nc(C)oc1-c1c(nc(N)c2cc(Cc3ccccn3)nn12)-c1cccc(c1)C#N |(2.87,.66,;2.55,2.16,;3.69,3.19,;1.09,2.64,;.61,4.1,;-.93,4.1,;-1.84,5.35,;-1.41,2.64,;-.16,1.73,;-.16,.19,;-1.49,-.58,;-1.49,-2.12,;-.16,-2.89,;-.16,-4.43,;1.17,-2.12,;2.64,-2.59,;3.54,-1.35,;5.08,-1.35,;5.85,-2.68,;5.08,-4.01,;5.85,-5.35,;7.39,-5.35,;8.16,-4.01,;7.39,-2.68,;2.64,-.1,;1.17,-.58,;-2.83,.19,;-2.83,1.73,;-4.16,2.5,;-5.5,1.73,;-5.5,.19,;-4.16,-.58,;-6.83,-.58,;-8.16,-1.35,)|

Cc1nc(C(O)C(F)F)c(o1)-c1c(nc(N)c2cc(Cc3ccccn3)nn12)-c1cccc(c1)C#N |(-1.84,5.35,;-.93,4.1,;.61,4.1,;1.09,2.64,;2.57,2.24,;2.97,.75,;3.66,3.33,;5.15,2.93,;3.26,4.82,;-.16,1.73,;-1.41,2.64,;-.16,.19,;-1.49,-.58,;-1.49,-2.12,;-.16,-2.89,;-.16,-4.43,;1.17,-2.12,;2.64,-2.59,;3.54,-1.35,;5.08,-1.35,;5.85,-2.68,;5.08,-4.01,;5.85,-5.35,;7.39,-5.35,;8.16,-4.01,;7.39,-2.68,;2.64,-.1,;1.17,-.58,;-2.83,.19,;-2.83,1.73,;-4.16,2.5,;-5.5,1.73,;-5.5,.19,;-4.16,-.58,;-6.83,-.58,;-8.16,-1.35,)|

CCn1nncc1-c1c(nc(N)c2cc(Cc3ccccn3)nn12)-c1cccc(c1)C#N |(3.66,3.95,;2.57,2.86,;1.09,3.26,;.61,4.73,;-.93,4.73,;-1.41,3.26,;-.16,2.36,;-.16,.82,;-1.49,.05,;-1.49,-1.49,;-.16,-2.26,;-.16,-3.8,;1.17,-1.49,;2.64,-1.97,;3.54,-.72,;5.08,-.72,;5.85,-2.06,;5.08,-3.39,;5.85,-4.73,;7.39,-4.73,;8.16,-3.39,;7.39,-2.06,;2.64,.52,;1.17,.05,;-2.83,.82,;-2.83,2.36,;-4.16,3.13,;-5.5,2.36,;-5.5,.82,;-4.16,.05,;-6.83,.05,;-8.16,-.72,)|

Cn1nncc1-c1c(nc(N)c2cc(Cc3ccccn3)nn12)-c1cccc(c1)C#N |(2.55,2.78,;1.09,3.26,;.61,4.73,;-.93,4.73,;-1.41,3.26,;-.16,2.36,;-.16,.82,;-1.49,.05,;-1.49,-1.49,;-.16,-2.26,;-.16,-3.8,;1.17,-1.49,;2.64,-1.97,;3.54,-.72,;5.08,-.72,;5.85,-2.06,;5.08,-3.39,;5.85,-4.73,;7.39,-4.73,;8.16,-3.39,;7.39,-2.06,;2.64,.52,;1.17,.05,;-2.83,.82,;-2.83,2.36,;-4.16,3.13,;-5.5,2.36,;-5.5,.82,;-4.16,.05,;-6.83,.05,;-8.16,-.72,)|

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Oc3ccccc3F)nc12

Cc1ncoc1-c1c(nc(N)c2nc(nn12)C(O)c1ccccn1)-c1cccc(c1)C#N |(2.57,2.86,;1.09,3.26,;.61,4.73,;-.93,4.73,;-1.41,3.26,;-.16,2.36,;-.16,.82,;-1.49,.05,;-1.49,-1.49,;-.16,-2.26,;-.16,-3.8,;1.17,-1.49,;2.64,-1.97,;3.54,-.72,;2.64,.52,;1.17,.05,;5.08,-.72,;5.85,.61,;5.85,-2.06,;5.08,-3.39,;5.85,-4.73,;7.39,-4.73,;8.16,-3.39,;7.39,-2.06,;-2.83,.82,;-2.83,2.36,;-4.16,3.13,;-5.5,2.36,;-5.5,.82,;-4.16,.05,;-6.83,.05,;-8.16,-.72,)|

Cn1cc(cn1)-c1ccccc1Cc1nc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncn3)n2n1

Cc1ncoc1-c1c(nc(N)c2nc(Cc3ccccn3)nn12)-c1cccc(c1)C#N |(2.42,2.49,;1.09,3.26,;.61,4.73,;-.93,4.73,;-1.41,3.26,;-.16,2.36,;-.16,.82,;-1.49,.05,;-1.49,-1.49,;-.16,-2.26,;-.16,-3.8,;1.17,-1.49,;2.64,-1.97,;3.54,-.72,;5.08,-.72,;5.85,-2.06,;5.08,-3.39,;5.85,-4.73,;7.39,-4.73,;8.16,-3.39,;7.39,-2.06,;2.64,.52,;1.17,.05,;-2.83,.82,;-2.83,2.36,;-4.16,3.13,;-5.5,2.36,;-5.5,.82,;-4.16,.05,;-6.83,.05,;-8.16,-.72,)|

CCc1ncoc1-c1c(nc(N)c2nc(Cc3ccccn3)nn12)-c1cccc(c1)C#N |(3.69,3.82,;2.55,2.78,;1.09,3.26,;.61,4.73,;-.93,4.73,;-1.41,3.26,;-.16,2.36,;-.16,.82,;-1.49,.05,;-1.49,-1.49,;-.16,-2.26,;-.16,-3.8,;1.17,-1.49,;2.64,-1.97,;3.54,-.72,;5.08,-.72,;5.85,-2.06,;5.08,-3.39,;5.85,-4.73,;7.39,-4.73,;8.16,-3.39,;7.39,-2.06,;2.64,.52,;1.17,.05,;-2.83,.82,;-2.83,2.36,;-4.16,3.13,;-5.5,2.36,;-5.5,.82,;-4.16,.05,;-6.83,.05,;-8.16,-.72,)|

Cc1cnccc1-c1c(nc(N)c2nc(Cc3ccccn3)nn12)-c1cccc(c1)C#N |(2.51,2,;1.17,2.77,;1.17,4.31,;-.16,5.08,;-1.49,4.31,;-1.49,2.77,;-.16,2,;-.16,.46,;-1.49,-.31,;-1.49,-1.85,;-.16,-2.62,;-.16,-4.16,;1.17,-1.85,;2.64,-2.33,;3.54,-1.08,;5.08,-1.08,;5.85,-2.41,;5.08,-3.75,;5.85,-5.08,;7.39,-5.08,;8.16,-3.75,;7.39,-2.41,;2.64,.17,;1.17,-.31,;-2.83,.46,;-2.83,2,;-4.16,2.77,;-5.5,2,;-5.5,.46,;-4.16,-.31,;-6.83,-.31,;-8.16,-1.08,)|

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3cccn4ccnc34)nc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3cccc4ccnn34)nc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cn3cc4ccccc4n3)nc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cn3ncc4ccccc34)nc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(nc12)C(O)c1c(F)cccc1F

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(nc12)C(O)c1cc(F)ccc1F

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(nc12)C(O)c1cccc(F)c1F

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(nc12)C(O)c1ccccc1F

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(nc12)C(O)c1ccccc1Cl

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(nc12)C(O)c1ccccc1

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(nc12)S(=O)(=O)c1ccccc1

Cc1ncoc1-c1c(nc(N)c2nc(nn12)C(=O)N1CCC1)-c1cccc(c1)C#N |(2.96,2.39,;1.5,2.87,;1.02,4.33,;-.52,4.33,;-1,2.87,;.25,1.97,;.25,.43,;-1.08,-.34,;-1.08,-1.88,;.25,-2.65,;.25,-4.19,;1.58,-1.88,;3.05,-2.36,;3.95,-1.11,;3.05,.13,;1.58,-.34,;5.49,-1.11,;6.26,.22,;6.26,-2.45,;5.87,-3.94,;7.35,-4.33,;7.75,-2.85,;-2.42,.43,;-2.42,1.97,;-3.75,2.74,;-5.08,1.97,;-5.08,.43,;-3.75,-.34,;-6.42,-.34,;-7.75,-1.11,)|

Nc1nc(-c2cccc(c2)C#N)c(-c2ccc(O)nc2)n2nc(Cc3ccccn3)nc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3cccc4ocnc34)nc12

Cn1nccc1-c1cccc(F)c1Cc1nc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncn3)n2n1

C[C@]1(CCN(Cc2cccc(F)c2Cc2nc3c(N)nc(-c4cccc(c4)C#N)c(-c4ccncn4)n3n2)C1)C(O)=O |r|

CN1CCC2(CN(Cc3cccc(F)c3Cc3nc4c(N)nc(-c5cccc(c5)C#N)c(-c5ccncn5)n4n3)C2)C1=O

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3c(F)cccc3CN3CCN4C(CCC4=O)C3)nc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3c(F)cccc3CN[C@H]3CCNC3=O)nc12 |r|

NC(=O)CNCc1cccc(F)c1Cc1nc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncn3)n2n1

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3c(F)cccc3CN3CCNC(=O)C3)nc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3c(F)cccc3CN[C@H]3C[C@H](C3)C(O)=O)nc12 |r,wU:32.34,34.39,(-3.02,-4.16,;-3.02,-2.62,;-4.35,-1.85,;-4.35,-.31,;-5.68,.46,;-5.68,2,;-7.02,2.77,;-8.35,2,;-8.35,.46,;-7.02,-.31,;-9.68,-.31,;-11.02,-1.08,;-3.02,.46,;-3.02,2,;-4.35,2.77,;-4.35,4.31,;-3.02,5.08,;-1.68,4.31,;-1.68,2.77,;-1.68,-.31,;-.22,.17,;.69,-1.08,;2.23,-1.08,;3,-2.41,;2.23,-3.75,;.69,-3.75,;3,-5.08,;4.54,-5.08,;5.31,-3.75,;4.54,-2.41,;5.31,-1.08,;6.85,-1.08,;7.62,.25,;7.22,1.74,;8.71,2.14,;9.11,.65,;9.48,3.47,;11.02,3.47,;8.71,4.81,;-.22,-2.33,;-1.68,-1.85,)|

CN1CCC(NCc2cccc(F)c2Cc2nc3c(N)nc(-c4cccc(c4)C#N)c(-c4ccncn4)n3n2)C1=O

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3c(F)cccc3CN3CC(C3)C#N)nc12

Cn1ncc(NCc2cccc(F)c2Cc2nc3c(N)nc(-c4cccc(c4)C#N)c(-c4ccncn4)n3n2)n1

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3ccccc3CN[C@H]3CCNC3=O)nc12 |r|

Cc1ncoc1-c1c(nc(N)c2nc(Cc3c(F)cccc3CN3CC[C@](C)(C3)C(O)=O)nn12)-c1cccc(c1)C#N |r,wU:26.28,wD:26.31,(-.67,2.86,;-2.16,3.26,;-2.63,4.73,;-4.17,4.73,;-4.65,3.26,;-3.4,2.36,;-3.4,.82,;-4.74,.05,;-4.74,-1.49,;-3.4,-2.26,;-3.4,-3.8,;-2.07,-1.49,;-.61,-1.97,;.3,-.72,;1.84,-.72,;2.61,-2.06,;1.84,-3.39,;.3,-3.39,;2.61,-4.73,;4.15,-4.73,;4.92,-3.39,;4.15,-2.06,;4.92,-.72,;6.46,-.72,;7.36,-1.97,;8.83,-1.49,;8.83,.05,;8.43,1.53,;7.36,.52,;9.92,1.13,;11.41,.74,;9.52,2.62,;-.61,.52,;-2.07,.05,;-6.07,.82,;-6.07,2.36,;-7.4,3.13,;-8.74,2.36,;-8.74,.82,;-7.4,.05,;-10.07,.05,;-11.41,-.72,)|

Cc1ncoc1-c1c(nc(N)c2nc(nn12)C(N)c1c(F)cccc1F)-c1cccc(c1)C#N |(2.57,2.4,;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,;2.64,.06,;1.17,-.41,;5.08,-1.18,;5.85,-2.52,;5.85,.15,;5.08,1.48,;3.54,1.48,;5.85,2.82,;7.39,2.82,;8.16,1.48,;7.39,.15,;8.16,-1.18,;-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,)|

CNC(c1nc2c(N)nc(-c3cccc(c3)C#N)c(-c3ocnc3C)n2n1)c1c(F)cccc1F |(7.39,-2.52,;5.85,-2.52,;5.08,-1.18,;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,;5.85,.15,;7.39,.15,;8.16,-1.18,;8.16,1.48,;7.39,2.82,;5.85,2.82,;5.08,1.48,;3.54,1.48,)|

Cc1ncoc1-c1c(nc(N)c2nc(nn12)C(NCCO)c1c(F)cccc1F)-c1cccc(c1)C#N |(1.78,2.78,;.32,3.26,;-.16,4.73,;-1.7,4.73,;-2.18,3.26,;-.93,2.36,;-.93,.82,;-2.26,.05,;-2.26,-1.49,;-.93,-2.26,;-.93,-3.8,;.4,-1.49,;1.87,-1.97,;2.77,-.72,;1.87,.52,;.4,.05,;4.31,-.72,;5.08,.61,;6.62,.61,;7.39,1.94,;8.93,1.94,;5.08,-2.06,;4.31,-3.39,;2.77,-3.39,;5.08,-4.73,;6.62,-4.73,;7.39,-3.39,;6.62,-2.06,;7.39,-.72,;-3.6,.82,;-3.6,2.36,;-4.93,3.13,;-6.27,2.36,;-6.27,.82,;-4.93,.05,;-7.6,.05,;-8.93,-.72,)|

Cc1ncoc1-c1c(nc(N)c2nc(nn12)C(N)c1ccccc1F)-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,;2.64,.06,;1.17,-.41,;5.08,-1.18,;5.85,-2.52,;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,;-2.83,.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,)|

Cn1nc(ccc1=O)-c1c(nc(N)c2nc(nn12)C(N)c1c(F)cccc1F)-c1cccc(c1)C#N

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3ncccc3-c3cnco3)nc12

Cn1cc(cn1)-c1cccc(F)c1Cc1nc2c(N)nc(cn2n1)-c1cccc(C#N)c1F

CN1CC[C@H](NCc2cccc(F)c2Cc2nc3c(N)nc(cn3n2)-c2cccc(C#N)c2F)C1=O |r|

CN1CCC2(CN(Cc3cccc(F)c3Cc3nc4c(N)nc(cn4n3)-c3cccc(C#N)c3F)C2)C1=O

Cc1ncoc1-c1c(nc(N)c2nc(Cc3ccccn3)nn12)-c1cccc(C#N)c1F |(2.55,2.78,;1.09,3.26,;.61,4.73,;-.93,4.73,;-1.41,3.26,;-.16,2.36,;-.16,.82,;-1.49,.05,;-1.49,-1.49,;-.16,-2.26,;-.16,-3.8,;1.17,-1.49,;2.64,-1.97,;3.54,-.72,;5.08,-.72,;5.85,-2.06,;5.08,-3.39,;5.85,-4.73,;7.39,-4.73,;8.16,-3.39,;7.39,-2.06,;2.64,.52,;1.17,.05,;-2.83,.82,;-2.83,2.36,;-4.16,3.13,;-5.5,2.36,;-5.5,.82,;-6.83,.05,;-8.16,-.72,;-4.16,.05,;-4.16,-1.49,)|

Cc1nc(C(O)C(F)F)c(o1)-c1c(nc(N)c2nc(Cc3ccccn3)nn12)-c1cccc(C#N)c1F |(-1.84,5.35,;-.93,4.1,;.61,4.1,;1.09,2.64,;2.55,2.16,;3.32,.83,;3.69,3.19,;3.37,4.7,;5.16,2.72,;-.16,1.73,;-1.41,2.64,;-.16,.19,;-1.49,-.58,;-1.49,-2.12,;-.16,-2.89,;-.16,-4.43,;1.17,-2.12,;2.64,-2.59,;3.54,-1.35,;5.08,-1.35,;5.85,-2.68,;5.08,-4.01,;5.85,-5.35,;7.39,-5.35,;8.16,-4.01,;7.39,-2.68,;2.64,-.1,;1.17,-.58,;-2.83,.19,;-2.83,1.73,;-4.16,2.5,;-5.5,1.73,;-5.5,.19,;-6.83,-.58,;-8.16,-1.35,;-4.16,-.58,;-4.16,-2.12,)|

Cc1nc(C(O)C(F)(F)F)c(o1)-c1c(nc(N)c2nc(Cc3ccccn3)nn12)-c1cccc(C#N)c1F |(3.26,5.35,;2.36,4.1,;.82,4.1,;.34,2.64,;-1.12,2.16,;-1.44,.66,;-2.27,3.19,;-1.24,4.34,;-3.3,2.05,;-3.41,4.22,;1.59,1.73,;2.83,2.64,;1.59,.19,;2.92,-.58,;2.92,-2.12,;1.59,-2.89,;1.59,-4.43,;.25,-2.12,;-1.21,-2.59,;-2.12,-1.35,;-3.66,-1.35,;-4.43,-2.68,;-3.66,-4.01,;-4.43,-5.35,;-5.97,-5.35,;-6.74,-4.01,;-5.97,-2.68,;-1.21,-.1,;.25,-.58,;4.25,.19,;4.25,1.73,;5.59,2.5,;6.92,1.73,;6.92,.19,;8.25,-.58,;9.59,-1.35,;5.59,-.58,;5.59,-2.12,)|

Cn1cc(ccc1=O)-c1c(nc(N)c2nc(Cc3ccccn3)nn12)-c1cccc(C#N)c1F

Cn1cnc(c1)S(=O)(=O)N1CCCC1Cc1nc2c(N)nc(cn2n1)-c1cccc(C#N)c1F

CC(=O)N1CCC(Cc2cccc(F)c2Cc2nc3c(N)nc(cn3n2)-c2cccc(C#N)c2F)CC1

CCn1nccc1-c1c(nc(N)c2nc(nn12)C(O)c1c(F)cccc1F)-c1cccc(c1)C#N |(3.69,3.82,;2.55,2.78,;1.09,3.26,;.61,4.73,;-.93,4.73,;-1.41,3.26,;-.16,2.36,;-.16,.82,;-1.49,.05,;-1.49,-1.49,;-.16,-2.26,;-.16,-3.8,;1.17,-1.49,;2.64,-1.97,;3.54,-.72,;2.64,.52,;1.17,.05,;5.08,-.72,;5.85,.61,;5.85,-2.06,;5.08,-3.39,;3.54,-3.39,;5.85,-4.73,;7.39,-4.73,;8.16,-3.39,;7.39,-2.06,;8.16,-.72,;-2.83,.82,;-2.83,2.36,;-4.16,3.13,;-5.5,2.36,;-5.5,.82,;-4.16,.05,;-6.83,.05,;-8.16,-.72,)|

Cc1cc(cc(C)n1)-c1c(nc(N)c2nc(nn12)C(O)c1c(F)cccc1F)-c1cccc(c1)C#N

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3c[nH]c4cccnc34)cc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(nc12)C(O)c1c(F)cccc1OC(F)F

Cn1cc(Cn2cc(cn2)-c2cccc(F)c2Cc2nc3c(N)nc(cn3n2)-c2cccc(C#N)c2F)cn1

CN(C)Cc1cccc(F)c1C(O)c1nc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncn3)n2n1

Cc1n[nH]cc1-c1c(nc(N)c2nc(nn12)C(O)c1c(F)cccc1F)-c1cccc(c1)C#N |(2.55,2.78,;1.08,3.26,;.61,4.73,;-.93,4.73,;-1.41,3.26,;-.16,2.36,;-.16,.82,;-1.49,.05,;-1.49,-1.49,;-.16,-2.26,;-.16,-3.8,;1.17,-1.49,;2.64,-1.97,;3.54,-.72,;2.64,.52,;1.17,.05,;5.08,-.72,;5.85,.61,;5.85,-2.06,;5.08,-3.39,;3.54,-3.39,;5.85,-4.73,;7.39,-4.73,;8.16,-3.39,;7.39,-2.06,;8.16,-.72,;-2.83,.82,;-2.83,2.36,;-4.16,3.13,;-5.5,2.36,;-5.5,.82,;-4.16,.05,;-6.83,.05,;-8.16,-.72,)|

Nc1nc(-c2cccc(c2)C#N)c(-c2ccc3nncn3c2)n2nc(nc12)C(O)c1c(F)cccc1F

Nc1nc(-c2cccc(c2)C#N)c(-c2cnco2)n2nc(nc12)C(O)c1c(F)cccc1F

Nc1nc(cn2nc(Cc3c(F)cccc3-c3cnn(Cc4ccccn4)c3)nc12)-c1cccc(C#N)c1F

Cc1cnccc1-c1c(nc(N)c2nc(nn12)C(O)c1c(F)cccc1F)-c1cccc(c1)C#N |(2.51,2,;1.17,2.77,;1.17,4.31,;-.16,5.08,;-1.49,4.31,;-1.49,2.77,;-.16,2,;-.16,.46,;-1.49,-.31,;-1.49,-1.85,;-.16,-2.62,;-.16,-4.16,;1.17,-1.85,;2.64,-2.33,;3.54,-1.08,;2.64,.17,;1.17,-.31,;5.08,-1.08,;5.85,.25,;5.85,-2.41,;5.08,-3.75,;3.54,-3.75,;5.85,-5.08,;7.39,-5.08,;8.16,-3.75,;7.39,-2.41,;8.16,-1.08,;-2.83,.46,;-2.83,2,;-4.16,2.77,;-5.5,2,;-5.5,.46,;-4.16,-.31,;-6.83,-.31,;-8.16,-1.08,)|

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(nc12)C(O)c1c(F)cccc1CN1CCCC1

CS(=O)(=O)CCn1cc(cn1)-c1cccc(F)c1Cc1nc2c(N)nc(cn2n1)-c1cccc(C#N)c1F

Nc1nc(cn2nc(nc12)C(O)c1c(F)cccc1CN1CCN2C(CCC2=O)C1)-c1cccc(C#N)c1F

CN(C)C(=O)Cn1cc(cn1)-c1cccc(F)c1Cc1nc2c(N)nc(cn2n1)-c1cccc(C#N)c1F

NC(=O)Cn1cc(cn1)-c1cccc(F)c1Cc1nc2c(N)nc(cn2n1)-c1cccc(C#N)c1F

CN[C@H]1C[C@@H](C1)n1cc(cn1)-c1cccc(F)c1Cc1nc2c(N)nc(cn2n1)-c1cccc(C#N)c1F |r,wU:2.1,wD:4.6,(12.06,2.28,;10.97,3.37,;9.49,2.97,;8.72,1.64,;7.38,2.41,;8.15,3.74,;5.89,2.01,;5.81,.47,;4.33,.08,;3.49,1.37,;4.46,2.56,;3.56,-1.26,;4.33,-2.59,;3.56,-3.93,;2.02,-3.93,;1.25,-2.59,;-.29,-2.59,;2.02,-1.26,;1.25,.08,;-.29,.08,;-1.2,-1.17,;-2.66,-.69,;-4,-1.46,;-4,-3,;-5.33,-.69,;-5.33,.85,;-4,1.62,;-2.66,.85,;-1.2,1.32,;-6.66,1.62,;-6.66,3.16,;-8,3.93,;-9.33,3.16,;-9.38,1.59,;-10.71,.82,;-12.05,.05,;-8,.85,;-8,-.69,)|

Nc1nc(cn2nc(Cc3c(F)cccc3-c3cnn(CCC#N)c3)nc12)-c1cccc(C#N)c1F

Nc1nc(cn2nc(Cc3c(F)cccc3-c3cnn(CC(=O)N4CC(O)C4)c3)nc12)-c1cccc(C#N)c1F

Cc1cccnc1COc1nc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncn3)n2n1

Nc1nc(cn2nc(Cc3ncccc3Nc3cnn(Cc4ccncc4)c3)nc12)-c1cccc(C#N)c1F

Nc1nc(cn2nc(Cc3ncccc3Nc3cnn(c3)C3CCOCC3)nc12)-c1cccc(C#N)c1F

Cn1cc(cn1)-c1cccnc1Cc1nc2c(N)nc(-c3cccc(c3)C#N)c(-c3ccncn3)n2n1

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncn2)n2nc(Cc3ccccc3CN3CC[C@H](O)C3)nc12 |r|

Nc1nc(-c2cccc(c2)C#N)c(-c2ccc3nccn3c2)n2ncnc12

Nc1nc(-c2cccc(c2)C#N)c(-c2ccncc2F)n2nc(nc12)C(=O)N1CCC1 |(.33,-4.44,;.33,-2.9,;-1.01,-2.13,;-1.01,-.59,;-2.34,.18,;-2.34,1.72,;-3.67,2.49,;-5.01,1.72,;-5.01,.18,;-3.67,-.59,;-6.34,-.59,;-7.67,-1.36,;.33,.18,;.33,1.72,;-1.01,2.49,;-1.01,4.03,;.33,4.8,;1.66,4.03,;1.66,2.49,;2.99,1.72,;1.66,-.59,;3.13,-.12,;4.03,-1.36,;3.13,-2.61,;1.66,-2.13,;5.57,-1.36,;6.34,-.03,;6.34,-2.7,;5.57,-4.03,;6.9,-4.8,;7.67,-3.47,)|

Cc1cc(cc(C)n1)-c1c(nc(N)c2nc(nn12)C(O)c1c(F)cccc1F)-c1cccc(C#N)c1F

COc1cccc(Cc2nc3c(N)nc(-c4cccc(c4)C#N)c(-c4ccc(=O)n(C)n4)n3n2)n1

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)c1cn2c(N)nc(cc2n1)-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|

Nc1nc(cc2nc(Cc3c(F)cccc3CN3CCC(C3)c3nn[nH]n3)nn12)-c1cccc(C#N)c1F

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

CCCCCn1c2cc[nH]c2c(=O)n2c(C)nnc12

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(Cc2cncc(Cl)c2)c1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(Cc2cncc(C)c2)c1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(Cc2cnc3ccsc3c2)c1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(Cc2ccn3ccnc3c2)c1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(Cc2cnc3cccnc3c2)c1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(Cc2cnc3cnn(C)c3c2)c1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(Cc2cccnc2)c1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(Cc2cncc(F)c2)c1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(Cc2ccccc2)c1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1ccc(cc1)S(=O)(=O)Nc1ccc(C)cc1

CCCCCn1c2cc([nH]c2c(=O)n2c(nnc12)C(F)(F)F)-c1cnn(Cc2cnc3cccnc3c2)c1

CCCCCn1c2nnc(C)n2c(=O)c2[nH]cc(Br)c12

CCCCCn1c2nnc(C)n2c(=O)c2[nH]cc(C)c12

CCCCCn1c2nnc(C)n2c(=O)c2[nH]cc(-c3ccccc3)c12

CCCCCn1c2nnc(C)n2c(=O)c2[nH]cc(C#N)c12

CCCCCn1c2nnc(C)n2c(=O)c2[nH]cc(-c3cnn(Cc4ccccc4)c3)c12

CCCCCn1c2cc[nH]c2c(=O)n2c(C)cnc12

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1ncccn1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1nccc(n1)C#N

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1nccc(N)n1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1nccc(NCCO)n1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1nccc(NC)n1

CCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1ncccn1

CCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1nccc(n1)C#N

CCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1nccc(C)n1

CCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1nccc(OC)n1

CCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1nccc(N)n1

CCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(c1)C1CN(C1)c1ncc(F)c(N)n1

CCCCCn1c2cc([nH]c2c(=O)n2c(C)nnc12)-c1cnn(Cc2ccc3CN(CCc3c2)C(=O)CN(C)C)c1

CC(C)n1cc(ccc1=O)-c1cc2c(nc1-c1ccccc1)[nH]ccc2=O

Cc1cc(cc(Cl)n1)-c1cc2c(nc1-c1cccc(C#N)c1C)[nH]ccc2=O

Cc1cc(cc(Cl)n1)-c1cc2c(nc1-c1cccc(c1)C#N)[nH]ccc2=O

CC(C)n1cc(cc(Cl)c1=O)-c1cc2c(nc1-c1ccccc1)[nH]ccc2=O

Cc1c(cccc1-c1nc2[nH]ccc(=O)c2cc1-c1ccc2ncccc2c1)C#N

O=c1cc[nH]c2nc(-c3cccc(c3)C#N)c(cc12)-c1ccc2ncccc2c1

O=c1cc[nH]c2nc(-c3cccc(c3)C#N)c(cc12)-c1ccc2[nH]ncc2c1

O=c1cc[nH]c2nc(-c3cccc(c3)C#N)c(cc12)-c1ccc2ncsc2c1

O=c1cc[nH]c2nc(-c3cccc(c3)C#N)c(cc12)-c1ccc2[nH]cnc2c1

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|