2979 SMILES Strings for Serine/threonine-protein kinase ATR

Compound Name
SMILES String
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(cc1)[C@@H]1COCCN1 |r|
C[C@@H]1COCCN1c1cc(C[S@](C)(=N)=O)nc(n1)-c1ccnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1(CC1)[S@](C)(=N)=O |r|
CNc1nc2ccccc2n1-c1nc(cc(n1)C1(CC1)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1(CC1)[S@@](C)(=N)=O
CNc1cc2c(ccnc2[nH]1)-c1nc(cc(n1)C1(CC1)[S@@](C)(=N)=O)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)C1(CC1)[S@](C)(=N)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)C1(CC1)[S@@](C)(=N)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2ccccc12)C1(CC1)[S@](C)(=N)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2ccccc12)C1(CC1)[S@@](C)(=N)=O |r|
CNc1nc2c(F)cccc2n1-c1nc(cc(n1)C1(CC1)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2c(F)cccc2n1-c1nc(cc(n1)C1(CC1)[S@@](C)(=N)=O)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1cncc2[nH]ccc12)C1(CC1)S(C)(=N)=O |r|
CNc1cc2c(cncc2[nH]1)-c1nc(cc(n1)C(C)(C)[S@@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1cc2c(cncc2[nH]1)-c1nc(cc(n1)C(C)(C)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2ccccc2n1-c1nc(cc(n1)C1(CCOCC1)[S@@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2ccccc2n1-c1nc(cc(n1)C1(CCOCC1)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)C1(CCOCC1)[S@@](C)(=N)=O |r|
CNc1nc2c(F)cccc2n1-c1nc(cc(n1)C(C)(C)[S@@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2c(F)cccc2n1-c1nc(cc(n1)C(C)(C)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2ccc(F)cc2n1-c1nc(cc(n1)C(C)(C)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2cc(F)ccc2n1-c1nc(cc(n1)C(C)(C)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2cc(F)ccc2n1-c1nc(cc(n1)C(C)(C)[S@@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2ccc(F)cc2n1-c1nc(cc(n1)C(C)(C)[S@@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2ccc(F)cc2n1-c1nc(cc(n1)C1(CC1)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2cc(F)ccc2n1-c1nc(cc(n1)C1(CC1)[S@@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2cc(F)ccc2n1-c1nc(cc(n1)C1(CC1)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2ccc(F)cc2n1-c1nc(cc(n1)C1(CC1)[S@@](C)(=N)=O)N1CCOC[C@H]1C |r|
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C1CC(=NO1)c1ccccc1 |c:23|
CNCc1ccc(cc1)C1=NOC(C1)c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C |t:10|
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cn(nn1)-c1ccccc1
Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
C[C@@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
C[C@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
C[C@H](CO)C(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)C(C)(C)O
Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2c1
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.99,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;8.5,-1.56,;9.99,-1.95,;7.87,-.15,;8.64,1.19,)|
CN(C)CCCOc1ccc(cn1)-c1cc2c3n(c(=O)n(C)c3cnc2cc1F)C1(C)CCOCC1
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4COC4)c3c2c1
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4C[C@H](O)C4)c3c2c1 |r,wD:25.25,27.28,(-9.98,.47,;-8.65,1.24,;-8.65,2.78,;-7.32,.47,;-5.98,1.24,;-4.65,.47,;-3.32,1.24,;-1.98,.47,;-.65,1.24,;.68,.47,;.68,-1.07,;-.65,-1.84,;-1.98,-1.07,;2.02,-1.84,;2.02,-3.38,;3.35,-4.15,;4.69,-3.38,;6.02,-4.15,;7.35,-3.38,;7.35,-1.84,;8.5,-.81,;9.98,-1.21,;7.87,.6,;8.64,1.93,;6.34,.43,;5.25,1.52,;3.71,1.52,;3.71,3.06,;2.62,4.15,;5.25,3.06,;6.02,-1.07,;4.69,-1.84,;3.35,-1.07,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;.68,-4.9,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.98,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;8.5,-1.56,;9.98,-1.95,;7.87,-.15,;8.64,1.19,)|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(c3c2c1)C1(C)CCOCC1
CN(C)CCCOc1ccc(cn1)-c1cc2c3n(C4CCOCC4)c(=O)n(C)c3cnc2cc1F
CN(C)CCCOc1ccc(cn1)-c1cc2c3n(C4COC4)c(=O)n(C)c3cnc2cc1F
CN(C)CCCOc1ccc(cn1)-c1cc2c3n([C@@H]4CCCOC4)c(=O)n(C)c3cnc2cc1F |r|
CN(C)CCCOc1ccc(cn1)-c1cc2c3n([C@H]4CCCOC4)c(=O)n(C)c3cnc2cc1F |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)[nH]c1=O |r,wD:4.6,2.1,(3.69,4.9,;3.29,3.41,;4.38,2.32,;4.38,.78,;5.92,.78,;5.92,2.32,;7.01,-.31,;6.69,-1.82,;8.02,-2.59,;8.02,-4.13,;6.69,-4.9,;5.36,-4.13,;4.02,-4.9,;2.69,-4.13,;2.69,-2.59,;4.02,-1.82,;5.36,-2.59,;1.36,-1.82,;1.36,-.28,;.02,.49,;-1.31,-.28,;-2.64,.49,;-3.98,-.28,;-5.31,.49,;-6.65,-.28,;-7.98,.49,;-9.31,-.28,;-7.98,2.03,;-1.31,-1.82,;.02,-2.59,;9.17,-1.56,;8.54,-.15,;9.31,1.19,)|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n(C4CCOCC4)c3c2c1
Cn1c2cnc3ccc(cc3c2n([C@@H]2C[C@H](O)C2)c1=O)-c1ccc(OCCCN2CCC2)nc1 |r,wD:13.14,15.17,(10.26,-1.21,;8.77,-.81,;7.63,-1.84,;7.63,-3.38,;6.3,-4.15,;4.96,-3.38,;3.63,-4.15,;2.29,-3.38,;2.29,-1.84,;3.63,-1.07,;4.96,-1.84,;6.3,-1.07,;6.62,.43,;5.53,1.52,;3.99,1.52,;3.99,3.06,;2.9,4.15,;5.53,3.06,;8.15,.6,;8.92,1.93,;.96,-1.07,;.96,.47,;-.37,1.24,;-1.71,.47,;-3.04,1.24,;-4.37,.47,;-5.71,1.24,;-7.04,.47,;-8.37,1.24,;-8.77,2.73,;-10.26,2.33,;-9.86,.84,;-1.71,-1.07,;-.37,-1.84,)|
Cn1c2cnc3ccc(cc3c2n([C@@H]2C[C@H](O)C2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r,wD:13.14,15.17,(10.5,-1.21,;9.02,-.81,;7.87,-1.84,;7.87,-3.38,;6.54,-4.15,;5.2,-3.38,;3.87,-4.15,;2.54,-3.38,;2.54,-1.84,;3.87,-1.07,;5.2,-1.84,;6.54,-1.07,;6.86,.43,;5.77,1.52,;4.23,1.52,;4.23,3.06,;3.14,4.15,;5.77,3.06,;8.39,.6,;9.16,1.93,;1.2,-1.07,;1.2,.47,;-.13,1.24,;-1.46,.47,;-2.8,1.24,;-4.13,.47,;-5.47,1.24,;-6.8,.47,;-8.13,1.24,;-8.13,2.78,;-9.6,3.25,;-10.5,2.01,;-9.6,.76,;-1.46,-1.07,;-.13,-1.84,)|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCCOC4)c3c2c1 |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.98,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;-.65,-4.13,;8.5,-1.56,;9.98,-1.95,;7.87,-.15,;8.64,1.19,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;.68,-4.9,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.98,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;-.65,-4.13,;8.5,-1.56,;9.98,-1.95,;7.87,-.15,;8.64,1.19,)|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2c1
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCCOC4)c3c2c1 |r|
Cn1c2cnc3cc(F)c(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
Cn1c2cnc3cc(F)c(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(4.18,4.94,;3.41,3.61,;4.18,2.27,;4.18,.73,;5.72,.73,;5.72,2.27,;6.81,-.35,;6.49,-1.86,;7.82,-2.63,;7.82,-4.17,;6.49,-4.94,;5.15,-4.17,;3.82,-4.94,;2.49,-4.17,;1.15,-4.94,;2.49,-2.63,;3.82,-1.86,;5.15,-2.63,;1.15,-1.86,;1.15,-.32,;-.18,.45,;-1.51,-.32,;-2.85,.45,;-4.18,-.32,;-5.52,.45,;-6.85,-.32,;-8.18,.45,;-8.18,1.99,;-9.65,2.46,;-10.55,1.22,;-9.65,-.03,;-1.51,-1.86,;-.18,-2.63,;8.97,-1.6,;10.55,-2.03,;8.34,-.19,;9.11,1.14,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.62,4.9,;3.22,3.41,;4.31,2.32,;4.31,.78,;5.85,.78,;5.85,2.32,;6.93,-.31,;6.61,-1.82,;7.95,-2.59,;7.95,-4.13,;6.61,-4.9,;5.28,-4.13,;3.95,-4.9,;2.61,-4.13,;2.61,-2.59,;3.95,-1.82,;5.28,-2.59,;1.28,-1.82,;1.28,-.28,;-.05,.49,;-1.39,-.28,;-2.72,.49,;-4.06,-.28,;-5.39,.49,;-6.72,-.28,;-8.06,.49,;-8.06,2.03,;-9.52,2.51,;-10.43,1.26,;-9.52,.02,;-1.39,-1.82,;-.05,-2.59,;9.09,-1.56,;10.43,-2.33,;8.47,-.15,;9.24,1.19,)|
Cn1c2cnc3ccc(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1
Cn1c2cnc3ccc(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.76,4.9,;3.37,3.41,;4.45,2.32,;4.45,.78,;5.99,.78,;5.99,2.32,;7.08,-.31,;6.76,-1.82,;8.1,-2.59,;8.1,-4.13,;6.76,-4.9,;5.43,-4.13,;4.1,-4.9,;2.76,-4.13,;2.76,-2.59,;4.1,-1.82,;5.43,-2.59,;1.43,-1.82,;1.43,-.28,;.09,.49,;-1.24,-.28,;-2.57,.49,;-3.91,-.28,;-5.24,.49,;-6.57,-.28,;-7.91,.49,;-7.91,2.03,;-9.24,2.8,;-10.57,2.03,;-10.57,.49,;-9.24,-.28,;-1.24,-1.82,;.09,-2.59,;9.24,-1.56,;10.57,-2.33,;8.61,-.15,;9.38,1.19,)|
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCC2)nc1 |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)[nH]c1=O |r,wD:4.6,2.1,(4.21,4.9,;3.81,3.41,;4.9,2.32,;4.9,.78,;6.44,.78,;6.44,2.32,;7.53,-.31,;7.21,-1.82,;8.54,-2.59,;8.54,-4.13,;7.21,-4.9,;5.88,-4.13,;4.54,-4.9,;3.21,-4.13,;3.21,-2.59,;4.54,-1.82,;5.88,-2.59,;1.87,-1.82,;1.87,-.28,;.54,.49,;-.79,-.28,;-2.13,.49,;-3.46,-.28,;-4.79,.49,;-6.13,-.28,;-7.46,.49,;-7.46,2.03,;-8.93,2.51,;-9.83,1.26,;-8.93,.02,;-.79,-1.82,;.54,-2.59,;9.69,-1.56,;9.06,-.15,;9.83,1.19,)|
O=c1[nH]c2cnc3ccc(cc3c2n1C1CCOCC1)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.37,4.9,;2.97,3.41,;4.06,2.32,;4.06,.78,;5.6,.78,;5.6,2.32,;6.69,-.31,;6.37,-1.82,;7.71,-2.59,;7.71,-4.13,;6.37,-4.9,;5.04,-4.13,;3.7,-4.9,;2.37,-4.13,;2.37,-2.59,;3.7,-1.82,;5.04,-2.59,;1.04,-1.82,;1.04,-.28,;-.3,.49,;-1.63,-.28,;-2.96,.49,;-4.3,-.28,;-5.63,.49,;-6.96,-.28,;-8.3,.49,;-8.7,1.98,;-10.18,1.58,;-9.79,.1,;-1.63,-1.82,;-.3,-2.59,;8.85,-1.56,;10.18,-2.33,;8.22,-.15,;8.99,1.19,)|
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCC2)nc1
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2c1
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCCOC4)c3c2c1 |r|
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4C[C@@H](C4)OC)c3c2c1 |r,wD:24.24,26.29,(-9.91,.47,;-8.57,1.24,;-7.24,.47,;-5.91,1.24,;-4.57,.47,;-3.24,1.24,;-1.91,.47,;-.57,1.24,;.76,.47,;.76,-1.07,;-.57,-1.84,;-1.91,-1.07,;2.1,-1.84,;2.1,-3.38,;3.43,-4.15,;4.76,-3.38,;6.1,-4.15,;7.43,-3.38,;7.43,-1.84,;8.57,-.81,;9.91,-1.58,;7.95,.6,;8.72,1.93,;6.42,.43,;5.33,1.52,;3.79,1.52,;3.79,3.06,;5.33,3.06,;2.7,4.15,;1.21,3.75,;6.1,-1.07,;4.76,-1.84,;3.43,-1.07,)|
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCC4)c3c2c1
Cn1c2cnc3cc(F)c(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1cc2c3n([C@H]4CCCOC4)c(=O)n(C)c3cnc2cc1F |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n(C4CCC4)c3c2c1
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n(C4COC4)c3c2c1
Cn1c2cnc3cc(F)c(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n([C@H]2CCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n(C2COC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1F |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(NCCCN3CCCCC3)nc2)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(NCCCN3CCCCC3)nc2)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r|
CO[C@H]1CC[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCNCC4)c3c2c1
COC(=O)N1CCC(CC1)n1c2c(cnc3ccc(cc23)-c2ccc(OC)nc2)n(C)c1=O
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2c1
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1cnn(CCCO)c1
Cn1c2cnc3ccc(cc3c2n(C2CNC2)c1=O)-c1cnc2[nH]ccc2c1
Cn1c2cnc3ccc(cc3c2n(C2CC2)c1=O)-c1cnc2[nH]ccc2c1
Cn1c2cnc3ccc(cc3c2n(C2CC2)c1=O)-c1cnc(N)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1cnc(N)nc1
COc1ncc(cc1NS(=O)(=O)C1CC1)-c1ccc2ncc3n(C)c(=O)n(C4CC4)c3c2c1
CCOC(=O)N=S(C)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CS(=N)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CS(=O)(=O)c1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C1CCC(OC1)n1nccc1-c1nccc2c(cc(nc12)N1CCOCC1)C1=CCOCC1 |t:32|
CN=S(C)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
Cc1cc(ncc1-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CS(=O)(=O)c1ccccc1-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
COP(=O)(OC)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CC(=C)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C1CCC(OC1)n1nccc1-c1nccc2c(cc(nc12)N1CCOCC1)-c1ccccc1
CCSc1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CCOC(=O)N=S(C)(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CN1CCC(=CC1)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1 |c:4|
CS(=O)(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
Cc1cc(cnc1S(C)(=O)=O)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C1CCC(OC1)n1nccc1-c1nccc2c(cc(nc12)N1CCOCC1)C1=CCNCC1 |t:32|
C1CC1c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CS(=N)(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CS(=O)(=O)c1nc(cs1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
COc1cc(ccn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CSc1ccc(c(F)c1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CC(C)Sc1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C[C@@H]1COCCN1c1cc(-c2ccc(cc2)S(C)(=O)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccccc2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cccc(c2)S(C)(=O)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(C2CC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CCOC(=O)N=S(C)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
CCOC(=O)N=S(C)(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
CS(=O)(=O)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccnn3C3CCCCO3)c2n1)S(C)(=O)=O |r|
N#Cc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C[C@@H]1COCCN1c1cc(C#N)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
NC(=O)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
[O-]C(=O)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
OCc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1cccn1C(=O)OC(C)(C)C)N1CCOCC1
CS(=O)(CCCO)=NC(=O)C(F)(F)F
CCOc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
COc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CC(C)(O)COc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C(Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1)C1CCCO1
O=C1OCCC1Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1cc(COc2cc(nc3c(nccc23)-c2ccn[nH]2)N2CCOCC2)on1
Cc1cc(COc2cc(nc3c(nccc23)-c2ccn[nH]2)N2CCOCC2)no1
C(Oc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1)c1ccccc1
CC(C)Oc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(OCCCCNC(=O)OC(C)(C)C)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
COc1cc(nc2c(Cl)nccc12)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(OCCCNC(=O)OC(C)(C)C)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(OCCN)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(OCCNC(=O)OC(C)(C)C)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(OCCCCN)c2ccnc(-c3ccn[nH]3)c2n1 |r|
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1[C@@H](C)COC[C@H]1C |r|
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1[C@H](C)COC[C@H]1C |r|
C1CC(CCO1)c1cc(cc2c(nccc12)-c1cc[nH]n1)N1CCOCC1
C1CCC(OC1)n1nccc1-c1nccc2ccc(nc12)N1CCOCC1
COC(=O)c1ccnc(Cl)c1NC(=O)OC(C)(C)C
CSc1cc(cc2c(cccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(N=S2(=O)CCOCC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CS(C)(=O)=Nc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C[C@@H]1COCCN1c1cc(N2CCNCC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CC(C)Oc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@@H]1C |r|
CC(C)Oc1cc(nc2c(nccc12)-c1cc[nH]c1)N1CCOCC1
CCn1nccc1-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2cncn2C)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccccc2N)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cccc(F)c2F)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(nc2C)S(C)(=O)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CSc1ccc(c(F)c1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2cc(F)ccc2N)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cncn2Cc2ccccc2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccccc2F)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnc(C)s2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnc(cc2C)S(C)(=O)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C2CC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(cc2F)N2CCNCC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N2CCN(CC2)S(C)(=O)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N(C)CC(C)(C)C)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N2CCC(CO)CC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N(C)C2CC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N2CCn3ccnc3C2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N(C)c2ccc(F)cc2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(C)nc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cccnc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2c(C)ccnc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r,wU:1.0,(-.67,4.21,;-2,3.44,;-3.33,4.21,;-4.67,3.44,;-4.67,1.9,;-3.33,1.13,;-2,1.9,;-.67,1.13,;-.67,-.41,;.67,-1.18,;.67,-2.72,;-.67,-3.49,;-2,-2.72,;-.67,-5.03,;.67,-5.8,;2,-5.03,;2,-3.49,;3.33,-2.72,;2,-.41,;3.33,-1.18,;4.67,-.41,;4.67,1.13,;3.33,1.9,;3.33,3.44,;2.09,4.34,;2.56,5.8,;4.1,5.8,;4.58,4.34,;2,1.13,;.67,1.9,)|
C[C@@H]1COCCN1c1cc(-c2cccn2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnc(F)c(C)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(C)nc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(F)nc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
COc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
COc1ncc(cc1C)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2ccc(F)nc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cc(nn2C)C(F)(F)F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2sccc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(C)s2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cscc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2sccc2Cl)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccsc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnc3[nH]ccc23)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2c(C)noc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r,wU:1.0,(-.67,3.85,;-2,3.08,;-3.33,3.85,;-4.67,3.08,;-4.67,1.54,;-3.33,.77,;-2,1.54,;-.67,.77,;-.67,-.77,;.67,-1.54,;.67,-3.08,;-.58,-3.99,;-1.91,-3.22,;-.1,-5.45,;1.44,-5.45,;1.91,-3.99,;3.25,-3.22,;2,-.77,;3.33,-1.54,;4.67,-.77,;4.67,.77,;3.33,1.54,;3.33,3.08,;2.09,3.99,;2.56,5.45,;4.1,5.45,;4.58,3.99,;2,.77,;.67,1.54,)|
COc1nccc(c1Cl)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(C2CCOCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(C2=CCSCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r,t:11|
CC1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C(C)(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cc(C)no2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CCn1nc(C)cc1-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2c(C)cnn2C)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r,wU:1.0,(-2.82,3.85,;-4.15,3.08,;-5.49,3.85,;-6.82,3.08,;-6.82,1.54,;-5.49,.77,;-4.15,1.54,;-2.82,.77,;-2.82,-.77,;-1.49,-1.54,;-1.49,-3.08,;-.24,-3.99,;1.09,-3.22,;-.72,-5.45,;-2.26,-5.45,;-2.73,-3.99,;-4.07,-3.22,;-.15,-.77,;1.18,-1.54,;2.51,-.77,;2.51,.77,;1.18,1.54,;1.18,3.08,;-.06,3.99,;.41,5.45,;1.95,5.45,;2.43,3.99,;3.89,3.51,;5.04,4.54,;6.5,4.06,;6.82,2.56,;5.68,1.53,;4.21,2,;-.15,.77,;-1.49,1.54,)|
CSc1ccc(c(C)n1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
CCCn1nccc1-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2cnc3CCCn23)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CCn1nc(cc1-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C)C(F)(F)F |r|
COC(=O)c1ccc(-c2cc(nc3c(nccc23)-c2ccnn2C2CCCCO2)N2CCOC[C@H]2C)n1C(=O)OC(C)(C)C |r|
C[C@@H]1COCCN1c1cc(-c2ccns2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccccc2N(C)C)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(F)cc2F)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CC(C)n1nccc1-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
CCOP(C)(=O)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
CCS(=O)(CC)=Nc1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
CC(C)COP(C)(=O)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
COC(=O)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
CCC(O)(CC)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2cncc(Cl)c2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(F)cc2N)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cccc(c2F)S(C)(=O)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C2COC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(cc2F)N2CCCC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
COCc1noc(C)c1-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r,wU:35.41,(3.73,-3.22,;2.39,-3.99,;1.06,-3.22,;-.27,-3.99,;-.75,-5.45,;-2.29,-5.45,;-2.77,-3.99,;-4.1,-3.22,;-1.52,-3.08,;-1.52,-1.54,;-2.85,-.77,;-2.85,.77,;-1.52,1.54,;-.19,.77,;1.15,1.54,;2.48,.77,;2.48,-.77,;1.15,-1.54,;-.19,-.77,;1.15,3.08,;-.1,3.99,;.38,5.45,;1.92,5.45,;2.39,3.99,;3.88,3.59,;4.97,4.68,;6.46,4.28,;6.86,2.79,;5.77,1.7,;4.28,2.1,;-4.19,1.54,;-5.52,.77,;-6.86,1.54,;-6.86,3.08,;-5.52,3.85,;-4.19,3.08,;-2.85,3.85,)|
C[C@@H]1COCCN1c1cc(C(=O)NN)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N=S2(=O)CCCC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2ccc(F)cc2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2ccccc2F)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2ccccc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@H]1COCCN1c1cc(N=S(C)(=O)c2ccccc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccnn3C3CCCCO3)c2n1)P(C)(C)=O |r|
CCP(=O)(CC)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
CCOP(=O)(CC(C)C)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(N2CCOCC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CC(C)Cn1nccc1-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2cnc(c(F)c2)S(C)(=O)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1 |r|
C[C@@H]1COCCN1c1cc(-c2[nH]ncc2C)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cc(ccc2F)S(C)(=O)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CC(C)S(=O)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2cccc(F)n2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CCn1cnc(c1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(N2CCCC2C(N)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cccnc2N)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2CC(F)(F)F)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N2CCN(C)C(=O)C2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccn(CCF)n2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2CCF)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccn(CCOC3CCCCO3)n2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccn(CC(C)(C)O)n2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1CN(CCO1)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(F)cn2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cccc(C)n2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ncccc2C)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccccc2NC(C)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cccnc2O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cccc(c2)C(C)(C)O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C1CCC(OC1)n1nccc1-c1nccc2c(cc(nc12)N1CCOCC1)N1CCn2ccnc2C1
C[C@H]1CN(CCO1)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1 |r|
C[C@H]1C[C@@H]1c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(OC(F)F)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CC(C)(O)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C1CC2COCC1N2c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C[C@@H]1COCCN1c1cc(N2CCCC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
O=C1CN(CCN1)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CP(C)(=O)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C[C@H]1CN([C@H](C)CN1)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1 |r|
C[C@H]1CN(C[C@@H](C)N1)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1 |r|
OC1(CN(C1)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1)C(F)(F)F
COP(O)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN1CCN(CC1)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C1OC[C@@H]2CN(C[C@H]12)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1 |r|
COC1(C)CN(C1)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C1O[C@H]2C[C@@H]1N(C2)c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1 |r|
C[C@@H]1COCCN1c1cc(O)c2ccnc(-c3ccnn3CCCC[Si](C)(C)C)c2n1 |r|
CN(C)c1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1cc(ccn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccnn3COCC[Si](C)(C)C)c2n1)C1(O)CCCCC1 |r|
C[C@@H]1COCCN1c1cc(-c2cccc(F)c2N)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CS(=N)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
CCNC(=O)N=S(C)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccnn1C1CCCCO1)N1CCOCC1
C[C@@H]1COCCN1c1cc(OCCCN)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(C#CC2CC2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
CCS(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC(C)S(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C[C@@H]1COCCN1c1cc(OCCCS(C)(=O)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|
O=S(=O)(c1ccccc1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC(C)S(=O)(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CCS(=O)(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=S(c1ccccc1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CS(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C[C@@H]1COCCN1c1cc(C2CCS(=O)CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(C2CCS(=O)(=O)CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccn[nH]2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
CN(C)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(Sc2ccccc2)c2ccnc(-c3ccn[nH]3)c2n1
CC(C)Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CCSc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC(C)Sc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2ccc[nH]2)c2ccnc(-c3ccn[nH]3)c2n1
C1CN(CCO1)c1cc(-c2cc[nH]c2)c2ccnc(-c3ccn[nH]3)c2n1
COc1ccc(Sc2cc(nc3c(nccc23)-c2ccn[nH]2)N2CCOCC2)cc1
Cc1cc(n[nH]1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=C1CCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=S1(=O)CCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=C1CCCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C[C@@H]1COCCN1c1cc(-c2cccnc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
CC(C)Oc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
COc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C1CN(CCO1)c1cc(-c2ccncc2)c2ccnc(-c3ccn[nH]3)c2n1
COc1ccc(Sc2cc(nc3c(nccc23)-c2ccn[nH]2)N2CCOC[C@H]2C)cc1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnc(N3CCOCC3)c2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
Cc1cc(cnc1F)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=C1OCCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=C1OCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C[C@@H]1COCCN1c1cc2c3ccncc3oc3cnc(-c4ccn[nH]4)c(n1)c23 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(F)nc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cc(Cl)cnc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccncc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnc(C)c(C)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnc(C)c(F)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2csc(C)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
COc1ccsc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2ccsc2Cl)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cncc3ccccc23)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(Cl)s2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cc(C)cs2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cc(C)sc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(C2CCSCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(C2=CCCN(C)C2)c2ccnc(-c3ccn[nH]3)c2n1 |r,t:11|
C[C@@H]1COCCN1c1cc(C2=CCN(C)CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r,t:11|
C[C@@H]1COCCN1c1cc(C2CCCN(C)C2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(C2=CCNCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r,t:11|
C[C@@H]1COCCN1c1cc(-c2ccn(n2)C2CCOCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnc(F)cc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnn(C)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cn(C)nc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnn(C)c2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(C2CCNCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2c[nH]nc2C(F)(F)F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnn(c2)C2CCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnn(c2)C2CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
CC(C)n1cc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2cnn(c2)C(F)F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnn(c2)C(C)(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(C)c2C)c2ccnc(-c3ccn[nH]3)c2n1 |r,wU:1.0,(-.67,4.52,;-2,3.75,;-3.33,4.52,;-4.67,3.75,;-4.67,2.21,;-3.33,1.44,;-2,2.21,;-.67,1.44,;-.67,-.1,;.67,-.87,;.67,-2.41,;-.58,-3.32,;-1.91,-2.55,;-.1,-4.78,;1.44,-4.78,;2.21,-6.12,;1.91,-3.32,;3.25,-2.55,;2,-.1,;3.33,-.87,;4.67,-.1,;4.67,1.44,;3.33,2.21,;3.33,3.75,;2.09,4.65,;2.56,6.12,;4.1,6.12,;4.58,4.65,;2,1.44,;.67,2.21,)|
C[C@@H]1COCCN1c1cc(-c2cn(C)nc2C(F)(F)F)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnn(CCO)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
CCn1cc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2ccn(C)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
CC(C)n1ccc(n1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2cc(C)n(C)c2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnn(c2)-c2ccccc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2c[nH]nc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N)c2ccnc(-c3ccn[nH]3)c2n1 |r|
CC(C)Cn1cc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2cn[nH]c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ncco2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
Cc1nn(C)cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1c(cnn1C)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1nn(C)c(C)c1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |(-1.91,-2.55,;-.58,-3.32,;-.1,-4.78,;1.44,-4.78,;2.21,-6.12,;1.91,-3.32,;3.25,-2.55,;.67,-2.41,;.67,-.87,;-.67,-.1,;-.67,1.44,;.67,2.21,;2,1.44,;3.33,2.21,;4.67,1.44,;4.67,-.1,;3.33,-.87,;2,-.1,;3.33,3.75,;2.09,4.65,;2.56,6.12,;4.1,6.12,;4.58,4.65,;-2,2.21,;-2,3.75,;-3.33,4.52,;-4.67,3.75,;-4.67,2.21,;-3.33,1.44,)|
COCCS(C)(=O)=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
CC(C)S(=O)(=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C)c1ccc(Br)cc1 |r|
C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2ccccc2O)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2ccc(Br)cc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N=S(C)(=O)C(C)(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
O=S1(CCOCC1)=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=S1(CCCCC1)=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C[C@@H]1COCCN1c1cc(C(O)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(c2ccnc(\C(N)=C\C=N)c2n1)C(C)(O)C1CCOCC1 |r|
C[C@@H]1COCCN1c1cc(c2ccnc(\C(N)=C\C=N)c2n1)C(C)(O)C(C)(C)C |r|
CCCCC(C)(O)c1cc(nc2c(nccc12)C(\N)=C\C=N)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(C(N)=O)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C[C@@H]1COCCN1c1cc(CO)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|
C(Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1)C1CCOCC1
CN(C)C(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=C(N1CCCCC1)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN(C)C(=O)c1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=C(NC1CC1)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1ccncc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2ccc3cc[nH]c3c2)c2ccnc(-c3ccn[nH]3)c2n1
C1CN(CCO1)c1cc(-c2cccc3[nH]ccc23)c2ccnc(-c3ccn[nH]3)c2n1
NC(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
NC(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CNC(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Clc1ccc(s1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
FC(F)(F)c1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
FC(F)(F)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
FC(F)(F)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Clc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC(=O)Nc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1cc(OC)cc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C(c1ccco1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1cc(cc(C)c1O)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1cccc(c1C)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
OCc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Clc1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1cccc(c1F)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1cccc(c1OC)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN(C)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN(C)c1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CS(=O)(=O)Nc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN(C)C(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C\C=C\c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Oc1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=C(N1CCCCC1)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC(C)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=C(NC1CC1)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2ccc(cc2)-c2ccccc2)c2ccnc(-c3ccn[nH]3)c2n1
COc1ccc(c(OC)c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Clc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1ccc(C)c(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Nc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2cccc(c2)-n2cccn2)c2ccnc(-c3ccn[nH]3)c2n1
Oc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1ccc(F)c(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1ccc(F)cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1ccc(c(F)c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1cccc(c1F)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1cccc(OC)c1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |(-4.67,-3.49,;-3.33,-2.72,;-2,-3.49,;-2,-5.03,;-.67,-5.8,;.67,-5.03,;.67,-3.49,;2,-2.72,;3.33,-3.49,;-.67,-2.72,;-.67,-1.18,;.67,-.41,;.67,1.13,;-.67,1.9,;-2,1.13,;-3.33,1.9,;-4.67,1.13,;-4.67,-.41,;-3.33,-1.18,;-2,-.41,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;2,1.9,;3.33,1.13,;4.67,1.9,;4.67,3.44,;3.33,4.21,;2,3.44,)|
Nc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Clc1cc(Cl)cc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2ccccc2-c2ccccc2)c2ccnc(-c3ccn[nH]3)c2n1
Clc1cc(ccn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2cc3ccccc3s2)c2ccnc(-c3ccn[nH]3)c2n1
CN\C(=C/C=N)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2cccc3ncccc23)c2ccnc(-c3ccn[nH]3)c2n1
C1CN(CCO1)c1cc(-c2cccnc2)c2ccnc(-c3ccn[nH]3)c2n1
Cc1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2cnc3ccccc3c2)c2ccnc(-c3ccn[nH]3)c2n1
O=S(=O)(c1ccccc1)n1c(cc2ccccc12)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Clc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Clc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
OCc1ccc(s1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1ccc(c(Cl)n1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2cncc3ccccc23)c2ccnc(-c3ccn[nH]3)c2n1
Clc1cnccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1cnccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1ccc(c(F)n1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cn1cc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1ccc2n(C(=O)OC(C)(C)C)c(cc2c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1cscc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2cccs2)c2ccnc(-c3ccn[nH]3)c2n1
C1CN(CCO1)c1cc(-c2ccsc2)c2ccnc(-c3ccn[nH]3)c2n1
Cc1ccsc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1cnc(Cl)c(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1ccncc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1ncc(Cl)cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1ccc2n(C(=O)OC(C)(C)C)c(cc2c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1ncc(Cl)cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cc1noc(C)c1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |(-2,5,;-3.33,4.23,;-4.8,4.71,;-5.7,3.47,;-4.8,2.22,;-5.2,.73,;-3.33,2.69,;-2,1.93,;-2,.38,;-.67,-.38,;.67,.38,;.67,1.93,;2,2.69,;2,4.23,;.67,5,;-.67,4.23,;-.67,2.69,;3.33,1.93,;3.33,.38,;4.8,-.09,;5.7,1.15,;4.8,2.4,;-.67,-1.93,;-2,-2.69,;-2,-4.23,;-.67,-5,;.67,-4.23,;.67,-2.69,)|
C1CN(CCO1)c1cc(-c2cccc3cccnc23)c2ccnc(-c3ccn[nH]3)c2n1
Cc1ccc(s1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CCOc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CCOc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2ccc3ncccc3c2)c2ccnc(-c3ccn[nH]3)c2n1
Clc1sccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Nc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2cc[nH]n2)c2ccnc(-c3ccn[nH]3)c2n1
Cc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Cn1cccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Oc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Clc1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1nccc(c1Cl)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Clc1ccsc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
Fc1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CSc1ncc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CC1Nc1ncc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2cccc3cnccc23)c2ccnc(-c3ccn[nH]3)c2n1
CNC(=O)c1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC(C)(C)NC(=O)c1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CSc1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(-c2ccnc3[nH]ccc23)c2ccnc(-c3ccn[nH]3)c2n1
Nc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COC(=O)c1cc(cs1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COc1ncc(cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1)C(F)(F)F
CC(C)Oc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CCOc1ncc(cc1Cl)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC(C)(C)n1cc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
OC1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN(c1ccccc1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CCCN(C)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(N2CCCCCC2)c2ccnc(-c3ccn[nH]3)c2n1
CC1CCCN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
NC(=O)C1CCCN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1C=CCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |c:1|
C1CN(c2ccccc2C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
C1CN(CCO1)c1cc(N2CCc3ccccc3C2)c2ccnc(-c3ccn[nH]3)c2n1
C1N(Cc2ccccc12)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC6(C)CC1CC(C)(CN1c4cc(N2CCOCC2)nc5c(c3ccn[nH]3)nccc45)C6
CC(C)(C)OC(=O)[C@@H]1CCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|
CC(C)CN(C)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN(c1cccc(F)c1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
O=S1(=O)CCC11CN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
FC1CCCN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN(c1ccccc1F)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
NC(=O)[C@H]1CCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|
OCC1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
COC1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN(c1ccc(F)cc1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CNC(=O)[C@@H]1CCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|
CCS(=O)(=O)N1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CS(=O)(=O)N1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN(C1CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CN(CC(C)(C)C)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
OC[C@H]1CCCN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)n(C)c1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)n(CCOC)c1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)n(CCO)c1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)n(CCCN)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C)c(OC)c1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)n(CC#N)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C2CCOC2)c(OC)c1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C1CCOC1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C)c(F)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C)c(C)c1
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CN[C@H]2CCOC2)cc1C |r|
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C2CCCC2)c(C)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C#N
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C#N)c(C)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)COC)c(C)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C2CC2)c(C)c1
CCn1cc(ccc1=O)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC)cc1OC
CC(C)NCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C)c(C)c1
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC(C)(C)C)cc1C
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C1CCC(C)C1
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CN[C@H]2CCOC2)cc1 |r|
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(CCN(C)C)c2)c(C)c1
CCC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC)cc1OC
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(CC(C)C)c2)c(OC)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(CC(F)(F)F)c2)c(C)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(CC(F)(F)F)c2)c(OC)c1
CNCc1ccc(-c2cc(on2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C)c(F)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C#CC)c(C)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)CF)c(C)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C2CCCC2)c(OC)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C2CCC2)c(C)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C#N)c(OC)c1
COc1cc(CNC(C)(C)C)ccc1-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)CO)c(OC)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C2CC2)c(OC)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C(O)=O)c(C)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C)c(c1)C#N
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC(C)(C)C)cc1C#N
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C(F)(F)F)c(OC)c1
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(c1)C(C)N
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C1CCCC1
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC(C)(C)C)cc1
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)C(C)N
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(CNC(C)(C)C)c1
CNCc1cccc(c1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1cccc(CNC(C)(C)C)c1
CNCc1cccc(c1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C
CC(C)(C)NCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C1CCCC1
Nc1ncc(nc1-c1cc(no1)-c1ccc(CN2CCCC2)cc1)-c1ccc(=O)n(c1)C1CCCC1
CC(C)(CO)NCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C1CCCC1
CC(N)c1cccc(c1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C1CCCC1
CNCc1ccc(-c2cc(on2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C2CC2)c(F)c1
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1cccc(c1)C(C)N
CNCc1ccc(-c2cc(on2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C2CCCC2)c(F)c1
CC(N)c1cccc(c1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C1CC1
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(cc1)C(N)CF
CC(C)NCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2CC2)cc1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CC2CC2)c1
CCNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C
CNCc1ccc(-c2cc(on2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C)c(OC)c1
CC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNc2ccccc2)cc1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C1CCOCC1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1cc(C=C)c(=O)n(c1)C(C)C
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CC2(C)CC2)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(Cc2ccoc2)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CCN2CCCC2=O)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1cc(Br)c(=O)n(c1)C(C)C
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CC2CC2C)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CCC#N)c1
CCC(Cn1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1)OC
CCc1cc(cn(C(C)C)c1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)[nH]c1
CC[C@H](C)CCn1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1 |r|
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1c[nH]c(=O)c(Br)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C1CC1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CC2(CO)CC2)c1
CCn1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1
CCC(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(Cc2nccs2)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(Cc2nccn2C)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CC2CCCO2)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CC2CCCCO2)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1c[nH]c(=O)c(CO)c1
CCc1cc(c[nH]c1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1c[nH]c(=O)c(Cl)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C(=O)NC
Nc1ncc(nc1-c1cc(no1)-c1ccc(CNC2CC2)cc1)-c1ccc(=O)n(c1)C1CCCC1
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2CC2)cc1
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1cccc(c1)C(C)N
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CCOC)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CCC2CC2)c1
CC[C@H](C)Cn1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1 |r|
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CC(N)=O)c1
CC(C#N)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2CC2)cc1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1c[nH]c(=O)c(c1)C(C)C
CCN(CC)C(=O)C(C)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C(=O)N1CCCC1
CC(N)c1cccc(c1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)[nH]c1
CC(N)c1cccc(c1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)C(N)=O
CC(N)c1cccc(c1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CC2(C)CC2)c1
CC(N)c1cccc(c1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CC2CC2C)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1c[nH]c(=O)c(c1)C1CCCC1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(C)c1
CCCn1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CCO)c1
Nc1ncc(nc1-c1cc(no1)-c1ccc(CNC2CC2)cc1)-c1ccc(=O)[nH]c1
Nc1ncc(nc1-c1cc(no1)-c1ccc(CNC2CC2)cc1)-c1c[nH]c(=O)c(Cl)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CC2(C)COC2)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1c[nH]c(=O)c(c1)C1=CCCCC1 |t:32|
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1c[nH]c(=O)c(c1)C1CCCCC1
CCCC(CC)c1cc(c[nH]c1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(CO)CO
CNCc1ccc(-c2cc(on2)-c2nc(cnc2N)-c2ccc(=O)n(c2)C(C)C)c(OC(C)C)c1
Nc1ncc(nc1-c1cc(no1)-c1ccc(CNC2CC2)cc1)-c1c[nH]c(=O)c(c1)C1CCCC1
CCCC(CC)c1cc(c[nH]c1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2CC2)cc1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1cc(F)c(=O)n(c1)C(C)C
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(CCC2CCCC2)c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1c[nH]c(=O)c(c1)-c1ccccc1
CC(N)c1cccc(c1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C1CCC(C)C1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)(C)C#N
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNCCF)cc1
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2CC(F)(F)C2)cc1
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2CC2)cc1F
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1F
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CN[C@@H]2CCC(F)C2)cc1 |r|
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1cccc(c1)C(N)CF
CCC(CC)c1cc(c[nH]c1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1F
CCC(N)c1cccc(c1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(CC)CC
CCC(CC)(C#N)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1
CCC(CC)(C#N)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC)cc1F
CCC(CC)(C#N)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2CC2)cc1F
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1cccc(c1)C1(N)CC1
CCC(CC)(C#N)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1cccc(c1)[C@@H](C)N |r|
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2(C)CC2)cc1
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(F)c(c1)C(C)N
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1cccc(C(C)N)c1F
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C1(CCCC1)C#N
CC(C)(C#N)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2CC2)cc1
CC(C)(C#N)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2CCOC2)cc1
CCC(CC)n1cc(ccc1=O)-c1cnc(N)c(n1)-c1cc(no1)-c1cccc(c1)C(C)(C)N
CC(CO)NCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(=O)n(c1)C(C)(C)C#N
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)[nH]c1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(=O)n(C(C)C)c1C#N
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(C(C)C)c2C)c(C)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(=O)n(C(C)C)c2C#N)c(C)c1
Cc1ccncc1NC(=O)c1c(N)nn2cc3CNCCc3nc12
COc1ccncc1NC(=O)c1c(N)nn2cc3CNCCc3nc12
CC(C)Oc1ccncc1NC(=O)c1c(N)nn2cc3CNCCc3nc12
Nc1nn2cc3CNCCc3nc2c1C(=O)Nc1cnccc1OCC(F)(F)F
COc1c(Cl)cncc1NC(=O)c1c(N)nn2cc3CNCCc3nc12
COc1cc(Cl)ncc1NC(=O)c1c(N)nn2cc3CNCCc3nc12
COc1cc(Cl)ncc1NC(=O)c1c(N)nn2cc3CN(C)CCc3nc12
Nc1nn2cc3CNCCc3nc2c1C(=O)Nc1cnccc1OC1CCOCC1
COc1ncncc1NC(=O)c1c(N)nn2cc3CNCCc3nc12
CC(C)Oc1ncncc1NC(=O)c1c(N)nn2cc3CNCCc3nc12
CN1CCc2nc3c(C(=O)Nc4cnccc4C4CC4)c(N)nn3cc2C1
CN1CCc2nc3c(C(=O)Nc4cncc(F)c4C4CC4)c(N)nn3cc2C1
COc1ccncc1NC(=O)c1c(N)nn2cc3CN(C)CCc3nc12
CN1CCc2nc3c(C(=O)Nc4cnccc4OC4COC4)c(N)nn3cc2C1
CN1CCc2nc3c(C(=O)Nc4cncnc4C4CC4)c(N)nn3cc2C1
CC(C)Oc1ncncc1NC(=O)c1c(N)nn2cc3CN(C)CCc3nc12
COc1ccncc1NC(=O)c1c(N)nn2cc3CN(CCc3nc12)C(C)C
COc1ccncc1NC(=O)c1c(N)nn2cc3CN(CCc3nc12)C1CC1
COc1ccncc1NC(=O)c1c(N)nn2cc3CN(CCF)CCc3nc12
Cc1ccncc1NC(=O)c1c(N)nn2cc3CN(CCc3nc12)C1COC1
Nc1nn2cc3CN(CCc3nc2c1C(=O)Nc1cnccc1C1CC1)C1COC1
Nc1nn2cc3CN(CCc3nc2c1C(=O)Nc1cncc(F)c1C1CC1)C1COC1
Nc1nn2cc3CN(CCc3nc2c1C(=O)Nc1cnccc1-c1ccccc1)C1COC1
COc1ccncc1NC(=O)c1c(N)nn2cc3CN(CCc3nc12)C1COC1
COc1cc(Cl)ncc1NC(=O)c1c(N)nn2cc3CN(CCc3nc12)C1COC1
Nc1nn2cc3CN(CCc3nc2c1C(=O)Nc1cncnc1C1CC1)C1COC1
COc1ncncc1NC(=O)c1c(N)nn2cc3CN(CCc3nc12)C1COC1
COCCN1CCc2nc3c(C(=O)Nc4cnccc4C4CC4)c(N)nn3cc2C1
COc1ccncc1NC(=O)c1c(N)nn2cc3CN(CCc3nc12)C(C)(C)C
CN1CCc2nc3c(C(=O)Nc4cnccc4OCC(F)(F)F)c(N)nn3cc2C1
COc1ccncc1NC(=O)c1c(N)nn2cc3CNCC(C)(C)c3nc12
Cn1cncc1-c1ccncc1NC(=O)c1c(N)nn2cc3CN(CCc3nc12)C1COC1
Cc1nsc(NC(=O)c2c(N)nn3cc4CN(CCc4nc23)C2COC2)c1C1CC1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)C1COC1
NC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
CN1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC(C)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)c1c(NC(=O)c2c(N)nn3cc(F)cnc23)cncc1C1CC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-n1ccnc1
CNCCc1cnn(c1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)CCc1cnn(c1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)[C@@H]1CCOC1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)C1CCOCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)[C@H]1CCOC1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C1COC1
CN1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1cncc(NC(=O)c2c(N)nn3cc(F)cnc23)c1N1CCN(CC1)C1COC1
CCN1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN2CCC1CC2 |(-4.03,3.58,;-3.63,2.09,;-4.77,1.06,;-4.15,-.35,;-4.77,-1.75,;-3.87,-3,;-4.49,-4.41,;-2.34,-2.84,;-1.71,-1.43,;-2.62,-.18,;-2.29,1.32,;-.96,2.09,;-.96,3.63,;.37,1.32,;1.71,2.09,;1.71,3.63,;3.04,4.41,;4.37,3.63,;4.37,2.09,;3.04,1.32,;3.04,-.22,;4.43,-.89,;4.77,-2.39,;3.81,-3.59,;2.27,-3.59,;1.31,-2.39,;1.66,-.89,;2.92,-1.23,;3.81,-2.36,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)C1CCOC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC(F)(F)F)CC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN2CCC[C@H]2C1 |r|
COCCN1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
C[C@@H]1CN(CCN1c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12)C1COC1 |r|
C[C@H]1CN(CCN1c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12)C1COC1 |r|
CC1(COC1)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-n1cccn1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-n1cnc(c1)C(F)(F)F
Cc1nccn1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1-n1ccnc1
Cc1nc(cn1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12)C(F)(F)F
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(C2CC12)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(C2CC2)c1N1CCN(CC1)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)C1CC1
CC(C)(C)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN(C)[C@H]1CCN(C[C@@H]1O)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12 |r|
CN(C)CC1(O)CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN(C)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CCN2CCN(CC2C1)C1COC1
CC(C)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN(C)C1CCCN(C1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN1CCN(CC1)c1c(Cl)cncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1C2CCC1CC(O)C2 |TLB:19:20:22.23:28.26.25|
CN1CCCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCn2ccnc2C1
CN(C)CC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
COC1(CN(C)C)CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
COCC1CN(CCN1C)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)C1CCC1
CN(C)CCN1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN1CCN(CC1)c1cc(N)ncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CCN1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN1CCN(CC1)c1cc(Cl)ncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN1CCN(CC1(C)C)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CC1CN(CCN1C)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
NC1CCCN(C1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCN2CCC1CC2 |(-4.03,3.58,;-3.63,2.09,;-4.77,1.06,;-4.15,-.35,;-4.77,-1.75,;-3.87,-3,;-4.49,-4.41,;-2.34,-2.84,;-1.71,-1.43,;-2.62,-.18,;-2.29,1.32,;-.96,2.09,;-.96,3.63,;.37,1.32,;1.71,2.09,;1.71,3.63,;3.04,4.41,;4.37,3.63,;4.37,2.09,;3.04,1.32,;3.04,-.22,;4.43,-.89,;4.77,-2.39,;3.81,-3.59,;2.27,-3.59,;1.31,-2.39,;1.66,-.89,;2.92,-1.23,;3.81,-2.24,)|
CN1CCN(CC1)c1c(C)cncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)C1COC1
CN1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
COCCN1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN1CCN2CCN(CC2C1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CC1(COC1)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1CO)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)C1CC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCN2CCC[C@@H]2C1 |r|
CC1(O)CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCN(CC(F)(F)F)CC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCS(=O)CC1
CC(C)(O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCNC(C1)C(F)(F)F
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCN2CCC[C@H]2C1 |r|
CC1CN(C)CCN1c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
COC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
COC(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCn2cncc2C1
CN1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(cnc12)C(C)(C)C#N
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1N1CCCC1
CC(C#N)c1cnc2c(C(=O)Nc3cnccc3N3CCN(C)CC3)c(N)nn2c1
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1N1CCCCCC1
CN1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1N1CCOCC1
CN1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1N1CCC(O)CC1
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1N1CCCCC1
CN1CCN(CC1)c1c(Cl)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
NC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CNC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCNCC1
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1N1CCNCC1
NCC1CN(CCO1)c1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
NCC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)C(O)=O
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CCC1
CN(C)C1CN(C1)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
COC1CCN(C1)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN1CCN(CC1)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CC[C@@H](F)C1 |r|
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CCC2(COC2)C1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CCS(=O)CC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CCn2cncc2C1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CCn2ccnc2C1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CC[C@H](F)C1 |r|
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CCOCC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CCCC1
CN(C)C1CCN(C1)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
COC1CN(C1)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CC(F)(F)C1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CCC11COC1
CN1CCN(CC1)c1c(NC(=O)c2c(N)nn3cc(F)cnc23)cncc1C(F)F
CN1CCN(CC1)c1c(NC(=O)c2c(N)nn3cc(F)cnc23)cncc1C#N
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN2CCOC[C@@H]2C1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN2CCOC[C@H]2C1 |r|
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCNCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(C2CC2)c1N1CCN(CC1)[C@@H]1CCOC1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(C2CC2)c1N1CCN(CC1)[C@H]1CCOC1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C1CCOCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C1CCOC1
Cc1cncc(NC(=O)c2c(N)nn3cc(F)cnc23)c1N1CCN(CC1)C1CCOCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CCN(CC1)C1CCOC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)[C@H]1CCOC1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CCNCC1
COCCN1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCC(CC1)C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CNc1cc(N2CCN(C)CC2)c(NC(=O)c2c(N)nn3cc(F)cnc23)cn1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)C1CN2CCC1CC2 |(-5.16,5.34,;-4.76,3.85,;-5.91,2.82,;-5.28,1.41,;-5.91,0,;-5,-1.24,;-5.63,-2.65,;-3.47,-1.08,;-2.85,.33,;-3.75,1.57,;-3.43,3.08,;-2.1,3.85,;-2.1,5.39,;-.76,3.08,;.57,3.85,;.57,5.39,;1.91,6.16,;3.24,5.39,;3.24,3.85,;4.57,3.08,;1.91,3.08,;1.91,1.54,;.57,.77,;.57,-.77,;1.91,-1.54,;3.24,-.77,;3.24,.77,;1.91,-3.08,;.57,-3.85,;3.24,-3.85,;4.57,-3.08,;5.91,-3.85,;5.91,-5.39,;4.57,-6.16,;3.24,-5.39,;4.18,-5.39,;5.34,-4.83,)|
CN1CC[C@H](C1)OC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
CN1CC[C@H](C1)OC1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
CN1CCN(CC11CCOCC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)C12CCN(CC1)CC2
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN2CCOC[C@H]2C1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN2C(COCC2=O)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN2CCOC[C@@H]2C1 |r|
CN1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(cnc12)C(C)(C)C#N
CC(C)(O)CN1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCOCC1
CC(C)(C#N)c1cnc2c(C(=O)Nc3cnccc3N3CCN(CC3)C3COC3)c(N)nn2c1
CC(C#N)c1cnc2c(C(=O)Nc3cnccc3N3CCN(CC3)C3COC3)c(N)nn2c1
CC(C)(C#N)c1cnc2c(C(=O)Nc3cncc(F)c3N3CCN(CC3)C3COC3)c(N)nn2c1
CC(C#N)c1cnc2c(C(=O)Nc3cncc(F)c3N3CCN(CC3)C3COC3)c(N)nn2c1
CN(C)S(=O)(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)N1CCCC1=O
CN(C1CCN(C)CC1)S(=O)(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CN2CCOCC2)CC1
CN1CCN(CC2CCN(CC2)c2c(F)cncc2NC(=O)c2c(N)nn3cc(F)cnc23)CC1
CN1CCN(C2CCN(CC2)c2c(F)cncc2NC(=O)c2c(N)nn3cc(F)cnc23)C(=O)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCCCC1
CN1CCC(CC1)OC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)S(=O)(=O)N1CCOCC1
CN1CCC(C1)C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCC[C@H]1C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)S(=O)(=O)C1CCOCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)S(=O)(=O)C1CC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)CN1CCC1
Cc1ncn(n1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1ncnn1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN2C(CCC2=O)C1
CN1CC(C1)OC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CS(=O)(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)S(=O)(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)OCCN1CCCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)C1CNC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)S(=O)(=O)N1CCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)S(=O)(=O)N1CCOCC1
CN1CCN(CC2CCN(CC2)c2c(F)cncc2NC(=O)c2c(N)nn3cc(F)cnc23)CC1=O
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)C1CNCCO1
CN1CCCCC1C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCOC(C1)C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCC(CC1)S(=O)(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)S(=O)(=O)C1CC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)S(=O)(=O)C1CCOCC1
CS(=O)(=O)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)S(=O)(=O)C1CCOC1
Nc1nn2cc(cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C1COC1)C1(CC1)C#N
CN1CCC[C@@H]1C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN2[C@H](CCC2=O)C1 |r|
CN1CCOC2(CCN(CC2)c2ccncc2NC(=O)c2c(N)nn3cc(F)cnc23)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)c1nccs1
CCN1CCCC1C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)CN1CCCC1
CN1CCC(CC1)S(=O)(=O)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)N1CCOCC1
CS(=O)(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)C(=O)C1CCN(C1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC2CCN(CC2)c2c(F)cncc2NC(=O)c2c(N)nn3cc(cnc23)C2(CC2)C#N)CC1
CN1CCN(CC2CCN(CC2)c2c(F)cncc2NC(=O)c2c(N)nn3cc(F)cnc23)C(=O)C1
CN1CC(C1)C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)S(=O)(=O)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)S(=O)(=O)N1CCN2CCC1CC2 |(-4.03,6.25,;-3.63,4.77,;-4.77,3.73,;-4.15,2.33,;-4.77,.92,;-3.87,-.32,;-4.49,-1.73,;-2.34,-.16,;-1.71,1.24,;-2.62,2.49,;-2.29,4,;-.96,4.77,;-.96,6.31,;.37,4,;1.71,4.77,;1.71,6.31,;3.04,7.08,;4.37,6.31,;4.37,4.77,;3.04,3.99,;3.04,2.45,;1.71,1.68,;1.71,.14,;3.04,-.63,;4.38,.14,;4.38,1.68,;3.04,-2.17,;4.58,-2.17,;1.5,-2.17,;3.04,-3.71,;4.43,-4.37,;4.77,-5.88,;3.81,-7.08,;2.27,-7.08,;1.31,-5.88,;1.66,-4.37,;2.96,-4.5,;3.81,-5.72,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CN2CCC(F)(F)C2)CC1
CN1CCC[C@H]1C(=O)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
CN1CCC[C@@H]1C(=O)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)S(=O)(=O)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-n1ccnc1C1CC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)C1CC2CCCCN2C1
CCN1CCCCC1C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC(C)N1CCCC1C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC(C)N1CCC(C1)C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CCN1CCC(C1)C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
COCCS(=O)(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1=O)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCS(=O)(=O)CC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)C1CCN(CC1)C1COC1
CN1CCN(CC1=O)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CN2CCCC2=O)CC1
CS(=O)(=O)CC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CC2(CCN(CC2)c2ccncc2NC(=O)c2c(N)nn3cc(F)cnc23)OC1=O
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN2[C@@H](CCC2=O)C1 |r|
Cc1nc(C)n(n1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-n1ccnc1C(F)(F)F
CC12CCCN1c1ccncc1N2C(=O)c1c(N)nn2cc(F)cnc12
CS(=O)(=O)C1CCCN(C1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CC2CCCN2C(=O)C1
Cc1ccnn1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1C[C@@H]2CCN(C[C@@H]2C1=O)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Cc1ccn(n1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC2(COC2)CC1
CN1CCOCC1C(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC(=O)N2CCC2)CC1
CN1CC2(CCN(CC2)c2c(F)cncc2NC(=O)c2c(N)nn3cc(F)cnc23)OC1=O
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CCCC1=O
CN1CC2(CCN(CC2)c2ccncc2NC(=O)c2c(N)nn3cc(F)cnc23)CCC1=O
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CC2CCCN2C(=O)C1
CN1CCN2CCN(CC2C1=O)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)C(=O)C1CN(CCO1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1C(=O)CCC11CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CC2(CC1=O)CCN(CC2)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1ccnn1-c1c(C)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |(-.16,-.73,;1.33,-1.13,;1.81,-2.59,;3.35,-2.59,;3.82,-1.13,;2.58,-.22,;2.58,1.32,;3.9,2.09,;5.24,1.32,;3.9,3.63,;2.58,4.41,;1.24,3.63,;1.24,2.09,;-.09,1.32,;-1.43,2.09,;-1.43,3.63,;-2.76,1.32,;-4.1,2.09,;-4.49,3.58,;-5.24,1.06,;-4.61,-.35,;-5.24,-1.75,;-4.33,-3,;-4.96,-4.41,;-2.8,-2.84,;-2.18,-1.43,;-3.08,-.18,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN2C(COC2=O)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC2(COC2)CC1
CN1CCN2CCN(CC2C1=O)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)c1ncon1
CC1(CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12)S(C)(=O)=O
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN2C(CCCC2=O)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN2[C@@H](CCS2(=O)=O)C1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN2[C@H](COC2=O)C1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN(CC1)C(=O)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCS(=O)(=O)CC1
CC(=O)N1CC2(C1)CCN(CC2)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC1(C)CN(CCS1(=O)=O)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCCC2(COC2)C1
CC(=O)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC2(CCNC2)CC1
Cc1nnc(o1)N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC(=O)N1CCC2(C1)CCN(CC2)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCN2[C@H](CCC2=O)C1 |r|
Cn1ccc2cncc(NC(=O)c3c(N)nn4cc(F)cnc34)c12
Cc1nonc1N1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
COC(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC(=O)N1CCCC11CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1nncn1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCCCCC1
Cc1nnc(o1)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
COC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)CC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)c1nnco1
Cc1ncn(c1C)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCCCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)S(=O)(=O)N1CCC1
CN1CCOC2(CCN(CC2)c2c(F)cncc2NC(=O)c2c(N)nn3cc(F)cnc23)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)S(=O)(=O)N1CCN2CCC1CC2 |(-4.49,6.25,;-4.1,4.77,;-5.24,3.73,;-4.61,2.33,;-5.24,.92,;-4.33,-.32,;-4.96,-1.73,;-2.8,-.16,;-2.18,1.24,;-3.08,2.49,;-2.76,4,;-1.43,4.77,;-1.43,6.31,;-.09,4,;1.24,4.77,;1.24,6.31,;2.58,7.08,;3.9,6.31,;3.9,4.77,;5.24,4,;2.58,3.99,;2.58,2.45,;1.24,1.68,;1.24,.14,;2.58,-.63,;3.91,.14,;3.91,1.68,;2.58,-2.17,;1.04,-2.17,;4.12,-2.17,;2.58,-3.71,;3.96,-4.37,;4.31,-5.88,;3.35,-7.08,;1.81,-7.08,;.85,-5.88,;1.19,-4.37,;2.35,-4.68,;3.35,-5.87,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)C1CCOC1
CC(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)C1CC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN2C(CCCC2=O)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)C(=O)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN2[C@@H](CCCC2=O)C1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCN2[C@H](CCCC2=O)C1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CCCC1
COCC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1cncn1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CCC(O)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CC[C@H](C1)C#N |r|
CN1CC2CN(CC2C1)c1c(Cl)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CS(=O)(=O)C1CCN(C1)c1c(Cl)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)n1ccnc1
CN1CCN(CC1)C(=O)C1CCCN(C1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)C(=O)C1CCCN(C1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CC[C@@H](C1)Oc1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1CCCNC1
CN(C)Cc1ccc(Oc2ccncc2NC(=O)c2c(N)nn3cc(F)cnc23)cn1
COc1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1O[C@H]1CN2CCC1CC2 |r,wU:21.23,(-5.16,3.58,;-4.76,2.09,;-5.91,1.06,;-5.28,-.35,;-5.91,-1.75,;-5,-3,;-5.63,-4.41,;-3.47,-2.84,;-2.85,-1.43,;-3.75,-.18,;-3.43,1.32,;-2.1,2.09,;-2.1,3.63,;-.76,1.32,;.57,2.09,;.57,3.63,;1.91,4.41,;3.24,3.63,;3.24,2.09,;1.91,1.32,;1.91,-.22,;3.24,-.99,;4.57,-.22,;5.91,-.99,;5.91,-2.53,;4.57,-3.3,;3.24,-2.53,;4.42,-2.53,;5.34,-1.97,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1OC1CN2CCC1CC2 |(-5.16,3.58,;-4.76,2.09,;-5.91,1.06,;-5.28,-.35,;-5.91,-1.75,;-5,-3,;-5.63,-4.41,;-3.47,-2.84,;-2.85,-1.43,;-3.75,-.18,;-3.43,1.32,;-2.1,2.09,;-2.1,3.63,;-.76,1.32,;.57,2.09,;.57,3.63,;1.91,4.41,;3.24,3.63,;3.24,2.09,;1.91,1.32,;1.91,-.22,;3.24,-.99,;4.57,-.22,;5.91,-.99,;5.91,-2.53,;4.57,-3.3,;3.24,-2.53,;4.42,-2.53,;5.34,-1.97,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1Oc1cccnc1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1OC1CCC(CC1)C(O)=O |(-6.5,3.8,;-6.1,2.31,;-7.24,1.28,;-6.62,-.13,;-7.24,-1.54,;-6.34,-2.78,;-6.96,-4.19,;-4.81,-2.62,;-4.18,-1.21,;-5.08,.03,;-4.76,1.54,;-3.43,2.31,;-3.43,3.85,;-2.1,1.54,;-.76,2.31,;-.76,3.85,;.57,4.62,;1.9,3.85,;1.9,2.31,;.57,1.54,;.57,-0,;1.91,-.77,;1.91,-2.31,;3.24,-3.08,;4.57,-2.31,;4.57,-.77,;3.24,-0,;5.91,-3.08,;5.91,-4.62,;7.24,-2.31,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1O[C@H]1CCCN(C1)C1COC1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1O[C@@H]1CN2CCC1CC2 |r,wD:21.23,(-5.16,3.58,;-4.76,2.09,;-5.91,1.06,;-5.28,-.35,;-5.91,-1.75,;-5,-3,;-5.63,-4.41,;-3.47,-2.84,;-2.85,-1.43,;-3.75,-.18,;-3.43,1.32,;-2.1,2.09,;-2.1,3.63,;-.76,1.32,;.57,2.09,;.57,3.63,;1.91,4.41,;3.24,3.63,;3.24,2.09,;1.91,1.32,;1.91,-.22,;3.24,-.99,;4.57,-.22,;5.91,-.99,;5.91,-2.53,;4.57,-3.3,;3.24,-2.53,;4.33,-2.53,;5.3,-2.04,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1OC1CCN(CC1)C1COC1
CN1CCC(CC1)Oc1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
COC(=O)[C@H]1CC[C@@H](CC1)Oc1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r,wU:4.3,wD:7.10,(7.24,-5.01,;5.91,-4.24,;5.91,-2.7,;7.24,-1.93,;4.57,-1.93,;3.24,-2.7,;1.91,-1.93,;1.91,-.39,;3.24,.38,;4.57,-.39,;.57,.38,;.57,1.92,;1.9,2.69,;1.9,4.24,;.57,5.01,;-.76,4.24,;-.76,2.69,;-2.1,1.92,;-3.43,2.69,;-3.43,4.23,;-4.76,1.92,;-6.1,2.69,;-6.5,4.18,;-7.24,1.66,;-6.62,.26,;-7.24,-1.15,;-6.34,-2.4,;-6.96,-3.8,;-4.81,-2.24,;-4.18,-.83,;-5.08,.42,)|
CCOc1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1OC1CCOC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1O[C@H]1Cc2nccn2C1 |r|
CN(C)C(=O)[C@@H]1CC[C@@H](CC1)Oc1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r,wU:8.11,5.4,(7.24,-5.01,;5.91,-4.24,;4.57,-5.01,;5.91,-2.7,;7.24,-1.93,;4.57,-1.93,;4.57,-.39,;3.24,.38,;1.91,-.39,;1.91,-1.93,;3.24,-2.7,;.57,.38,;.57,1.92,;1.9,2.69,;1.9,4.24,;.57,5.01,;-.76,4.24,;-.76,2.69,;-2.1,1.92,;-3.43,2.69,;-3.43,4.23,;-4.76,1.92,;-6.1,2.69,;-6.5,4.18,;-7.24,1.66,;-6.62,.26,;-7.24,-1.15,;-6.34,-2.4,;-6.96,-3.8,;-4.81,-2.24,;-4.18,-.83,;-5.08,.42,)|
COC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r,wU:7.10,4.3,(7.24,-5.01,;5.91,-4.24,;5.91,-2.7,;7.24,-1.93,;4.57,-1.93,;4.57,-.39,;3.24,.38,;1.91,-.39,;1.91,-1.93,;3.24,-2.7,;.57,.38,;.57,1.92,;1.9,2.69,;1.9,4.24,;.57,5.01,;-.76,4.24,;-.76,2.69,;-2.1,1.92,;-3.43,2.69,;-3.43,4.23,;-4.76,1.92,;-6.1,2.69,;-6.5,4.18,;-7.24,1.66,;-6.62,.26,;-7.24,-1.15,;-6.34,-2.4,;-6.96,-3.8,;-4.81,-2.24,;-4.18,-.83,;-5.08,.42,)|
CN1CCN(CC1)C(=O)[C@@H]1CC[C@@H](CC1)Oc1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r,wU:12.16,9.9,(5.91,-6.93,;5.91,-5.39,;4.57,-4.62,;4.57,-3.08,;5.91,-2.31,;7.24,-3.08,;7.24,-4.62,;5.91,-.77,;7.24,-0,;4.57,-0,;4.57,1.54,;3.24,2.31,;1.91,1.54,;1.91,-0,;3.24,-.77,;.57,2.31,;.57,3.85,;1.9,4.62,;1.9,6.16,;.57,6.93,;-.76,6.16,;-.76,4.62,;-2.1,3.85,;-3.43,4.62,;-3.43,6.16,;-4.76,3.85,;-6.1,4.62,;-6.5,6.11,;-7.24,3.59,;-6.62,2.18,;-7.24,.77,;-6.34,-.47,;-6.96,-1.88,;-4.81,-.31,;-4.18,1.1,;-5.08,2.34,)|
CCC(C#N)c1cnc2c(C(=O)Nc3cnccc3OC)c(N)nn2c1
COc1ccncc1NC(=O)c1c(N)nn2cc(cnc12)C(C)C#N
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1CN2CCC1CC2 |(-5.16,4.82,;-4.76,3.34,;-5.91,2.31,;-5.28,.9,;-5.91,-.51,;-5,-1.75,;-5.63,-3.16,;-4.72,-4.41,;-3.82,-5.65,;-3.47,-1.59,;-2.85,-.18,;-3.75,1.06,;-3.43,2.57,;-2.1,3.34,;-2.1,4.88,;-.76,2.57,;.57,3.34,;.57,4.88,;1.91,5.65,;3.24,4.88,;3.24,3.34,;1.91,2.57,;1.91,1.03,;3.24,.26,;4.57,1.03,;5.91,.26,;5.91,-1.28,;4.57,-2.05,;3.24,-1.28,;4.37,-1.28,;5.35,-.71,)|
CN1CCC(CC1)Oc1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
CN(C)CCOc1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1Oc1ccccc1
COc1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
COc1cc(Cl)ncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
CCOc1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
COCCOc1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1CCOCC1
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1O[C@@H]1CCOC1 |r|
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OCC1CC1
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OCCO
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OCC(F)(F)F
CC(C)Oc1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1CCC1
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1CCOC1
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1COC1
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1CCCCC1
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OCCCO
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1CCCOC1
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1O[C@H]1CCOC1 |r|
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1CCCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1OC1CC[S](O)CC1 |(-5.83,3.58,;-5.43,2.09,;-6.58,1.06,;-5.95,-.35,;-6.58,-1.75,;-5.67,-3,;-6.3,-4.41,;-4.14,-2.84,;-3.51,-1.43,;-4.42,-.18,;-4.1,1.32,;-2.76,2.09,;-2.76,3.63,;-1.43,1.32,;-.1,2.09,;-.1,3.63,;1.24,4.41,;2.57,3.63,;2.57,2.09,;1.24,1.32,;1.24,-.22,;2.57,-.99,;2.57,-2.53,;3.91,-3.3,;5.24,-2.53,;6.58,-3.3,;5.24,-.99,;3.91,-.22,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1OC1CCS(=O)(=O)CC1
CN1CCC(CC1)Oc1c(Cl)cncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN(C)CCOCCOc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN(C)CCOc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN1CCC[C@@H]1COc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12 |r|
CN1CCC[C@H]1COc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12 |r|
CN1CCCC(C1)Oc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN(C)CCCOc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OCCCO
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1O[C@@H]1CCOC1 |r|
COCCOc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CCOc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
COc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1O[C@H]1CCOC1 |r|
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OCC(F)(F)F
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OCCN1CCOCC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CCOCC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CN2CCC1CC2 |(-5.16,3.58,;-4.76,2.09,;-5.91,1.06,;-5.28,-.35,;-5.91,-1.75,;-5,-3,;-5.63,-4.41,;-3.47,-2.84,;-2.85,-1.43,;-3.75,-.18,;-3.43,1.32,;-2.1,2.09,;-2.1,3.63,;-.76,1.32,;.57,2.09,;.57,3.63,;1.91,4.41,;3.24,3.63,;3.24,2.09,;1.91,1.32,;1.91,-.22,;3.24,-.99,;4.57,-.22,;5.91,-.99,;5.91,-2.53,;4.57,-3.3,;3.24,-2.53,;4.14,-2.53,;5.33,-1.99,)|
CN1CC[C@H](C1)Oc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12 |r|
CN1CCC(CC1)Oc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CCCOC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OCCO
COCCN1CCC[C@@H](C1)Oc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12 |r|
CN(C)CCOc1cc(Cl)ncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN1CC[C@@H](C1)Oc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12 |r|
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1Oc1cccnc1
CN(C)CCOc1cc(ncc1NC(=O)c1c(N)nn2cc(Cl)cnc12)C(F)(F)F
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CC2(CNC2)C1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CNC1
Nc1nn2cc(Cl)cnc2c1C(=O)NC1CNCC[C@@H]1OC1CNC1 |r|
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CCCNC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1O[C@H]1CCNC1 |r|
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1O[C@@H]1CCNC1 |r|
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1O[C@H]1C[C@]2(CCN2)C1 |r,wD:21.23,23.29,(-5.71,3.58,;-5.32,2.09,;-6.46,1.06,;-5.83,-.35,;-6.46,-1.75,;-5.56,-3,;-6.18,-4.41,;-4.02,-2.84,;-3.4,-1.43,;-4.3,-.18,;-3.98,1.32,;-2.65,2.09,;-2.65,3.63,;-1.32,1.32,;.02,2.09,;.02,3.63,;1.36,4.41,;2.68,3.63,;2.68,2.09,;1.36,1.32,;1.36,-.22,;2.69,-.99,;3.09,-2.48,;4.57,-2.08,;4.97,-3.57,;6.46,-3.17,;6.06,-1.68,;4.18,-.59,)|
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CCNCC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1O[C@@H]1CCCNC1 |r|
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1CNC1
NCCOc1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1OC1CCNCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1O[C@H]1CCCNC1 |r|
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1O[C@H]1CCNC1 |r|
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1O[C@@H]1CCNC1 |r|
CC(C)(C)Oc1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCC(CC1)Oc1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CNc1cc(OC)c(NC(=O)c2c(N)nn3cc(F)cnc23)cn1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1OC1CCN(CC1)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1OC1COC1
CN1CCC(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Cc1ccncc1NC(=O)c1c(N)nn2cc(CC#N)cnc12
Cc1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccccc1
Nc1nn2cc(cnc2c1C(=O)Nc1cnccc1-c1ccccc1)C#N
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc2CNCCc12
CN1CCc2c(C1)cncc2NC(=O)c1c(N)nn2cc(F)cnc12
C[N+]1([O-])CCc2c(C1)cncc2NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1C1CCN(CC1)C1COC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1C1CCN(CC1)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1C1=CCN(CC1)C1COC1 |t:24|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1C1CCN(CC1)C1COC1
CN1CCC(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1cccnc1
CN1CCC(CC1)C(=O)N1CCC(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)C(=O)N1CCC(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1C1CCN(CC1)C(=O)C12CCN(CC1)CC2
CN1CCN(CC1)C(=O)c1ccc(cn1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1ncccc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)c1ccc(cn1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1ccc(cn1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCC(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(cnc12)C(C)(C)C#N
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccncc1
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccnnc1
COc1ccc(cn1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1cncnc1
Cc1cnccc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1ccncc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1nnccc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1cccnc1O
Cc1ccnnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1nc(F)ccc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1cccnc1F
Cc1cccnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1cccnc1Cl
CN1CCC(CC1)C(=O)N1CCC(=CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |c:13|
CN1CCN(CC1)C(=O)c1ccc(c(C)n1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)c1ccc(c(C)n1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CC[C@H](C1)Oc1ccc(c(C)n1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1C1CC1
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(cc1)C(=O)N1CCNCC1
CN1CCN(CC1)C(=O)c1ccc(c(C)c1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)C(=O)c1cnc(c(Cl)c1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1C1CCN(CC1)S(=O)(=O)C1CC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(cc1)C(=O)N1CCN2CCC1CC2 |(-5.5,5.35,;-5.18,3.84,;-6.21,2.7,;-5.44,1.36,;-5.91,-.1,;-4.88,-1.24,;-5.36,-2.71,;-3.38,-.92,;-2.9,.54,;-3.93,1.69,;-3.77,3.22,;-2.44,3.99,;-2.44,5.53,;-1.1,3.22,;.23,3.99,;.23,5.53,;1.57,6.3,;2.9,5.53,;2.9,3.99,;1.57,3.22,;1.57,1.68,;.23,.91,;.23,-.63,;1.57,-1.4,;2.9,-.63,;2.9,.91,;1.57,-2.94,;.23,-3.71,;2.9,-3.71,;2.78,-5.25,;3.91,-6.3,;5.44,-6.07,;6.21,-4.73,;5.64,-3.3,;4.17,-2.85,;3.53,-4.06,;4.07,-5.54,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(cc1)C(=O)N1CCN(CC1)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(cc1F)C(=O)N1CCN2CCC1CC2 |(-5.5,5.35,;-5.18,3.84,;-6.21,2.7,;-5.44,1.36,;-5.91,-.1,;-4.88,-1.24,;-5.36,-2.71,;-3.37,-.92,;-2.9,.54,;-3.93,1.68,;-3.77,3.22,;-2.44,3.99,;-2.44,5.53,;-1.1,3.22,;.23,3.99,;.23,5.53,;1.57,6.3,;2.9,5.53,;2.9,3.99,;1.57,3.22,;1.57,1.68,;.23,.91,;.23,-.63,;1.57,-1.4,;2.9,-.63,;2.9,.91,;4.23,1.68,;1.57,-2.94,;.23,-3.71,;2.9,-3.71,;4.17,-2.85,;5.64,-3.3,;6.21,-4.73,;5.44,-6.07,;3.91,-6.3,;2.78,-5.25,;3.55,-4.16,;5.12,-3.89,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(cc1F)C(=O)N1CCN(CC1)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(nc1)C(=O)N1CCN(CC1)C1COC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(nc1)C(=O)N1CCC(CC1)N1CCCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(nc1)C(=O)N1CCC(CC1)N1CCC1
Cn1ccnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cn1cncc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cn1nccc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cn1c(cccc1=O)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cn1cc(ccc1=O)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccccn1
CS(=O)(=O)c1ccc(cc1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1nccnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1nn(C)cc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(cc1)S(=O)(=O)N1CCC1
Cn1ncnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCOC[C@@H]1c1ccc(cc1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Cc1cncnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cn1ccc(n1)-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC(=O)N1CCC(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1C1CCN(CC1)C(=O)C1CC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1C1CCN(CC1)C(=O)C1(CC1)C#N
Cn1nncc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCC(CC1=O)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cn1ccc2c(NC(=O)c3c(N)nn4cc(F)cnc34)cncc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1C1CCOC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1CN1CCCC1=O
Cc1ncc(-c2ccncc2NC(=O)c2c(N)nn3cc(F)cnc23)n1C
Cc1ncn(C)c1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |(5.25,-.62,;3.77,-1.02,;3.29,-2.49,;1.75,-2.49,;1.27,-1.02,;-.21,-.62,;2.52,-.12,;2.52,1.42,;3.85,2.19,;3.85,3.73,;2.52,4.5,;1.19,3.73,;1.19,2.19,;-.15,1.42,;-1.48,2.19,;-1.48,3.73,;-2.82,1.42,;-4.22,2.05,;-4.54,3.56,;-5.25,.9,;-4.48,-.43,;-4.96,-1.89,;-3.93,-3.04,;-4.4,-4.5,;-2.42,-2.72,;-1.95,-1.25,;-2.98,-.11,)|
Cn1cncc1-c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |(5.25,-.62,;3.77,-1.02,;3.29,-2.49,;1.75,-2.49,;1.27,-1.02,;2.52,-.12,;2.52,1.42,;3.85,2.19,;5.19,1.42,;3.85,3.73,;2.52,4.5,;1.19,3.73,;1.19,2.19,;-.15,1.42,;-1.48,2.19,;-1.48,3.73,;-2.82,1.42,;-4.22,2.05,;-4.54,3.56,;-5.25,.9,;-4.48,-.43,;-4.96,-1.89,;-3.93,-3.04,;-4.4,-4.5,;-2.42,-2.72,;-1.95,-1.25,;-2.98,-.11,)|
CCn1cncc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
COc1cncc(NC(=O)c2c(N)nn3cc(F)cnc23)c1-c1cncn1C |(5.89,2.19,;4.55,1.42,;3.22,2.19,;3.22,3.73,;1.89,4.5,;.55,3.73,;.55,2.19,;-.78,1.42,;-2.12,2.19,;-2.12,3.73,;-3.45,1.42,;-4.86,2.05,;-5.18,3.56,;-5.89,.9,;-5.12,-.43,;-5.59,-1.89,;-4.56,-3.04,;-5.04,-4.5,;-3.06,-2.72,;-2.58,-1.25,;-3.61,-.11,;1.89,1.42,;1.89,-.12,;.64,-1.02,;1.12,-2.49,;2.66,-2.49,;3.13,-1.02,;4.62,-.62,)|
COc1cncc(NC(=O)c2c(N)nn3cc(F)cnc23)c1-c1cccnc1
COCCn1cncc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
COc1cncc(NC(=O)c2c(N)nn3cc(F)cnc23)c1C1CC1
CN1CCN(CC1)C(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)C(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)C(=O)C1CCN(CC1)c1c(Cl)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
CN1CCCN(CC1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCN2CCC1CC2 |(-5.5,5.35,;-5.18,3.84,;-6.21,2.7,;-5.44,1.36,;-5.91,-.1,;-4.88,-1.24,;-5.36,-2.71,;-3.38,-.92,;-2.9,.54,;-3.93,1.69,;-3.77,3.22,;-2.44,3.99,;-2.44,5.53,;-1.1,3.22,;.23,3.99,;.23,5.53,;1.57,6.3,;2.9,5.53,;2.9,3.99,;4.23,3.22,;1.57,3.22,;1.57,1.68,;.23,.91,;.23,-.63,;1.57,-1.4,;2.9,-.63,;2.9,.91,;1.57,-2.94,;.23,-3.71,;2.9,-3.71,;4.17,-2.85,;5.64,-3.3,;6.21,-4.73,;5.44,-6.07,;3.91,-6.3,;2.78,-5.25,;3.62,-4.35,;5.18,-4.08,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCC1
CCN1CCN(CC1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCN2CCCC2C1
CN(C)[C@@H]1CCN(C1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCNCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCN(CC1)C1CC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC2(COC2)C1
CN1CCN(CC1(C)C)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)CCCN(C)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CC2CN(CC2C1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC(C)(C)NC(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCC(CC1)NC(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
COC1CN(C1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)C1CN(C1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CC(C1)NC(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCC(C1)NC(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)C(=O)C1(CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12)C#N
CN(C)CCCNC(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC1(C)CN(CCN1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)CCNC(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)CCN(C)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCN(CC1)C1COC1
CNC(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CNC1CN(C1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCN(CC1)C1CCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCOCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)NC1COC1
CN1CCN(CC11CC1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
COCCN(C)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC(O)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)NCCN1CCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC(C1)N1CCCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC2CCC(C1)N2
C[C@@H]1CN(CCN1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCN2CCC1C2
C[C@H]1CN(CCN1C)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CCC(CC1)C(=O)N1CCNCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC(C1)N1CCC1
C[C@@H]1CN(CCN1C)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC2CNCC2C1
CN1C2CCC1CN(C2)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CC2CC1CN2C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)C(=O)C1(C)CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CCN(CC1)C(=O)C1CCN(CC1)c1c(C)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1cncc(NC(=O)c2c(N)nn3cc(F)cnc23)c1N1CCC(CC1)C(=O)N1CCNCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC(C1)N1CCCCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC[C@@H](C1)N1CCCC1 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCC(CC1)N1CCCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCC(CC1)N1CCCCC1
C[C@H]1CN(CCN1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCNC2CC12
CC1(O)CN(C1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCC(C1)N1CCCCC1
CN1CCN(C2CC12)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CCC(CC1)C(=O)N1CCN2CCC1CC2 |(-5.5,5.35,;-5.18,3.84,;-6.21,2.7,;-5.44,1.36,;-5.91,-.1,;-4.88,-1.24,;-5.36,-2.71,;-3.38,-.92,;-2.9,.54,;-3.93,1.69,;-3.77,3.22,;-2.44,3.99,;-2.44,5.53,;-1.1,3.22,;.23,3.99,;.23,5.53,;1.57,6.3,;2.9,5.53,;2.9,3.99,;4.23,3.22,;1.57,3.22,;1.57,1.68,;.23,.91,;.23,-.63,;1.57,-1.4,;2.9,-.63,;2.9,.91,;1.57,-2.94,;.23,-3.71,;2.9,-3.71,;4.17,-2.85,;5.64,-3.3,;6.21,-4.73,;5.44,-6.07,;3.91,-6.3,;2.78,-5.25,;3.62,-4.29,;5.18,-4.02,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC(F)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCC(CC1)N1CCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CCC(CC1)C(=O)N1CCN2CCC1C2
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCN2CC[C@H]1C2 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCN2CC[C@@H]1C2 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)C1CC(F)(F)C1
COC1(C)CN(C1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC(C1)C#N
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)C(=O)N1CCC1
COC1CN(C1)C(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
COC1(C)CN(C1)C(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)C(=O)N1CC(F)(F)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)C(=O)N1CC(C1)C#N
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)C(=O)N1CC(F)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)C(=O)N1CCCC1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)C(=O)N1CCC2(COC2)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)C(=O)N1CCOCC1
CS(=O)(=O)C1CN(C1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCN2CCC1CC2 |(-5.5,5.35,;-5.18,3.84,;-6.21,2.7,;-5.44,1.36,;-5.91,-.1,;-4.88,-1.24,;-5.36,-2.71,;-3.38,-.92,;-2.9,.54,;-3.93,1.69,;-3.77,3.22,;-2.44,3.99,;-2.44,5.53,;-1.1,3.22,;.23,3.99,;.23,5.53,;1.57,6.3,;2.9,5.53,;2.9,3.99,;4.23,3.22,;1.57,3.22,;1.57,1.68,;.23,.91,;.23,-.63,;1.57,-1.4,;2.9,-.63,;2.9,.91,;1.57,-2.94,;.23,-3.71,;2.9,-3.71,;4.17,-2.85,;5.64,-3.3,;6.21,-4.73,;5.44,-6.07,;3.91,-6.3,;2.78,-5.25,;3.55,-4.23,;5.12,-3.96,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)C(=O)N1CC2(COC2)C1
CS(=O)(=O)C1CN(C1)C(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)C(=O)N1CC2(CCO2)C1
CCOC1CN(C1)C(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC1(COC1)N1CCN(CC1)C(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CO[C@@H]1CCN(C1)C(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
CO[C@H]1CCN(C1)C(=O)C1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
C[NH+]1CCN(CC1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN1CC(C1)N1CCN(CC1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
COCC1CN(C1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CO[C@H]1CCN(C1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
COc1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccncc1C#N
CS(=O)(=O)c1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(F)cc1
CS(=O)(=O)Nc1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccccc1C(F)(F)F
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(O)=O
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(O)=O
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(F)c1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C#N
Cc1ccccc1-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)N1CCOCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)N1CCOCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccccc1F
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(CO)cc1
CC(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
NC(=O)c1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccccc1CO
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)N1CCOCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C#N
CC(=O)c1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
C[C@H]1CC[C@@H](CC1)NC(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1 |r,wU:1.0,wD:4.7,(7.66,-8.44,;6.32,-7.67,;4.99,-8.44,;3.66,-7.67,;3.66,-6.13,;4.99,-5.36,;6.32,-6.13,;2.32,-5.36,;2.32,-3.82,;3.66,-3.05,;.99,-3.05,;-.34,-3.82,;-1.68,-3.05,;-1.68,-1.51,;-.34,-.74,;.99,-1.51,;-3.01,-.74,;-4.35,-1.51,;-5.68,-.74,;-5.68,.8,;-7.01,1.57,;-4.35,1.57,;-3.01,.8,;-4.35,3.11,;-5.68,3.88,;-3.01,3.88,;-3.01,5.42,;-1.68,6.19,;-1.68,7.73,;-3.01,8.5,;-4.35,7.73,;-4.35,6.19,)|
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CS(=O)(=O)Nc1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccc(cc1)N1CCCC1)-c1cccc(c1)C(=O)N1CCOCC1
COc1ccccc1NC(=O)c1nc(cnc1N)-c1cccc(c1)C(N)=O
COc1ccccc1NC(=O)c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
COc1ccccc1NC(=O)c1nc(cnc1N)-c1ccc2[nH]ccc2c1
COc1ccccc1NC(=O)c1nc(cnc1N)-c1ccco1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccn[nH]1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(O)nc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccncc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(nc1)N1CCOCC1
COc1ccccc1NC(=O)c1nc(cnc1N)-c1cccs1
COc1ccccc1NC(=O)c1nc(cnc1N)-c1ccc2[nH]ncc2c1
COc1ccccc1NC(=O)c1nc(cnc1N)-c1ccoc1
COc1cc(ccn1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc2[nH]ncc2c1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cncnc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccco1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCC[C@@H]1CN1CCCC1 |r|
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCCNCC1
COC1CN(C1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
COCCN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)NCCN1CCCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)NC1CCOCC1
CN1CCC(CC1)NC(=O)c1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)NCCN1CCCCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)N1CCC(CO)CC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)NC1CC1
CN(C)CCN(C)C(=O)c1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)N1CCNCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)NCCN1CCCC1
CN(C)[C@@H]1CCN(C1)C(=O)c1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1 |r|
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:28.31,wD:25.27,(-4.39,3.64,;-3.06,2.87,;-3.06,1.33,;-1.73,.56,;-.39,1.33,;-.39,2.87,;-1.73,3.64,;-1.73,5.18,;-3.06,5.95,;-.39,5.95,;-.39,7.49,;.94,8.26,;.94,9.8,;-.39,10.57,;-1.73,9.8,;-1.73,8.26,;.94,.56,;2.28,1.33,;3.61,.56,;3.61,-.98,;2.28,-1.75,;.94,-.98,;2.28,-3.29,;.94,-4.06,;3.61,-4.06,;3.61,-5.6,;2.28,-6.37,;2.28,-7.91,;3.61,-8.68,;3.61,-10.22,;4.94,-7.91,;4.94,-6.37,)|
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)N1CCN(CCC#N)CC1
CN1CCN(CC1)C(=O)c1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
COC1CN(C1)C(=O)c1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)NCCN1CCCCC1
NC(=O)C1CCN(CC1)C(=O)c1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)N1CCCC1
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)N1CCC(O)C1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(c1)C(=O)NC1CCOCC1
COCCN(C)C(=O)c1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CN(C)CCN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)NCC1CCOCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCC(CC1)N1CCCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCC1
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCNCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCC(O)C1
CN(C)[C@@H]1CCN(C1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1 |r|
NC(=O)C1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCCCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCC(CO)CC1
CN(C)C1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCN(CCC#N)CC1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1cccc2cc[nH]c12)-c1cccnc1
COc1ccc(NC(=O)c2nc(cnc2N)-c2cccnc2)cc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccnc1
COc1cccc(NC(=O)c2nc(cnc2N)-c2cccnc2)c1
Nc1ncc(nc1C(=O)Nc1cccc(c1)C#N)-c1cccnc1
NC(=O)c1cccc(NC(=O)c2nc(cnc2N)-c2cccnc2)c1
Nc1ncc(nc1C(=O)Nc1ccncn1)-c1cccnc1
CN(C)c1cccc(NC(=O)c2nc(cnc2N)-c2cccnc2)c1
Cc1ccccc1NC(=O)c1nc(cnc1N)-c1cccnc1
NC(=O)c1ccc(NC(=O)c2nc(cnc2N)-c2cccnc2)cc1
CC(=O)Nc1ccc(NC(=O)c2nc(cnc2N)-c2cccnc2)cc1
Nc1ncc(nc1C(=O)Nc1ccc(F)cc1)-c1cccnc1
CC(=O)Nc1cccc(NC(=O)c2nc(cnc2N)-c2cccnc2)c1
Nc1ncc(nc1C(=O)Nc1ccccc1F)-c1cccnc1
Nc1ncc(nc1C(=O)Nc1ccccn1)-c1cccnc1
Nc1ncc(nc1C(=O)Nc1ccncc1)-c1cccnc1
Nc1ncc(nc1C(=O)Nc1cccc2OC(F)(F)Oc12)-c1cccnc1
COc1ccc(NC(C)=O)cc1NC(=O)c1nc(cnc1N)-c1cccnc1
Nc1ncc(nc1C(=O)Nc1cccc(c1)S(N)(=O)=O)-c1cccnc1
Nc1ncc(nc1C(=O)Nc1ccccc1OC(F)(F)F)-c1cccnc1
Nc1ncc(nc1C(=O)Nc1cccc(F)c1)-c1cccnc1
Nc1ncc(nc1C(=O)Nc1ccc2[nH]ccc2c1)-c1cccnc1
Nc1ncc(nc1C(=O)Nc1ccc2cc[nH]c2c1)-c1cccnc1
COc1ccccc1NC(=O)c1nc(cnc1N)-c1cccnc1
COc1ccc(OC)c(NC(=O)c2nc(cnc2N)-c2cccnc2)c1
COc1ccc(C)cc1NC(=O)c1nc(cnc1N)-c1cccnc1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2cccc(O)c2[nH]1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccccc1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccc(cc2[nH]1)C#N
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2cccnc2[nH]1
Nc1ncc(nc1-c1nc2cccc(O)c2[nH]1)-c1ccccc1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccc(Cl)cc2[nH]1
COc1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(cc1)S(C)(=O)=O
COC(=O)c1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(cc1)S(C)(=O)=O
Cc1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(cc1)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccc(cc2[nH]1)C(F)(F)F
Cc1cccc2nc([nH]c12)-c1nc(cnc1N)-c1ccc(cc1)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccncc2[nH]1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1cccnc1
CS(=O)(=O)c1cccc(c1)-c1cnc(N)c(n1)-c1nc2ccccc2[nH]1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccccc2[nH]1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccccc2[nH]1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1cccc(c1)C(=O)N1CCOCC1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1cccc(O)c1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccccc1CO
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(cc1)C(=O)NCCCO
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(cc1)C#N
CC(=O)NCc1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccccc2[nH]1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(F)c(c1)C(=O)N1CCOCC1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(cc1)C(=O)NCCO
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(cc1)C(=O)NCCN1CCCC1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(cc1)S(=O)(=O)N1CCCC1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(nc1)N1CCOCC1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccnc(c1)N1CCNCC1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(O)nc1
Nc1ncc(nc1-c1nnc([nH]1)-c1ccccc1)-c1cccnc1
NCc1ccc(cc1)-c1nnc([nH]1)-c1nc(cnc1N)-c1cccnc1
Nc1cccc(c1)-c1nnc([nH]1)-c1nc(cnc1N)-c1cccnc1
Cc1cccc(c1)-c1nnc([nH]1)-c1nc(cnc1N)-c1cccnc1
Nc1ncc(nc1-c1nnc([nH]1)-c1cccs1)-c1cccnc1
NCc1cccc(c1)-c1nnc([nH]1)-c1nc(cnc1N)-c1cccnc1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1noc(n1)-c1ccccc1
Nc1ncc(nc1-c1noc(n1)-c1ccccc1)-c1cccnc1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccccc2s1
Cc1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N1CCCN(CC1)C(=O)OC(C)(C)C
CN(C)C1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccc(C)cc2[nH]1
Cc1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N1CCNCC1
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccc(C)cc2[nH]1
CN1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccc(C)cc2[nH]1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccccc2n1-c1ccccc1
Cc1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N1CCCNCC1
Nc1ncc(nc1-c1noc(n1)-c1ccccc1)-c1ccc(cc1)C(=O)N1CCCNCC1
CN(C)C1CCN(CC1)C(=O)c1ccc(cc1F)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)[C@@H]1CCN(C1)C(=O)c1ccc(cc1F)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1 |r|
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(C(=O)N2CCCNCC2)c(F)c1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(C(=O)N2CCNCC2)c(F)c1
Nc1ncc(nc1C(=N)OC(=N)c1ccccc1)-c1ccc(C(=O)N2CCCNCC2)c(F)c1
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)[C@@H]1CCN(C1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1 |r|
CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1)C(=O)N1CCNCC1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1)C(=O)N1CCOCC1
COCCN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1)C(=O)N1CCCOCC1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1)C(=O)N1CCNC(C1)C(F)(F)F
CC1CN(CCN1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CCC1CN(CCN1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Cc1cc(ccc1-c1cnc(N)c(n1)C(=N)OC(=N)c1ccccc1)C(=O)N1CCCN(CC1)C(=O)OC(C)(C)C
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1C#N)C(=O)N1CCCNCC1
CN(C)C1CCN(CC1)C(=O)c1c(F)cc(cc1F)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C1CCN(CC1)C(=O)c1ccc(-c2cnc(N)c(n2)-c2nnc(o2)-c2ccccc2)c(c1)C(F)(F)F
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1)S(=O)(=O)N1CCNCC1
CN(C)[C@@H]1CCN(C1)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1 |r|
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1)S(=O)(=O)NCCO
CC(C)(C)CCN1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)c1ccccc1
CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1)C(=O)N1CCCN(CC1)C=O
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1F
CC(C)(C)CC(=O)N1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(Nc2ccccc2)o1
CNc1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
COC(=O)N1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccncc1C#N
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(F)cc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cnc(nc1)C(=O)N1CCCNCC1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cc(F)c(C(=O)N2CCCNCC2)c(F)c1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1C(F)(F)F)C(=O)N1CCCNCC1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(F)c1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccnc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(Nc2ccc(Cl)cc2)o1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(Nc2cccc(Cl)c2)o1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(Nc2cccnc2)o1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)N1CCOCC1
CN(C)C(=O)c1ccc(c(Cl)c1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(nc1)C(=O)N1CCCNCC1
Nc1ncc(nc1C(=N)OC(=N)c1ccccc1)-c1ccc(C(=O)N2CCCNCC2)c2ccccc12
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccccc1C#N
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccn1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccs1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc[nH]c1=O
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC2CCNCC2)o1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NCc2ccccc2)o1
CC(C)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CCc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccc2[nH]ccc12
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccncc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccccc1O
NCc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc2ncccc2c1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccnc1
COc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(=O)Nc1cccc(c1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccncc1
Nc1ncc(nc1-c1nnc(s1)-c1ccccc1)-c1ccc(cc1)C(=O)N1CCCNCC1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(CCO)c1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)C(N)=N
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1C
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(NCCN2CCOCC2)nc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(CNC(=O)OC(C)(C)C)c1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccnc1C#N
CS(=O)(=O)c1cccc(c1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CO)cc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1C=C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(CC(O)=O)o1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C(=O)N1CCCNCC1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(c1)[C@@H](C)N |r|
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C(=O)NC1CCCCC1N
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC(=O)CN)o1
CCNCc1ccc(s1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(c1)C1CCCN1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(O)c1
COc1cnccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(O)cc1
CNCc1ccc(cc1)C(=N)OC(=N)c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)CCO
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(CCCN)o1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(CCCCN)o1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccc2ccccc12
CN(C)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C1=CCN(CC1)C(=O)OC(C)(C)C |t:26|
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccc(c1)C(F)(F)F
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NCCCN)o1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C(=O)N1CCCC(N)C1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1N
NC(=O)c1cccc(c1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C1CC1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)C1CCCN1
COc1ccccc1Nc1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccsc1
COC(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)C(O)CO
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CCN)cc1
CC(C)Oc1ccccc1-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)N1CCC(N)CC1
CC(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)N1CC(N)C1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1)S(=O)(=O)N1CCC1
CCCCOC(=O)c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C(=O)NC1CCNC1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccco1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
COc1ccc(cn1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)Cc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
COCCNCc1ccc(cc1)C(=N)OC(=N)c1nc(cnc1N)-c1ccc(SC(C)C)cc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C(=O)N1CC(N)C1
CC(C)S(=O)(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CCNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(c1)[C@H](C)N |r|
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)[C@@H](C)N |r|
COCc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(-c2cnc(N)c(n2)-c2nnc(o2)-c2ccccc2)c(c1)C(F)F
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1-c1ccsc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C(O)=O
C[C@H](Nc1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C)c1ccc(Cl)cc1 |r|
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(F)c1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(COC(C)=O)cc1
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(n2)-c2nnc(o2)-c2ccccc2)c(c1)C#N
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C(=O)N1CCC(N)C1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccccc1-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccn1C
CC(C)S(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccccc1CCO
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)N1CCC(CN)CC1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)N(C)C(CO)(CO)CO
CNCc1ccc(s1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
Nc1ncc(nc1-c1nnc(o1)-c1cccs1)-c1ccncc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(N)c1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cc(cs1)C#N
CS(=O)(=O)Nc1cccc(c1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc2CNCCc2c1
CNCc1cccc(c1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(s1)C1CCCN1
CN(C)C(=O)c1ccc(c(\C=C\F)c1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CCS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccc(OC(F)(F)F)c1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(Nc2ccccc2Cl)o1
Nc1ncc(nc1-c1nnc(o1)-c1cccs1)-c1ccc(cc1C#N)C(=O)N1CCCNCC1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cnccc1C#N
CC(C)Sc1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)c1cccc(c1)C(C)NC(=O)OC(C)(C)C
CCc1ccccc1-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NCCc2ccccc2)o1
COc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC2CC2)cc1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)NC(=O)[C@H]1N[C@H]2CCC1C2 |r,TLB:25:27:31.30:33|
CN(C)C(=O)c1ccc(-c2cnc(N)c(n2)-c2nnc(o2)-c2ccccc2)c(c1)-c1cnco1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC(=O)OC(C)(C)C)cc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC2CCCCC2)o1
CC(C)(C)OC(=O)NCCS(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)CCOc1cc(ccn1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(C)c1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1sccc1C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(CN)o1
CN(C)CCS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccoc1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(OC)c1
COc1ccsc1-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CN)s1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccccc1C(F)(F)F
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1OCCNC(=O)OC(C)(C)C
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccccc1Br
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC(C)=O)o1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)c1ccc(CNCCO)cc1
COc1ccsc1-c1nnc(o1)-c1nc(cnc1N)-c1ccccc1S(C)=O
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cscn1
Cc1ccsc1-c1nnc(o1)C1=C(N)OC=C(O1)c1ccc(cc1C#N)C(=O)N1CCCNCC1 |c:13,17|
Cc1cccc(c1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(CN)c1
CCSc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(c1)C1CNC1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(nc1)N1CCNCC1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(c1)C#N
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)N1CCC(N)C1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1sccc1C#N
CS(=O)(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)CCS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(O)cc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)N1CCC1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(O)cc1
COc1cccc(c1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1OCCO
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1)S(=O)(=O)C1CCNCC1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(CO)c1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC2CCCNC2)o1
CN1CCN(CC1)c1ccc(cn1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(N)cc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccc(CO)c1
CCS(=O)(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(CN(C)C)c1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1I
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)N1CCCC(N)C1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccccc1-c1cnco1
CNC(=N)c1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CN(C)CCNc1nccc(-c2cnc(N)c(n2)-c2nnc(o2)-c2ccccc2)c1C#N
CCn1cc(cn1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC(=O)[C@@H]2CCCCN2)o1 |r|
CNC(C)c1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1OCCN
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(CCN)o1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1O
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccc2cccnc12
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC(=O)C2CCCN2)o1
NC(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC(=O)C(C)(C)N)o1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(CN)c1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccccc1CC#N
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CN)cc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccnc(N)c1
NCCSc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)Sc1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)c1ccc(CNCCN(C)C)cc1
CNCc1csc(c1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)N1CCCC(CN)C1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)[C@H](C)N |r|
CC(C)Sc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CSc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(N)n1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C1=CCNCC1 |t:27|
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1C(F)(F)F
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CN)cc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1O
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNCC(F)F)s1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(C)c1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CO)cc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)N1CCNCC1
CN(C)Cc1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CO)cc1
CS(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
COc1ccccc1-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CN(C)C)cc1
CN(C)C(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(C)s1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cc(C)cs1
CC(=O)Nc1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)NCc1ccc(s1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CC(=O)c1cccc(c1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)N(C)c1ccccc1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)CCNC(=O)OC(C)(C)C
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccc(c1)C#N
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccccc1C=C
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(Nc2cccc(c2)C#N)o1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(CNCC2CCCNC2)o1
CCS(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CS(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(CN)c1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C#C
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccc2ccsc12
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1cccc2ncccc12
NCCS(=O)c1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccsc1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(C)cc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-n1cccc1C#N
CN(C)CCNc1cc(ccn1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
NC(=O)Cc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(=O)Nc1ccccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC#Cc1cc(ccc1-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1)C(=O)N(C)C
CN(C)CCS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1sccc1C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(N)o1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccnc(c1)N1CCNCC1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC(=O)C(C)N)o1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)C#N
CS(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(O)c1cccc(c1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1sccc1C
CCOc1ccccc1-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC(C)=O)o1
CN(C)CCCOc1ccc(cn1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(c1)C(C)N
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(nc1)N1CCOCC1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1OCCCO
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)C1CNC1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(c1)[N+]([O-])=O
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC(=O)c2ccccc2)o1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(C)(=O)=O
CNCc1ccc(cc1)C(=N)OC(=N)c1nc(cnc1N)-c1ccc(cc1)S(=O)CCN(C)C
CNCc1ccc(cc1)C(=N)OC(=N)c1nc(cnc1N)-c1ccc(c(OC(F)(F)F)c1)S(=O)(=O)C(C)C
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(O)c1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1F)S(=O)(=O)C(C)C
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1C)S(=O)(=O)C(C)C
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(c(c1)C#N)S(=O)(=O)C(C)C
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)N(C)C
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)N1CCC1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1Cl)S(=O)(=O)C(C)C
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cn1)S(=O)(=O)C(C)C
CNCc1ccc(cc1)C(=N)OC(=N)c1nc(cnc1N)-c1ccc(cc1)S(=O)CCCO
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)C1CCOC1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(nc1)S(=O)(=O)C(C)C
CNCc1ccc(cc1)C(=N)OC(=N)c1nc(cnc1N)-c1ccc(cc1)S(=O)NCCO
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(c(Cl)c1)S(=O)(=O)C(C)C
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(Cl)c1
CCS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC)cc1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C1COC1
CNCc1ccc(cc1Cl)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CCCS(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC)cc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)C(C)(C)N
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(c(C)c1)S(=O)(=O)C(C)C
CCC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC)cc1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(c(F)c1)S(=O)(=O)C(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC2CCNCC2)o1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)c1ccc(CNC2COC2)cc1F
CNCc1ccc(cc1O)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(c(F)c2)S(=O)(=O)C(C)C)c(F)c1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1C(F)F)S(=O)(=O)C(C)C
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)C1CCOCC1
CNCc1ccc(cc1)C(=N)OC(=N)c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)CN(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(cc1)[C@@H](N)C(F)(F)F |r|
CCc1cc(ccc1S(=O)(=O)C(C)C)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC)cc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1F)-c1ccc(cc1)S(=O)(=O)C1CCOCC1
CNCc1ccc(C(=N)OC(=N)c2nc(cnc2N)-c2ccc(cc2)S(=O)C(C)CC(C)(C)O)c(F)c1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(c(Cl)c2)S(=O)(=O)C(C)C)c(F)c1
CNCc1ccc(cc1)C(=N)OC(=N)c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)CCOC
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1C#N)S(=O)(=O)C(C)C
CNCc1ccc(C(=N)OC(=N)c2nc(cnc2N)-c2ccc(cc2)S(=O)C(C)CCOC)c(F)c1
C[C@H](CO)NCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(F)c1 |r|
C[C@H](O)CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(F)c1 |r|
C[C@@H](CO)NCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(F)c1 |r|
CNCc1ccc(cc1F)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(C)(=O)=O
CC(CN(C)C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1F
CCC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC)cc1F
CC(CCO)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1F
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)c1ccc(CNCCF)cc1F
C[C@@H](O)CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(F)c1 |r|
CNCc1ccc(C(=N)OC(=N)c2nc(cnc2N)-c2ccc(cc2)S(=O)C(C)CCO)c(F)c1
CC(CCN(C)C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1F
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)C2CCOCC2)c(F)c1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC2CCOC2)cc1F
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=N)OC(=N)c1ccc(CNCCF)cc1
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)C2CCOC2)c(F)c1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNCC(C)(C)O)cc1F
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1F)-c1ccc(cc1)S(=O)(=O)C1CCOC1
Nc1ncc(nc1-c1cc(no1)-c1ccccc1)-c1ccc(cc1)C(=O)N1CCCNCC1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(cc1)N(C)CCOCCO
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CN)cc1
CCCNCc1ccc(cc1)C(=N)\C=C(/O)c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CC(C)NCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(\O)=C\C(=N)c1ccc(CNCCO)cc1
CCNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CC(O)CNCc1ccc(cc1)C(=N)\C=C(/O)c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CNCc1ccc(-c2cc(on2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(C)c1
CNCc1ccc(cc1Cl)-c1cc(on1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CNCc1ccc(-c2cc(on2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(F)c1
CNCc1ccc(-c2cc(on2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C2CCOC2)c(F)c1
CN(C)C(=O)c1ccc(-c2cnc(N)c(n2)-c2nnc(s2)-c2ccccc2)c(c1)C#N
Nc1ncc(nc1-c1nnc(s1)-c1ccccc1)-c1ccc(cc1C#N)C(=O)N1CCCNCC1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(Nc2ccccc2C#N)s1
Cc1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)NCCN1CCCC1
Cc1cccc2nc([nH]c12)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N1CCCNCC1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(cc1)C(=O)N1CCNCC1
CN(C)[C@H]1CCN(C1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccc(C)cc2[nH]1 |r|
CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2cccc(F)c2[nH]1
COc1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N1CCCNCC1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(C(=O)N2CCNCC2)c(F)c1
CN(C)[C@H]1CCN(C1)C(=O)c1ccc(cc1F)-c1cnc(N)c(n1)-c1nc2cccc(C)c2[nH]1 |r|
Nc1ncc(nc1-c1nc2cccc(F)c2[nH]1)-c1ccc(cc1)C(=O)N1CCCNCC1
CN(C)C1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccccc2[nH]1
CN(C)C1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2cccc(C)c2[nH]1
COc1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(C(=O)N2CC[C@@H](C2)N(C)C)c(F)c1 |r|
CN(C)C1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2cccc(F)c2[nH]1
CN(C)C1CCN(CC1)C(=O)c1ccc(cc1F)-c1cnc(N)c(n1)-c1nc2ccccc2[nH]1
Cc1cccc2nc([nH]c12)-c1nc(cnc1N)-c1ccc(C(=O)N2CCNCC2)c(F)c1
Nc1ncc(nc1-c1nc2cccc(F)c2[nH]1)-c1ccc(cc1)C(=O)N1CCCOCC1
CN(C)[C@H]1CCN(C1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2cccc(F)c2[nH]1 |r|
COc1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N1CCNCC1
Cc1cccc2nc([nH]c12)-c1nc(cnc1N)-c1ccc(C(=O)N2CCCNCC2)c(F)c1
Nc1ncc(nc1-c1nc2cccc(F)c2[nH]1)-c1ccc(cc1)C(=O)N1CCNCC1
CN(C)C1CCN(CC1)C(=O)c1ccc(cc1F)-c1cnc(N)c(n1)-c1nc2cccc(C)c2[nH]1
Nc1ncc(nc1-c1nc2cccc(c2[nH]1)C(F)(F)F)-c1ccc(cc1)C(=O)N1CCNCC1
Nc1ncc(nc1-c1nc2cccc(c2[nH]1)C(F)(F)F)-c1ccc(cc1)C(=O)N1CCCNCC1
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(cc1)C(=O)N1CCCNCC1
COc1cccc2nc([nH]c12)-c1nc(cnc1N)-c1ccc(cc1)C(=O)N1CCC(CC1)N(C)C
CN(C)[C@H]1CCN(C1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccccc2[nH]1 |r|
Nc1ncc(nc1-c1nc2ccccc2[nH]1)-c1ccc(C(=O)N2CCCNCC2)c(F)c1
CN(C)C1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccc(cc2[nH]1)C(F)(F)F
CN(C)[C@H]1CCN(C1)C(=O)c1ccc(cc1F)-c1cnc(N)c(n1)-c1nc2ccccc2[nH]1 |r|
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1nc2ccccc2[nH]1
Nc1ncc(nc1C(=O)Nc1nc2ccccc2[nH]1)-c1ccc(cc1C#N)C(=O)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1nc2ccccc2[nH]1)-c1ccncc1C#N
Nc1ncc(nc1C(=O)Nc1ccc2cn[nH]c2c1)-c1ccc(cc1)C(=O)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1nc2ccccc2o1)-c1ccc(cc1)C(=O)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1cc2ccccc2[nH]1)-c1ccc(cc1)C(=O)N1CCCNCC1
Cn1c(NC(=O)c2nc(cnc2N)-c2ccc(cc2)C(=O)N2CCCNCC2)nc2ccccc12
Nc1ncc(nc1C(=O)Nc1n[nH]c2ccccc12)-c1ccc(cc1)C(=O)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1nc2ccccc2s1)-c1ccc(cc1)C(=O)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1nc2ccccc2[nH]1)-c1ccc(cc1)C(=O)N1CCCNCC1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1nc2ccccc2[nH]1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccc2cc[nH]c2n1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1n[nH]c2ccccc12
Nc1ncc(nc1C(=O)Nc1cccn2ncnc12)-c1cccnc1
Nc1ncc(nc1C(=O)Nc1nc2ccccc2s1)-c1ccc(cc1)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1n[nH]c2ccccc12)-c1ccc(cc1)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1nc2ccccc2[nH]1)-c1ccc(cc1)N1CCCNCC1
Cn1c(NC(=O)c2nc(cnc2N)-c2ccc(cc2)N2CCCNCC2)nc2ccccc12
Nc1ncc(nc1C(=O)Nc1cc2ccccc2[nH]1)-c1ccc(cc1)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1nc2ccccc2o1)-c1ccc(cc1)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1ccc2cn[nH]c2c1)-c1ccc(cc1)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1nc2ccccc2[nH]1)-c1ccc(cc1C#N)N1CCCNCC1
Nc1ncc(nc1C(=O)Nc1nc2ccccc2[nH]1)-c1ccccc1C#N
CC(C)(C)OC(=O)N1CCCN(CC1)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1nc2ccccc2s1
COc1ncccc1NC(=O)c1nc(cnc1N)-c1ccc(cc1)S(C)(=O)=O
Cc1cc(NC(=O)c2nc(cnc2N)-c2ccc(cc2)S(C)(=O)=O)ccn1
Cc1cc(NC(=O)c2nc(cnc2N)-c2ccc(cc2)S(C)(=O)=O)n(C)n1
CCc1ncccc1NC(=O)c1nc(cnc1N)-c1ccc(cc1)S(C)(=O)=O
Cc1ncccc1NC(=O)c1nc(cnc1N)-c1ccc(cc1)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccn1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ncns1
Cc1cnc(NC(=O)c2nc(cnc2N)-c2ccc(cc2)S(C)(=O)=O)s1
COc1ccncc1NC(=O)c1nc(cnc1N)-c1ccc(cc1)S(C)(=O)=O
CNCc1ccc(NC(=O)c2nc(cnc2N)-c2ccc(cc2)S(C)(=O)=O)cc1
CNCc1ccc(NC(=O)c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)cc1
CNCc1cccc(NC(=O)c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c1
CNCc1cccc(NC(=O)c2nc(cnc2N)-c2ccc(cc2)S(C)(=O)=O)c1
CN1CCN2CCN(CC2C1)c1c(Cl)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CON1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(Cl)cnc12
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)N1CC2(COC2)C1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CCN(CC1)C1COC1
CN1CCN2CCN(CC2C1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN(C)CC(=O)N1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1N1CCC(CC1)S(=O)(=O)C1COC1
CC1(C)CCCN1c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Cc1ncnn1-c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |(5.24,-.55,;3.78,-1.02,;3.3,-2.49,;1.76,-2.49,;1.28,-1.02,;2.53,-.12,;2.53,1.42,;3.86,2.19,;5.2,1.42,;3.86,3.73,;2.53,4.5,;1.2,3.73,;1.2,2.19,;-.14,1.42,;-1.47,2.19,;-1.47,3.73,;-2.8,1.42,;-4.21,2.05,;-4.61,3.54,;-5.24,.9,;-4.47,-.43,;-4.95,-1.89,;-3.92,-3.04,;-4.39,-4.5,;-2.41,-2.72,;-1.93,-1.25,;-2.97,-.11,)|
CC(C)N1CCN2CCN(CC2C1=O)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1OC1CCS(=O)CC1
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1O[C@H]1C[C@@]2(CCN2)C1 |r,wU:23.29,wD:21.23,(-5.81,3.54,;-5.41,2.05,;-6.44,.9,;-5.67,-.43,;-6.14,-1.89,;-5.11,-3.04,;-5.59,-4.5,;-3.61,-2.72,;-3.13,-1.25,;-4.16,-.11,;-4,1.42,;-2.67,2.19,;-2.67,3.73,;-1.33,1.42,;-0,2.19,;-0,3.73,;1.33,4.5,;2.67,3.73,;2.67,2.19,;1.33,1.42,;1.33,-.12,;2.67,-.89,;3.07,-2.37,;4.55,-1.98,;4.95,-3.46,;6.44,-3.07,;6.04,-1.58,;4.15,-.49,)|
Nc1nn2cc(CC#N)cnc2c1C(=O)Nc1cnccc1-c1ccccc1
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(cc1F)C(=O)N1CCN2CCC1CC2 |(-5.49,5.35,;-5.17,3.84,;-6.2,2.7,;-5.43,1.36,;-5.9,-.1,;-4.87,-1.24,;-5.35,-2.71,;-3.37,-.92,;-2.89,.54,;-3.92,1.69,;-3.76,3.22,;-2.43,3.99,;-2.42,5.53,;-1.11,3.22,;.22,3.99,;.22,5.53,;1.56,6.3,;2.89,5.53,;2.89,3.99,;1.56,3.22,;1.56,1.68,;.22,.91,;.22,-.63,;1.56,-1.4,;2.89,-.63,;2.89,.91,;4.23,1.68,;1.56,-2.94,;.22,-3.71,;2.89,-3.71,;4.16,-2.85,;5.64,-3.3,;6.2,-4.73,;5.43,-6.07,;3.91,-6.3,;2.78,-5.25,;3.59,-4.38,;4.99,-4.16,)|
COCCn1cncc1-c1c(NC(=O)c2c(N)nn3cc(F)cnc23)cncc1OC |(7.09,-2.4,;6,-1.31,;4.51,-1.71,;3.42,-.62,;1.93,-1.02,;1.46,-2.49,;-.08,-2.49,;-.56,-1.02,;.69,-.12,;.69,1.42,;-.65,2.19,;-1.98,1.42,;-3.31,2.19,;-3.31,3.73,;-4.65,1.42,;-6.05,2.05,;-6.38,3.56,;-7.09,.9,;-6.32,-.43,;-6.79,-1.89,;-5.76,-3.04,;-6.24,-4.5,;-4.25,-2.72,;-3.78,-1.25,;-4.81,-.11,;-.65,3.73,;.69,4.5,;2.02,3.73,;2.02,2.19,;3.35,1.42,;3.35,-.12,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(Cl)c1N1CCC(CC1)C(=N)N1CCN2CCC1CC2 |(-5.5,5.35,;-5.18,3.84,;-6.21,2.7,;-5.44,1.36,;-5.91,-.1,;-4.88,-1.24,;-5.36,-2.71,;-3.38,-.92,;-2.9,.54,;-3.93,1.69,;-3.77,3.22,;-2.44,3.99,;-2.44,5.53,;-1.1,3.22,;.23,3.99,;.23,5.53,;1.57,6.3,;2.9,5.53,;2.9,3.99,;4.23,3.22,;1.57,3.22,;1.57,1.68,;.23,.91,;.23,-.63,;1.57,-1.4,;2.9,-.63,;2.9,.91,;1.57,-2.94,;.23,-3.71,;2.9,-3.71,;4.17,-2.85,;5.64,-3.3,;6.21,-4.73,;5.44,-6.07,;3.91,-6.3,;2.78,-5.25,;3.55,-4.35,;5.07,-4.08,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CC(F)(F)C1
CC1(COC1)N1CCN(CC1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
NN(C(=O)c1nc(cnc1N)-c1cncnc1)c1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(CNCCN2CCCC2)c1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(cc1)C(=O)N1CCCNCC1
CCOPN1CCCN(CC1)C(=O)c1ccc(cc1F)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CCNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)C
CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)c1ccc(-c2cnc(N)c(n2)-c2nnc(o2)-c2ccccc2)c(c1)C#N
CC(C)(C)CCN1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
CC(C)(C)CC(=O)N1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
COC(=O)N1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1
Nc1ncc(nc1-c1nnc(o1)-c1ccccc1)-c1ccc(C(=O)N2CCCNCC2)c2ccccc12
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)CCO
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C1=CCN(CC1)C(=O)OC(C)(C)C |t:27|
CN(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CCN)cc1
COCCNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
Nc1ncc(nc1-c1nnc(o1)-c1cccs1)-c1ccc(cc1C#N)C(=O)C1CCCNCC1
CC(C)Sc1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1cccc(c1)C(C)NC(=O)OC(C)(C)C
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(NC(=O)[C@H]2N[C@H]3CCC2C3)o1 |r,TLB:24:26:30.29:32|
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNCCO)cc1
Cc1ccsc1-c1nnc(o1)-c1nc(cnc1N)-c1ccccc1S(C)=O
Cc1ccsc1-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1C#N)C(=O)N1CCCNCC1
CC(C)Sc1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNCCN(C)C)cc1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(CCNC(=O)OC(C)(C)C)o1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)C(=O)NCC1CCCNC1
CN(C)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccccc1CCCCO
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)CCN(C)C
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(c(OC(F)(F)F)c1)S(=O)(=O)C(C)C
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)CCCO
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)NCCO
CCCS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC)cc1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNC2COC2)cc1F
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)CN(C)C
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)C(C)CC(C)(C)O)c(F)c1
CNCc1ccc(cc1)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)CCOC
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)CCOC)c(F)c1
CNCc1ccc(cc1F)-c1nnc(o1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNCCF)cc1F
CNCc1ccc(-c2nnc(o2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)C(C)CCO)c(F)c1
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(o1)-c1ccc(CNCCF)cc1
CCCNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)C
CC(C)NCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)C(C)C
CC(C)S(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNCO)cc1
CC(O)CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
CNCc1ccc(-c2cc(on2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)C2CCOC2)c(F)c1
CN(C)[C@H]1CCN(C1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2cccc(C)c2[nH]1 |r|
Nc1ncc(nc1-c1nc2ccc(F)cc2[nH]1)-c1ccc(cc1)C(=O)N1CCCOCC1
CN(C)[C@H]1CCN(C1)C(=O)c1ccc(cc1F)-c1cnc(N)c(n1)-c1nc2cccc(F)c2[nH]1 |r|
Nc1ncc(nc1-c1nc2ccc(cc2[nH]1)C(F)(F)F)-c1ccc(cc1)C(=O)N1CCNCC1
COc1ccc2nc([nH]c2c1)-c1nc(cnc1N)-c1ccc(C(=O)N2CCC(CC2)N(C)C)c(F)c1
CN(C)C1CCN(CC1)C(=O)c1ccc(cc1F)-c1cnc(N)c(n1)-c1nc2ccc(cc2[nH]1)C(F)(F)F
Nc1ncc(nc1C(=O)Nc1ccc2CNNc2c1)-c1ccc(cc1)C(=O)N1CCCNCC1
CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1nc2ccccc2s1
CCc1cccc(NC(=O)c2nc(cnc2N)-c2ccc(cc2)S(C)(=O)=O)n1
Cc1cccc(NC(=O)c2nc(cnc2N)-c2ccc(cc2)S(C)(=O)=O)n1
NC1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
Nc1nn2cc(cnc2c1C(=O)Nc1cncc(F)c1N1CCN(CC1)S(=O)(=O)C1COC1)C1(CC1)C#N
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCCC1=O
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)S(=O)(=O)N1CCN2CCC1CC2 |(-4.68,5.96,;-4.28,4.47,;-5.19,3.23,;-4.28,1.98,;-4.6,.47,;-3.46,-.56,;-3.78,-2.06,;-1.99,-.08,;-1.67,1.43,;-2.82,2.46,;-2.82,4,;-1.48,4.77,;-1.48,6.31,;-.15,4,;1.18,4.77,;1.18,6.31,;2.52,7.08,;3.85,6.31,;3.85,4.77,;5.19,4,;2.52,4,;2.52,2.46,;1.18,1.69,;1.18,.15,;2.52,-.62,;3.85,.15,;3.85,1.69,;2.52,-2.16,;4.06,-2.16,;.98,-2.16,;2.52,-3.7,;3.91,-4.37,;4.25,-5.87,;3.29,-7.08,;1.75,-7.08,;.79,-5.87,;1.14,-4.37,;2.45,-4.68,;3.29,-5.73,)|
Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1O[C@H]1CCCNC1 |r|
C[N+]1([O-])CCCC(C1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12
CNCCCN(C)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CC1CN(CCN1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
CN=S(C)(=O)C1(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C(C)(C)O
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C(C)(C)C#N
C[C@@H]1COCCN1c1cc(NCC2CC(F)(F)C2)nc(n1)-c1ccnc2[nH]ccc12
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C(C)(O)C(F)(F)F
CN1CC[C@H](C1)ON1CCN(CC1)c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
CN1CC[C@H](C1)ON1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1OC1CC[S+]([O-])CC1 |(-6.38,3.29,;-5.61,1.96,;-6.52,.71,;-5.61,-.54,;-5.93,-2.04,;-4.79,-3.07,;-5.19,-4.56,;-3.33,-2.6,;-3.01,-1.09,;-4.15,-.06,;-4.15,1.48,;-2.82,2.25,;-2.82,3.79,;-1.48,1.48,;-.15,2.25,;-.15,3.79,;1.18,4.56,;2.52,3.79,;2.52,2.25,;1.18,1.48,;1.18,-.06,;2.52,-.83,;2.52,-2.37,;3.85,-3.14,;5.19,-2.37,;6.52,-3.14,;5.19,-.83,;3.85,-.06,)|
Nc1nn2cc(F)cnc2c1C(=O)Nc1cncc(F)c1N1CCC(CC1)C(=O)N1CCC2CCC1CN2
CN1CC2CN(CC2C1)C(O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12
C[N+]1([O-])CCC(CC1)C(=O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |(6.08,-6.58,;5.56,-5.13,;7.07,-4.86,;4.16,-5.94,;2.83,-5.11,;2.83,-3.57,;4.17,-2.8,;5.55,-3.52,;1.5,-2.8,;.17,-3.57,;1.5,-1.26,;.17,-.49,;.17,1.05,;1.5,1.82,;2.83,1.05,;2.83,-.49,;1.5,3.36,;2.83,4.13,;4.17,3.36,;2.83,5.67,;1.5,6.44,;.17,5.67,;.17,4.13,;-1.17,3.36,;-2.5,4.13,;-2.5,5.67,;-3.83,3.36,;-5.24,3.99,;-5.56,5.49,;-6.27,2.84,;-5.5,1.51,;-5.98,.05,;-4.95,-1.1,;-5.42,-2.56,;-3.44,-.78,;-2.96,.69,;-4,1.83,)|
CC1COCCN1c1cc(nc(c1)-c1cccc2[nH]ccc12)-c1ccnn1C
CC1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)-c1ccnn1C
CC1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)-c1cc(C)nn1C
CC1COCCN1c1nc(cc(n1)-c1cccc2[nH]ccc12)-c1ccnn1C
CCn1nccc1-c1cc(nc(n1)N1CCOCC1C)-c1cccc2[nH]ccc12
CC1COCCN1c1nc(cc(n1)-c1ccnc2[nH]ccc12)-c1ccnn1C
CC1COCCN1c1nc(cc(n1)-c1ccnc2[nH]ccc12)-c1c(C)cnn1C
CCn1nccc1-c1cc(nc(n1)N1CCOCC1C)-c1ccnc2[nH]ccc12
CC1COCCN1c1nc(cc(n1)-c1cc(F)cc2[nH]ccc12)-c1ccnn1C
CC1COCCN1c1nc(cc(n1)-c1cc(F)cc2[nH]ccc12)-c1c(C)cnn1C
CCn1nccc1-c1cc(nc(n1)N1CCOCC1C)-c1cc(F)cc2[nH]ccc12
CC1COCCN1c1nc(cc(n1)-c1cccc2[nH]ccc12)-c1c(C)cnn1C
CC1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)-c1c(C)cnn1C
CCn1nccc1-c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1ccnn1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1cc(C)nn1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1c(C)cnn1C
CCn1nccc1-c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOCC1C
CC1COCCN1c1cc(nc(n1)-c1cc(F)cc2[nH]ccc12)-c1ccnn1C
CC1COCCN1c1cc(nc(n1)-c1cc(F)cc2[nH]ccc12)-c1cc(C)nn1C
CC1COCCN1c1cc(nc(n1)-c1cc(F)cc2[nH]ccc12)-c1c(C)cnn1C
CCn1nccc1-c1cc(nc(n1)-c1cc(F)cc2[nH]ccc12)N1CCOCC1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1c(C)n[nH]c1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1c(C)nn(C)c1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1cn(C)nc1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1cnn(C)c1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1cn(C)nc1C(F)(F)F
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1c(C)noc1C
CCc1c(cnn1C)-c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOCC1C
CC1COCCN1c1cc(cc(n1)-c1ccnc2[nH]ccc12)-c1c(C)noc1C
CC1COCCN1c1cc(cc(n1)-c1ccnc2[nH]ccc12)-c1c(C)cnn1C
CC1COCCN1c1cc(cc(n1)-c1ccnc2[nH]ccc12)-c1c(C)n[nH]c1C
CC1COCCN1c1cc(cc(n1)-c1ccnc2[nH]ccc12)-c1ccnn1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1c(C)nnn1C
CC1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)-c1c(C)nnn1C
CC1COCCN1c1cc(nc(n1)-c1cc(F)cc2[nH]ccc12)-c1c(C)nnn1C
CC1COCCN1c1cc(nc(n1)-c1cc(CO)cc2[nH]ccc12)-c1c(C)nnn1C
CC1COCCN1c1cc(cc(n1)-c1cc(CO)cc2[nH]ccc12)-c1c(C)nnn1C
CC1COCCN1c1cc(cc(n1)-c1ccnc2[nH]ccc12)-c1c(C)nnn1C
COc1cc(C)c(cn1)-c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOCC1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1ccc(F)nc1C
CC1N=CC(C)=C1c1cc(nc(n1)-c1cc(CO)cc2[nH]ccc12)N1CCOCC1C |c:2,5|
COCc1cnn(C)c1-c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1c(C)ncn1C
CC1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)-n1c(C)nnc1C
CC1COCCN1c1cc(nc(n1)-c1cc(F)cc2[nH]ccc12)-n1c(C)nnc1C
CC1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)-c1c(C)nnn1C1CC1
CC1COCCN1c1cc(cc(n1)-c1ccnc2[nH]ccc12)-n1c(C)nnc1C
CC1COCCN1c1cc(nc(n1)-c1cc(CO)cc2[nH]ccc12)-n1c(C)nnc1C1CC1
CC1N=NC(C)=C1c1cc(nc(c1)-c1ccnc2[nH]ccc12)N1CCOCC1C |c:2,5|
CC1COCCN1c1cc(nc(n1)-c1cc(CO)cc2[nH]ccc12)-c1c(C)noc1C
CC1COCCN1c1cc(nc(n1)-c1cc(C)cc2[nH]ccc12)-c1c(C)noc1C
CC1COCCN1c1cc(nc(n1)-c1cc(cc2[nH]ccc12)C(O)=O)-c1c(C)noc1C
CC1COCCN1c1cc(cc(n1)-c1cc(F)cc2[nH]ccc12)-n1c(C)nnc1C
CC1COCCN1c1nc(cc(n1)-n1c(C)nnc1C)-c1cccc2[nH]ccc12
CC1COCCN1c1nc(cc(n1)-n1cnnc1C)-c1cc(F)cc2[nH]ccc12
Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1OC1CC[S](O)CC1 |(-6.38,3.29,;-5.61,1.96,;-6.52,.71,;-5.61,-.54,;-5.93,-2.04,;-4.79,-3.07,;-5.19,-4.56,;-3.33,-2.6,;-3.01,-1.09,;-4.15,-.06,;-4.15,1.48,;-2.82,2.25,;-2.82,3.79,;-1.48,1.48,;-.15,2.25,;-.15,3.79,;1.18,4.56,;2.52,3.79,;2.52,2.25,;1.18,1.48,;1.18,-.06,;2.52,-.83,;2.52,-2.37,;3.85,-3.14,;5.19,-2.37,;6.52,-3.14,;5.19,-.83,;3.85,-.06,)|
CN1CC2CN(C[C@H]2C1)C(O)C1CCN(CC1)c1c(F)cncc1NC(=O)c1c(N)nn2cc(F)cnc12 |r|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(C3CCNCC3)c2C(F)(F)F)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;3.68,-1.14,;2.21,-.67,;.75,-.19,;2.69,.8,;1.74,-2.13,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)n(nc2C(F)(F)F)C2CCNCC2)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;.75,-.19,;2.69,.8,;1.74,-2.13,;6.6,-3.85,;8.13,-3.69,;9.04,-4.94,;8.41,-6.34,;6.88,-6.51,;5.97,-5.26,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(C3CCNCC3)c2C)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;3.68,-1.14,;2.21,-.67,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)noc2C)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(C3CCNCC3)c2C(F)(F)F)n2ncc(-c3ccccn3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;3.68,-1.14,;2.21,-.67,;.75,-.19,;2.69,.8,;1.74,-2.13,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.14,5.87,;-.33,7.34,;.7,8.48,;2.2,8.16,;2.68,6.7,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(C3CCNCC3)c2C(F)(F)F)n2ncc(-c3cccs3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;3.68,-1.14,;2.21,-.67,;.75,-.19,;2.69,.8,;1.74,-2.13,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nnn2C)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2cncc(F)c2)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;-.72,-4.78,;1.72,-3.69,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2cncc(c2)C(F)F)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;-.72,-4.78,;-1.62,-6.02,;-1.35,-3.37,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2cncc(c2)C#N)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;-.72,-4.78,;-2.25,-4.62,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2cncc(Cl)c2)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;-.72,-4.78,;1.72,-3.69,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2ccnnc2)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2ccc(=O)[nH]c2)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.53,-7.59,;.81,-4.94,;1.72,-3.69,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(C(=O)N3CCNCC3)c2C)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.25,-3.85,;3.88,-5.26,;1.72,-3.69,;.81,-4.94,;-.72,-4.78,;-1.35,-3.37,;-.44,-2.12,;1.09,-2.28,;3.68,-1.14,;2.21,-.67,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(C3CCNC[C@@H]3F)c2C)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,20.22,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;1.09,-2.28,;3.68,-1.14,;2.21,-.67,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(C3CCNC[C@H]3F)c2C)n2ncc(-c3ccn[nH]3)c2n1 |wU:20.22,wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;1.09,-2.28,;3.68,-1.14,;2.21,-.67,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2cncc(c2)C(N)=O)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;-.72,-4.78,;-1.62,-6.02,;-1.35,-3.37,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(CCO)c2C)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.25,-3.85,;1.72,-3.69,;.81,-4.94,;3.68,-1.14,;2.21,-.67,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2cncc(O)c2)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;-.72,-4.78,;1.72,-3.69,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(n2ncc(-c3ccn[nH]3)c2n1)C1(O)CCOCC1
C[C@@H]1COCCN1c1cc(-c2cccnc2C(F)(F)F)n2ncc(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2cccnc2)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2cncc(C)c2)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;-.72,-4.78,;1.72,-3.69,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2ccncc2)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;1.72,-3.69,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)n2ncc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)n2ncc(-c3cn[nH]c3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)n2ncc(-c3cccnc3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)n2ncc(-c3ccc[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(n2ncc(-c3ccn[nH]3)c2n1)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(-c2cccnc2F)n2ncc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(n2ncc(-c3ccc[nH]3)c2n1)C1(CC1)[S@](C)(=N)=O |r|
C[C@@H]1COCCN1c1cc(n2ncc(-c3ccn[nH]3)c2n1)C1(CC1)[S@@](C)(=N)=O |r|
C[C@@H]1COCCN1c1cc(n2ncc(-c3ccc[nH]3)c2n1)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(n2ncc(-c3cc[nH]c3)c2n1)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(-c2ccn[nH]2)n2ncc(-c3ccc[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(n2ncc(-c3cc(C)n[nH]3)c2n1)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(n2ncc(-c3[nH]ncc3C)c2n1)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)n2ncc(-c3cc(C)n[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2ncc(-c3ccc[nH]3)n2n1 |r|
C[C@@H]1COCCN1c1cc(c2ncc(-c3ccn[nH]3)n2n1)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2cnc(-c3ccn[nH]3)n2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2snc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(c2cnc(-c3ccn[nH]3)n2n1)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(c2cnc(-c3cc(C)n[nH]3)n2n1)C1(CC1)S(C)(=O)=O |r|
CS(=O)(=O)C1(CC1)c1cc(nn2c(ncc12)-c1ccn[nH]1)N1CC2CCC(C1)O2
C[C@@H]1COCCN1c1cc(-c2c(C)nnn2C)c2cnc(-c3ccn[nH]3)n2n1 |r,wU:1.0,(2.08,2.09,;.71,2.79,;.71,4.33,;-.63,5.1,;-1.96,4.33,;-1.96,2.79,;-.63,2.02,;-.66,.48,;-2,-.29,;-2,-1.83,;-3.33,-2.6,;-4.74,-1.98,;-5.06,-.47,;-5.77,-3.12,;-5,-4.46,;-3.49,-4.14,;-2.29,-5.1,;-.66,-2.6,;-.34,-4.11,;1.19,-4.27,;1.81,-2.86,;3.33,-2.59,;3.97,-1.27,;5.5,-1.44,;5.77,-2.86,;4.45,-3.74,;.67,-1.83,;.67,-.29,)|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2cnc(-c3cc(C)n[nH]3)n2n1 |r|
CCP(=O)(CC)c1cc(nn2c(ncc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(-c2c(C)nnn2C)c2snc(-c3cc(C)n[nH]3)c2n1 |r,wU:1.0,(1.63,2.05,;.3,2.82,;.3,4.36,;-1.03,5.13,;-2.37,4.36,;-2.37,2.82,;-1.03,2.05,;-1.03,.51,;-2.37,-.26,;-2.37,-1.8,;-3.7,-2.57,;-5.11,-1.94,;-5.43,-.44,;-6.14,-3.09,;-5.37,-4.42,;-3.86,-4.1,;-2.72,-5.13,;-1.03,-2.57,;-.71,-4.08,;.82,-4.24,;1.44,-2.83,;2.95,-2.51,;3.58,-1.1,;5.11,-1.26,;6.14,-.12,;5.43,-2.77,;4.09,-3.54,;.3,-1.8,;.3,-.26,)|
C[C@@H]1COCCN1c1cc(c2snc(-c3cc(C)n[nH]3)c2n1)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3ccn[nH]3)c2n1)C1(CC1)C#N |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3cc(C)n[nH]3)c2n1)C1(CC1)C#N |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3ccn[nH]3)c2n1)C(C)(C)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3cc(C)n[nH]3)c2n1)C(C)(C)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3ccn[nH]3)c2n1)C1(CCCC1)C#N |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3ccn[nH]3)c2n1)C1(CCCCC1)C#N |r|
C[C@@H]1COCCN1c1cc(c2cnc(-c3ccn[nH]3)n2n1)C1(CCCCC1)C#N |r|
C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2c(Cl)nc(-c3ccn[nH]3)n2n1 |r|
C[C@@H]1COCCN1C1=NN2C(C(Cl)N=C2c2cc(C)n[nH]2)C(=C1)c1ccnn1C |r,c:14,24,t:8|
C[C@@H]1COCCN1c1cc(c2cnc(-c3cc(C)n[nH]3)n2n1)C1(CC1)C#N |r|
C[C@@H]1COCCN1c1cc(c2cnc(-c3cc(C)n[nH]3)n2n1)C(C)(C)C#N |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3ccn[nH]3)c2n1)S(=O)(=O)C1CC1 |r|
C[C@@H]1COCCN1c1cc(N2CCCCS2(=O)=O)c2snc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(c2onc(-c3cc(C)n[nH]3)c2n1)C1(CCCC1)C#N |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3cc(C)n[nH]3)c2n1)C1(CCCCC1)C#N |r|
C[C@@H]1COCCN1c1cc(N2CCCCS2(=O)=O)c2snc(-c3cc(C)n[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3ccn[nH]3)c2n1)C1(CCOCC1)C#N |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3cc(C)n[nH]3)c2n1)C1(CCOCC1)C#N |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3cc(C)n[nH]3)c2n1)S(=O)(=O)C1CC1 |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3cc(C)n[nH]3)c2n1)C1(CCCC1)C(N)=O |r|
C[C@@H]1COCCN1c1cc(c2snc(-c3ccn[nH]3)c2n1)C1(CCCCC1)C(N)=O |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(COCCN3CCC(C)(C)CC3)nc2)n(C)c1=O
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCC(=O)N2CCC3(CC3)C2)n(C)c1=O |r|
COC1CCN(CCO[C@H](C)c2ccc(cn2)-c2ccc3nnc4n(C)c(=O)n(C(C)C)c4c3c2)CC1 |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CCCC2)n(C)c1=O |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CCC(C2)OC2CC2)n(C)c1=O |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CC[C@@H](C)C2)n(C)c1=O |r|
C[C@@H](OCCN1CCC2(CC2)C1)c1ccc2nnc3n(C)c(=O)n(C4CCOCC4)c3c2c1 |r|
C[C@@H](OCCN1CCC2(CC2)CC1)c1ccc(cn1)-c1ccc2nnc3n(C)c(=O)n(C4CCOCC4)c3c2c1 |r|
CO[C@@H]1CCN(CCO[C@H](C)c2ccc(cn2)-c2ccc3nnc4n(C)c(=O)n(C5CCOCC5)c4c3c2)C1 |r|
CO[C@H]1C[C@@H](C1)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CCCC2)n(C)c1=O |r,wU:2.1,wD:4.6,23.27,(3.84,4.98,;3.36,3.51,;4.39,2.37,;5.93,2.29,;5.85,.75,;4.31,.83,;6.88,-.39,;6.56,-1.9,;7.9,-2.67,;7.9,-4.21,;6.56,-4.98,;5.23,-4.21,;3.89,-4.98,;2.56,-4.21,;2.56,-2.67,;3.89,-1.9,;5.23,-2.67,;1.23,-1.9,;1.23,-.36,;-.11,.41,;-1.44,-.36,;-1.44,-1.9,;-.11,-2.67,;-2.77,.41,;-2.77,1.95,;-4.11,-.36,;-5.44,.41,;-6.78,-.36,;-8.11,.41,;-8.27,1.94,;-9.78,2.26,;-10.55,.93,;-9.52,-.22,;9.04,-1.64,;10.55,-1.96,;8.41,-.23,;9.18,1.1,)|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@H](OCCN2CCCC2)C(F)(F)F)n(C)c1=O |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](OCCN2CCCC2)C(F)(F)F)n(C)c1=O |r|
C[C@@H]1COCCN1c1cc(c2n(C)nc(-c3cc[nH]n3)c2n1)C(C)(C)C#N
Cn1c2cnc3cc(F)c(-c4ccc(OCCCN5CCCCC5)nc4)c4OC5CCCCC5n(c2c34)c1=O
CC[C@@H]1COc2c(c(F)cc3ncc4n(C)c(=O)n1c4c23)-c1ccc(OCCCN2CCCCC2)nc1 |r|
C[C@@H]1COCCN1c1cc(nc2c(cnn12)-c1cc[nH]n1)N1CC2CCC(C1)O2 |r|
C[C@@H]1COCCN1c1cc(nn2c(cnc12)-c1cc[nH]n1)N1CC2CCC(C1)O2 |r|
C[C@@H]1COCCN1c1cc(nn2c(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2 |r|
C[C@@H]1COCCN1c1c(Cl)c(nn2c(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2 |r|
C[C@@H]1COCCN1c1cc(nc2n(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2 |r|
C1CC2CN(CC1O2)c1cc(N2CC3CCC(C2)O3)c2cnc(-c3cc[nH]n3)n2n1
C1CC2CN(CC1O2)c1cc(N2CCOCC2)c2cnc(-c3cc[nH]n3)n2n1
C1CC2CN(CC1O2)c1cc(N2C3CCC2COC3)c2cnc(-c3cc[nH]n3)n2n1
C[C@@H]1CNCCN1c1cc(nn2c(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2 |r|
C1CC2CN(CC1O2)c1cc(N2CCNCC2)c2cnc(-c3cc[nH]n3)n2n1
C[C@@H]1CN(C)CCN1c1cc(nn2c(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2 |r|
C1CC2CN(CC1O2)c1cc(N2CC3CCC(C2)O3)c2cnn(-c3cc[nH]n3)c2n1
Cn1nc(-c2cc[nH]n2)c2nc(cc(N3CC4CCC(C3)O4)c12)N1CC2CCC(C1)O2
FC1(F)CCN(CC1)c1cc(nn2c(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2
C[C@H]1COCCN1c1cc(nn2c(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2 |r|
C[C@H]1CN(C[C@@H](C)O1)c1cc(nn2c(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2 |r|
C1CC2CC(CC1O2)c1cc(N2CCCCC2)c2cnc(-c3cc[nH]n3)n2n1
CC1CN(CCO1)c1cc(nn2c(ncc12)-c1cc[nH]n1)C1CC2CCC(C1)O2
Cn1nccc1-c1cc(nc2c(cnn12)-c1cc[nH]n1)N1CC2CCC(C1)O2
Cn1nccc1-c1cc(nn2c(cnc12)-c1cc[nH]n1)N1CC2CCC(C1)O2
CC1(C)COCCN1c1cc(nn2c(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2
OC1(CCOCC1)c1cc(nc2c(cnn12)-c1ccn[nH]1)N1CC2CCC(C1)O2
CC(=O)N6CCN(c4cc(N1CC2CCC(C1)O2)nc5c(c3cc[nH]n3)ncn45)[C@H](C)C6
CC1CC(F)(F)CCN1c5cc(N2CC3CCC(C2)O3)nn6c(c4cc[nH]n4)ncc56
C[C@H]1CC(F)(F)CCN1c1cc(nn2c(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2 |r|
C[C@@H]1CN(CCN1c1cc(nc2n(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2)C(C)=O |r|
OCC1COCCN1c1cc(nc2n(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2
CC1(C)COCCN1c1cc(nc2c(ncn12)-c1ccn[nH]1)N1CC2CCC(C1)O2
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(CNC(=N)N)cc4)no3)n2)cc1
CNCc1ccc(-c2cc(-c3nc(-c4ccc(S(=N)(=O)C(C)C)cc4)cnc3N)on2)cc1
CC(C)S(=O)(=O)c5ccc(c4cnc(N)c(c3cc(c2ccc1[nH]nnc1c2)no3)n4)cc5
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(CNC(=N)N)cc4F)no3)n2)cc1
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(CNC(=O)NC5CC5)cc4)no3)n2)cc1
CCNC(=O)NCc1ccc(-c2cc(-c3nc(-c4ccc(S(=O)(=O)C(C)C)cc4)cnc3N)on2)cc1
CNC(=O)NCc1ccc(-c2cc(-c3nc(-c4ccc(S(=O)(=O)C(C)C)cc4)cnc3N)on2)cc1
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(CNS(C)(=O)=O)cc4)no3)n2)cc1
CC(C)S(=O)(=O)c4ccc(c3cnc(N)c(c2cc(c1ccc(CNC(N)=O)cc1)no2)n3)cc4
CN(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(CNC(=N)N)cc4)no3)n2)cc1
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4c(F)cc(CNC(=N)N)cc4F)no3)n2)cc1
CN=S(C)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(CNC(=N)N)cc4)no3)n2)cc1
CN=S(=O)(c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(CNC(=N)N)cc4)no3)n2)cc1)C(C)C
CNC(=O)Nc1ccc(-c2cc(-c3nc(-c4ccc(S(=O)(=O)C(C)C)cc4)cnc3N)on2)cc1
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(NC(N)=O)cc4)no3)n2)cc1
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(NC(=N)N)cc4)no3)n2)cc1
CNC(=N)Nc1ccc(-c2cc(-c3nc(-c4ccc(S(=O)(=O)C(C)C)cc4)cnc3N)on2)cc1
CCNC(=N)Nc1ccc(-c2cc(-c3nc(-c4ccc(S(=O)(=O)C(C)C)cc4)cnc3N)on2)cc1
CNC(=N)Nc1ccc(-c2cc(-c3nc(-c4ccc(S(=O)(=O)C(C)C)cc4)cnc3N)on2)nc1
CNC(=N)Nc1ccc(-c2cc(-c3nc(-c4ccc(S(=O)(=O)C(C)C)cc4)cnc3N)on2)c(F)c1
CC(C)S(=O)(=O)c5ccc(c4cnc(N)c(c3cc(c2ccc1[nH]c(=O)[nH]c1c2)no3)n4)cc5
CC(C)S(=N)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc5c(c4)CC(=O)N5)no3)n2)cc1
N=C(N)NCc1ccc(-c2cc(-c3nc(-c4ccc(S(=O)(=O)C5CC5)cc4)cnc3N)on2)cc1
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(CNC(=N)N)c(F)c4)no3)n2)cc1
CN(C)C(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(CNC(=N)N)cc4)no3)n2)cc1
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc(C(=O)NC(=N)N)cc4)no3)n2)cc1
N=C(N)NCc1ccc(-c2cc(-c3nc(-c4ccc5c(c4)CCS5(=O)=O)cnc3N)on2)cc1
CC(=N)NCc1ccc(-c2cc(-c3nc(-c4ccc(S(=O)(=O)C(C)C)cc4)cnc3N)on2)cc1
CC(=N)Nc1ccc(-c2cc(-c3nc(-c4ccc(S(=O)(=O)C(C)C)cc4)cnc3N)on2)cc1
Cc1cc(CNC(=N)N)ccc1-c1cc(-c2nc(-c3ccc(S(=O)(=O)C(C)C)cc3)cnc2N)on1
CC(C)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3cc(-c4ccc5c(c4)CNC5=O)no3)n2)cc1
CNCc1ccc(-c2cc(-c3nc(-c4ccc5c(c4)C(F)C(C)(C)S5(=O)=O)cnc3N)on2)cc1
CNCc1ccc(-c2nnc(-c3nc(-c4ccc5c(c4)[C@@H](F)C(C)(C)S5(=O)=O)cnc3N)o2)cc1
CNCc1ccc(-c2cc(-c3nc(-c4ccc5c(c4)C(F)C(C)(C)S5(=O)=O)cnc3N)no2)cc1
CNCc1ccc(-c2cc(-c3nc(-c4ccc5c(c4)[C@@H](F)C(C)(C)S5(=O)=O)cnc3N)on2)cc1
CN1CCC(NCc2ccc(-c3nnc(-c4nc(-c5ccc6c(c5)C(F)C(C)(C)S6(=O)=O)cnc4N)o3)cc2)CC1
CNCc5ccc(c4nnc(c3nc(c1ccc2c(c1)C(F)C(C)(C)S2(=O)=O)cnc3N)s4)cc5
[2H]c2c(c1ccc(CNC)cc1)noc2c5nc(c3ccc4c(c3)[C@@H](F)C(C)(C)S4(=O)=O)cnc5N
CC(C)S(=O)(=O)c1ccc(cc1)c2cnc(c(n2)c3cc(no3)c4ccc(cc4)CNC)N
C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(N=S2(=O)CCC2)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(N=S2(=O)CCCC2)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(N=S2(=O)CCOCC2)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2CC2)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)C2CC2)c2cnn(-c3ccn[nH]3)c2n1
Cc1cc(-n2ncc3c(N=S(C)(C)=O)cc(N4CCOC[C@H]4C)nc32)[nH]n1
C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)c2ccc(F)cc2)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)C2CCCC2)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2CCC(F)(F)CC2)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(N=S(C)(=O)C(C)(C)C)c2cnn(-c3ccn[nH]3)c2n1
Cc1cc(-n2ncc3c(N=[S@@](C)(=O)C4CC4)cc(N4CCOC[C@H]4C)nc32)[nH]n1
Cc1nn(-c2ccn[nH]2)c2nc(N3CCOC[C@H]3C)cc(N=S(C)(C)=O)c12
C[C@@H]1COCCN1c4cc(N=S(C)(C)=O)c3c(C(F)(F)F)nn(c2ccn[nH]2)c3n4
C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)c2c(CCC(F)(F)F)nn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)c2c(C(C)(C)C)nn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(-c2ccnc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2cccc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2cncc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2cnc3[nH]ccc3c2)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2c[nH]c3ncccc23)nc2c1ccn2S(C)(=O)=O
Cc1c[nH]c2nccc(-c3cc(N4CCOC[C@H]4C)c4ccn(S(C)(=O)=O)c4n3)c12
C[C@@H]1COCCN1c1cc(-c2cc(F)cc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2ccc(F)c3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2ccn[nH]2)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2cn[nH]c2)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2nc3ccccc3[nH]2)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2ncnc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2ccnc3[nH]cnc23)nc2c1ccn2S(C)(=O)=O
CC(C)S(=O)(=O)n1ccc2c(N3CCOC[C@H]3C)cc(-c3ccnc4[nH]ccc34)nc21
C[C@@H]1COCCN1c1cc(-c2ccnc3[nH]ccc23)nc2c1ccn2S(=O)(=O)C1CC1
C[C@@H]1COCCN1c1cc(-c2ccnc3[nH]ccc23)nc2c1ccn2S(=O)(=O)N(C)C
C[C@@H]1COCCN1c1nc(-c2ccnc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2cccc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2cncc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2cc(F)cc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2ccnc3[nH]ccc23)nc2c1ccn2S(=O)(=O)CCO
C[C@@H]1COCCN1c1nc(-c2ccnc3[nH]ccc23)nc2c1ncn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2ccnc3[nH]ccc23)nc2c1cnn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2ccnc3[nH]ccc23)nc2c1ncn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2cncc3[nH]ccc23)cc2c1ncn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2ccnc3[nH]ccc23)cc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2nc3ccccc3[nH]2)nc2c1ccn2S(C)(=O)=O
CNc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2ccn(S(C)(=O)=O)c2n1
Cc1cc(-c2cc3c(ccn3S(C)(=O)=O)c(N3CCOC[C@H]3C)n2)c2cc[nH]c2c1
C[C@@H]1COCCN1c1nc(-c2cc(C#N)cc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2cc(Cl)cc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
COc1cc(-c2nc(N3CCOC[C@H]3C)c3ccn(S(C)(=O)=O)c3n2)c2cc[nH]c2c1
CCS(=O)(=O)n1ccc2c(N3CCOC[C@H]3C)nc(-c3ccnc4[nH]ccc34)nc21
C[C@@H]1COCCN1c1nc(-c2ccnc3[nH]ccc23)nc2c1ccn2S(=O)(=O)N(C)C
C[C@@H]1COCCN1c1nc(cc2n(C)cnc12)-c1cncc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1cc(-c2cccc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2cncc3[nH]ccc23)nc2c1ccn2C
C[C@@H]1COCCN1c1cc(-c2cncc3[nH]ccc23)nc2c1ccn2CS(C)(=O)=O
CC(n1ccc2c(N3CCOC[C@H]3C)cc(-c3cncc4[nH]ccc34)nc21)S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2ccnc3[nH]ccc23)c2ccn(S(C)(=O)=O)c2n1
CC(n1cnc2c(N3CCOC[C@H]3C)nc(-c3cncc4[nH]ccc34)cc21)S(C)(=O)=O
CC(C)n1c2c(n(C)c1=O)N=NC1CC(F)C(C3C=NC(OCCCN4CCCCC4)=CC3)=CC21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN(C)C)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CCCC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(N5CCC(N(C)C)CC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(N5CCC(CN(C)C)C5)nc4)cc3c21
CC(C)n1c2c(n(C)c1=O)N=NC1C=C(F)C(c3ccc(COCCN(C)C)nc3)=CC21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CCCCC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CCCC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CC[C@@H](F)C5)nc4)cc3c21
CC(C)n1c2c(nnc3cc(F)c(cc23)-c2ccc(COCCN3CCC(F)CC3)nc2)n(C)c1=O
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CC6CC6C5)nc4)cc3c21
CC(C)n1c2c(n(C)c1=O)N=NC1C=C(F)C(c3ccc(C(=O)NCCN(C)C)nc3)=CC21
CC(C)n1c2c(n(C)c1=O)N=NC1CC(F)C(C3C=NC(OCCCN4CCC(F)CC4)=CC3)=CC21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CC[C@H](F)C5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CC[C@@H](F)C5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CC6CC6C5)nc4)cc3c21
C[C@@H]1COCCN1c1nc(-c2ccnc3[nH]ccc23)nc2c1ncn2S(C)(=O)=O
C[C@@H]1COCCN1c1cc(-c2ccnc3[nH]ccc23)nc2c1ccn2C
C[C@@H]1COCCN1c1cc(-c2ccnc3[nH]ccc23)nc2c1ccn2CS(C)(=O)=O
CC(n1ccc2c(N3CCOC[C@H]3C)cc(-c3ccnc4[nH]ccc34)nc21)S(C)(=O)=O
Cc1[nH]nc(C(F)(F)F)c1c3cc(N2CCOC[C@H]2C)nc4c3cnn4c5cc[nH]n5
C#CC5CC=C(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cn[nH]c4)CC5
C[C@@H]1COCCN1c6cc(C2(O)CCC3(CC2)CO3)c5cnn(c4cc[nH]n4)c5n6
C#CC5CCC(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4ccn[nH]4)CC5
Cc2nn(C1CCNCC1)c(C(F)(F)F)c2c4cc(N3CCOC[C@H]3C)nc5c4cnn5c6cc[nH]n6
C[C@@H]1COCCN1c8cc(c5ccc(N4CC3(CCN(Cc2ccccc2)C3)CC4=O)cc5)c7cnn(c6cc[nH]n6)c7n8
Cc5c(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)c(C(F)(F)F)nn5C6CCNCC6
CCC(=O)C#Cc2cc(N1CCOC[C@H]1C)nc3c2cnn3c4ccn[nH]4
COCC#Cc2cc(N1CCOC[C@H]1C)nc3c2cnn3c4ccn[nH]4
C[C@@H]1COCCN1c6cc(C#CCN3CC2(CNC2)C3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c5cc(C#CC2(O)CCCCC2)c4cnn(c3cc[nH]n3)c4n5
C[C@@H]1COCCN1c6cc(C3(C(N)=O)CCN(c2cccc(F)c2)CC3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCC2=O)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)N2CCCC2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c5cc(C2=CCCOC2)c4cnn(c3cc[nH]n3)c4n5
C[C@@H]1COCCN1c6cc(C3(C#N)CCN(c2cccc(F)c2)CC3)c5cnn(c4cc[nH]n4)c5n6
Cc5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)cn5
C[C@@H]1COCCN1c5cc(C#CC2CCCNC2)c4cnn(c3ccn[nH]3)c4n5
C[C@@H]1COCCN1c6cc(C#CC2(O)CCC3(CC2)CC3)c5cnn(c4ccn[nH]4)c5n6
C[C@@H]1COCCN1c5cc(C#CC2CCCOC2)c4cnn(c3ccn[nH]3)c4n5
C[C@@H]1COCCN1c6cc(c2ccnc3[nH]ccc23)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCC2=O)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(C#CC3(O)CCN(c2cccc(F)c2)CC3)c5cnn(c4ccn[nH]4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CCN(C)C2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c5cc(C2CCCOC2)c4cnn(c3cc[nH]n3)c4n5
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)c2cccnc2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(C#CC3(O)CCC2(CCOCC2)CC3)c5cnn(c4ccn[nH]4)c5n6
CNC(=O)N(C)c5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)cc5
C[C@@H]1COCCN1c7cc(c4ccc(N3CC2(COC2)C3)cc4)c6cnn(c5cc[nH]n5)c6n7
CCN6CCN(c5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)cc5)C6=O
C[C@@H]1COCCN1c4cc(C#CC(C)(C)O)c3cnn(c2cc[nH]n2)c3n4
C[C@@H]1COCCN1c5cc(c2ccc(NC(=O)C(F)F)cc2)c4cnn(c3cc[nH]n3)c4n5
C#Cc2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CC2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c4cc(C#CCN(C)C)c3cnn(c2cc[nH]n2)c3n4
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)N2CCNCC2)cc3)c5cnn(c4cc[nH]n4)c5n6
CC(=O)Nc5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)cc5
CC(=O)Nc1ccccc1c3cc(N2CCOC[C@H]2C)nc4c3cnn4c5cc[nH]n5
CC(=O)C(=O)Nc5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)cc5
C[C@@H]1COCCN1c6cc(c3ccc(n2cc[nH]c2=O)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CCC2)cc3)c5cnn(c4cc[nH]n4)c5n6
CCn6ccn(c5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)cc5)c6=O
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)NC2CC2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(N(C)C(=O)N2CCCC2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3cccc(N2CCCC2=O)c3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCC2=O)cc3C#N)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCC2=O)cc3F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c7cc(c2ccc3c(c2)CCCN3C(=O)c4cccnc4)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c6cc(c3ccc(N2C(=O)CCCC2CO)cc3)c5cnn(c4cc[nH]n4)c5n6
Cc5cc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)ccc5NC(=O)N6CCCC6
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCN(C)C2=O)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(N(C)C(=O)N2CCCC2)nc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c7cc(c4ccc(N3CC2CCC(O2)C3=O)cc4)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)N2CCCC2)c(C#N)c3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(C#Cc2ccnc3[nH]ccc23)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)N2CCCCC2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c5cc(C#Cc2c[nH]cn2)c4cnn(c3cc[nH]n3)c4n5
C[C@@H]1COCCN1c6cc(c3ccc(N(C)C(=O)N2CCCCC2)cc3)c5cnn(c4cc[nH]n4)c5n6
CC(=O)N5CCC(C#Cc2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)C5
C[C@@H]1COCCN1c7cc(c4ccc(NC(=O)NC2CC3CCC(C2)N3)cc4)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c5cc(C#CC2(O)COC2)c4cnn(c3cc[nH]n3)c4n5
C[C@@H]1COCCN1c8cc(c5ccc(NC(=O)C34CC2CC(CC(C2)C3)C4)cc5)c7cnn(c6cc[nH]n6)c7n8
C[C@@H]1COCCN1c5cc(C#CC(=O)N2CC(O)C2)c4cnn(c3cc[nH]n3)c4n5
CCC(=O)Nc5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)c(F)c5
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)c2cccc(S(C)(=O)=O)c2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CC2)cc3F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCNC2=O)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)c2cocn2)cc3F)c5cnn(c4cc[nH]n4)c5n6
C#CC5CCC(O)(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)CC5
C[C@@H]1COCCN1c5cc(c2ccc(NC(=O)C(F)F)cc2F)c4cnn(c3cc[nH]n3)c4n5
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)c2ccncc2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c7cc(c4ccc(N3CC2CCC(O2)C3=O)cn4)c6cnn(c5cc[nH]n5)c6n7
CC(=O)Cc5cccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)c5
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCC2=O)cc3F)c5cnn(c4cc[nH]n4)c5n6
CCC(=O)Nc5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)cc5
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCS2(=O)=O)cc3F)c5cnn(c4cc[nH]n4)c5n6
CCC(CC)C(=O)Nc5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)cc5
C[C@@H]1COCCN1c6cc(c3c(F)cc(N2CCCCC2=O)cc3F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c5cc(c2ccc(NC(=O)CCO)cc2)c4cnn(c3cc[nH]n3)c4n5
CC6CCCN(c5cc(F)c(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)c(F)c5)C6=O
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCCC2=O)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCC2=O)cc3C(F)(F)F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CCOC2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(N2CC=CCC2=O)cc3F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CCOCC2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)N2CCCCC2)c(F)c3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CNC2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)N2CCCC2)cc3F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CCNC2)cc3)c5cnn(c4cc[nH]n4)c5n6
CC1CCCN1C(=O)Nc6ccc(c3cc(N2CCOC[C@H]2C)nc4c3cnn4c5cc[nH]n5)cc6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CC(N)C2)cc3)c5cnn(c4cc[nH]n4)c5n6
COc5cc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)ncc5NC(=O)N6CCCC6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CCCNC2)cc3)c5cnn(c4cc[nH]n4)c5n6
COc2cc(NC(=O)N1CCCC1)ncc2c4cc(N3CCOC[C@H]3C)nc5c4cnn5c6cc[nH]n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)C2CC(O)C2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)N2CCCC2)cn3)c5cnn(c4cc[nH]n4)c5n6
CC(=O)N6CCC(C(=O)Nc5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)cc5)C6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)N2CCCC2)nc3)c5cnn(c4cc[nH]n4)c5n6
CC(=O)N6CCCC(C(=O)Nc5ccc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)cc5)C6
Cc2cc(NC(=O)N1CCCC1)cc(C)c2c4cc(N3CCOC[C@H]3C)nc5c4cnn5c6cc[nH]n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)c2ccccc2)cc3)c5cnn(c4cc[nH]n4)c5n6
CC1CCCN1C(=O)Nc6ccc(c3cc(N2CCOC[C@H]2C)nc4c3cnn4c5cc[nH]n5)c(F)c6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)c2cocn2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3cc(NC(=O)C2CC2)[nH]n3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)c2ccncn2)cc3)c5cnn(c4cc[nH]n4)c5n6
Cc3cc(N2CC1CCC(O1)C2=O)ccc3c5cc(N4CCOC[C@H]4C)nc6c5cnn6c7cc[nH]n7
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCC2=O)nc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c7cc(c4ccc(N3CC2CCC(O2)C3=O)nc4)c6cnn(c5cc[nH]n5)c6n7
Cc2cc(N1CCCCC1=O)ccc2c4cc(N3CCOC[C@H]3C)nc5c4cnn5c6cc[nH]n6
Cc5cc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4cc[nH]n4)ccc5N7CC6CCC(O6)C7=O
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCC2=O)c(C#N)c3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c7cc(c4cnc(N3CC2CCC(O2)C3=O)cc4F)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCC2=O)c(F)c3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(c2ccnn2C)cc3F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)c2cccs2)cc3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3cc(C#N)c(N2CCCCC2=O)cc3F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c7cc(c2ccc3c(c2)CCN3C(=O)c4ccncc4)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c6cc(c3cc(NC(=O)C2CC2)on3)c5cnn(c4cc[nH]n4)c5n6
Cc5cc(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4ccn[nH]4)cc(C)c5N(C)C(=O)c6ccncc6
C[C@@H]1COCCN1c7cc(c4c(F)cc(N3CC2CCC(O2)C3=O)cc4F)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c8cc(c5ccc(NC(=O)NC34CC2CC(CC(C2)C3)C4)cc5)c7cnn(c6cc[nH]n6)c7n8
C[C@@H]1COCCN1c7cc(c4ccc(N2C(=O)C3C=CC2C3)cc4F)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCC2=O)c(F)c3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c7cc(c4ccc(N2C(=O)C3CCC2C3)cc4F)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c6cc(c3ccc(N(C)C(=O)N2CCCC2)cc3F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c7cc(c4ccc(N2C(=O)C3CCC2CC3)cc4F)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c6cc(c3ccc(NC(=O)c2cccnc2)cc3F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(N3CC(NC(=O)C2CCC2)C3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(c3ccc(N2CCCCCC2=O)cc3F)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c6cc(N3CC(c2ccnn2C)C3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c7cc(c4ccc(N3CC2CCC(O2)C3=O)cc4F)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c6cc(N3CC(c2ccn(C)n2)C3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c7cc(c4ccc(N3CC2CCC(O2)C3=O)c(F)c4)c6cnn(c5cc[nH]n5)c6n7
C[C@@H]1COCCN1c6cc(C3CN(C(=O)NC2CC2)C3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c1cc(C2(O)CCC(C#N)CC2)c2cnn(C3=CCN=N3)c2n1
C[C@@H]1COCCN1c6cc(C3CN(c2ccnn2C)C3)c5cnn(c4cc[nH]n4)c5n6
C[C@@H]1COCCN1c1cc([C@]2(O)C[C@H]3CC[C@@H](C2)O3)c2cnn(-c3cc[nH]n3)c2n1
C#CC5CCC(O)(c2cc(N1CCOC[C@H]1C)nc3c2cnn3c4ccn[nH]4)C5
C[C@@H]1COCCN1c5cc(C#CC2(C#N)CCCNC2)c4cnn(c3cc[nH]n3)c4n5
Cc1nn(-c2cccnc2)c(C)c1-c1cc(N2CC3CCC(C2)O3)nc2c(-c3ccn[nH]3)cnn12
Cc1cncc(-n2nc(C)c(-c3cc(N4CC5CCC(C4)O5)nc4c(-c5ccn[nH]5)cnn34)c2C)c1
Cc1nn(-c2ccc(N)nc2)c(C)c1-c1cc(N2CC3CCC(C2)O3)nc2c(-c3ccn[nH]3)cnn12
Cc1nn(-c2cccnc2)c(C)c1-c1cc(N2CC3CCC(C2)O3)nc2c(-c3ccn[nH]3)cnn12
Cc1nn(-c2cccnc2)c(C)c1-c1cc(N2C3CCC2COC3)nc2c(-c3ccn[nH]3)cnn12
Cc1nn(-c2cccnc2)c(C)c1-c1cc([C@]23CCOC[C@H]2C3)nc2c(-c3ccn[nH]3)cnn12
Cc1nn(-c2cccnc2)c(C)c1-c1cc(C23CCOC[C@@H]2C3)nc2c(-c3ccn[nH]3)cnn12
Cc1nn(-c2cncc(F)c2)c(C)c1-c1cc([C@]23CCOC[C@H]2C3)nc2c(-c3ccn[nH]3)cnn12
Cc1nn(-c2cncc(F)c2)c(C)c1-c1cc([C@@]23CCOC[C@@H]2C3)nc2c(-c3ccn[nH]3)cnn12
Cc1cc(-c2cnn3c(-c4c(C)nn(-c5cccnc5)c4C)cc(C4CC5CCC(C4)O5)nc23)[nH]n1
Cc1n[nH]c(C)c1-c1cc(C2CC3CCC(C2)O3)nc2c(-c3ccn[nH]3)cnn12
Cc1nn(C2CCNCC2)c(C)c1-c1cc(N2CC3CCC(C2)O3)nc2c(-c3ccn[nH]3)cnn12
C[C@@H]1COCCN1c1cc(C2([S@](C)(=N)=O)CC2)nc(-c2cncc3[nH]ccc23)n1
C[C@@H]1COCCN1c1cc(C2(S(C)(=O)=O)CC2)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C(C)(C)O)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(S(C)(=O)=O)CC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C(C)(C)C(N)=O)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCCCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(-c2ccccc2S(C)(=O)=O)c2ccn(-c3cc[nH]n3)c2n1
Cc1cn(-c2cc[nH]n2)c2nc(N3CCOC[C@H]3C)cc(C(C)(C)C#N)c12
C[C@@H]1COCCN1c1cc(-c2ccccc2S(C)(=O)=O)c2cnn(-c3cc[nH]n3)c2n1
Cc1ccncc1-c1cc(N2CCOC[C@H]2C)nc2c1ccn2-c1cc[nH]n1
C[C@@H]1COCCN1c1cc(C(C)(C)O)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C(C)(C)C#N)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C(C)(C)C(N)=O)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(-c2ccncn2)c2ccn(-c3cc[nH]n3)c2n1
Cc1ccc(-c2cc(N3CCOC[C@H]3C)nc3c2ccn3-c2cc[nH]n2)nn1
C[C@@H]1COCCN1c1cc(-c2ccncc2)c2ccn(-c3cc[nH]n3)c2n1
COc1ccc(-c2cc(N3CCOC[C@H]3C)nc3c2ccn3-c2cc[nH]n2)cn1
C[C@@H]1COCCN1c1cc(Nc2cccnc2)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C(=O)N2CCOCC2)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C(=O)N(C)Cc2ccccc2)c2ccn(-c3cc[nH]n3)c2n1
CC(=O)c1ccccc1-c1cc(N2CCOC[C@H]2C)nc2c1ccn2-c1cc[nH]n1
COc1ccc(-c2cc(N3CCOC[C@H]3C)nc3c2c(C)cn3-c2cc[nH]n2)cn1
C[C@@H]1COCCN1c1cc(N(C)c2cccnc2)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C(N)=O)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C(C)(C)C#N)c2cnn(-c3cc[nH]n3)c2n1
CC1CCN(c2cc(N3CCOC[C@H]3C)nc3c2ccn3-c2cc[nH]n2)C1=O
C[C@@H]1COCCN1c1cc(N2CCOC2=O)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CC2)c2ccn(-c3cc[nH]n3)c2n1
COC(C)(C)c1cc(N2CCOC[C@H]2C)nc2c1ccn2-c1cc[nH]n1
CC(C)c1cc(N2CCOC[C@H]2C)nc2c1ccn2-c1cc[nH]n1
C[C@@H]1COCCN1c1cc(CC#N)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(-c2nncs2)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(S(C)(=O)=O)CC2)c2ccn(-c3cc[nH]n3)c2n1
Cc1c[nH]nc1-n1ccc2c(C3(S(C)(=O)=O)CC3)cc(N3CCOC[C@H]3C)nc21
C[C@@H]1COCCN1c5cc(C2(S(C)(=O)=O)CC2)c4ccn(c3cn[nH]c3C(F)(F)F)c4n5
C[C@@H]1COCCN1c1cc(C2(S(C)(=O)=O)CC2)c2ccn(-c3cn[nH]c3)c2n1
COc1cc(-c2cc(N3CCOC[C@H]3C)nc3c2ccn3-c2cc[nH]n2)ccn1
COc1cc(-c2cc(N3CCOC[C@H]3C)nc3c2ccn3-c2cc[nH]n2)ccn1
C[C@@H]1COCCN1c1cc(-c2cccs2)c2ccn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(I)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(-c2ccccc2S(C)(=O)=O)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(S(C)(=O)=O)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(S(=O)(=O)C2CC2)c2cnn(-c3cc[nH]n3)c2n1
CC(C#N)c1cc(N2CCOC[C@H]2C)nc2c1cnn2-c1cc[nH]n1
C[C@@H]1COCCN1c1cc(-c2ccccc2F)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(C(C)(C#N)C2COC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(S(=O)(=O)c2ccccc2)c2cnn(-c3cc[nH]n3)c2n1
COc1cc(N2CCOC[C@H]2C)nc2c1cnn2-c1cc[nH]n1
C[C@@H]1COCCN1c1cc(N(C)S(C)(=O)=O)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(N2CCCCS2(=O)=O)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(N2CCCS2(=O)=O)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(OCC(F)(F)F)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(O)CCCCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(O)CCOCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(O)CCC3(CCC3)CC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(O)CCC(C)(C#N)CC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(O)CCN(C)CC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(O)CCC3(CC2)CSC3)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(O)CCOC(C)(C)C2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C(C)(C)O)c2cnn(-c3ccccn3)c2n1
Cc1ccnc(-n2ncc3c(C(C)(C)O)cc(N4CCOC[C@H]4C)nc32)c1
C[C@@H]1COCCN1c1cc(C(C)(C)O)c2cnn(-c3cccc(N)n3)c2n1
C#CC(C)(C)c1cc(N2CCOC[C@H]2C)nc2c1cnn2Cc1ccn[nH]1
C[C@@H]1COCCN1c1cc(C(C)(C)O)c2cnn(-c3cccnn3)c2n1
C[C@@H]1COCCN1c1cc(C(C)(C)C#N)c2cnn(-c3n[nH]cc3F)c2n1
C[C@@H]1COCCN1c1nc2c(cnn2-c2cc[nH]n2)c(C(C)(C)C#N)c1Cl
C[C@@H]1COCCN1c1cc(C(C)(C)C#N)c2c(Br)nn(-c3cc[nH]n3)c2n1
C=Cc1nn(-c2cc[nH]n2)c2nc(N3CCOC[C@H]3C)cc(C(C)(C)C#N)c12
C[C@@H]1COCCN1c1cc(-c2nncs2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCOCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCSCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCS(=O)CC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCS(=O)(=O)CC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C(N)=O)CCCCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(CN)CCCCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CN(C(=O)OC(C)(C)C)C2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCN(C(=O)OC(C)(C)C)C2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCN(C(=O)OC(C)(C)C)CC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CNC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCNCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(C2(C#N)CCNC2)c2cnn(-c3cc[nH]n3)c2n1
Cc1cc(-n2ncc3c(C(C)(C)C#N)cc(N4CCOC[C@H]4C)nc32)[nH]n1
C[C@@H]1COCCN1c1cc(N2CCNC(=O)C2)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(-c2ccccc2C(N)=O)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(-c2ccc(S(C)(=O)=O)cc2)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(C(C)(C)C#N)c2cnn(-c3ncc[nH]3)c2n1
C[C@@H]1COCCN1c1cc(-c2ccccc2F)c2cnn(-c3ccn[nH]3)c2n1
C[C@@H]1COCCN1c1cc(-c2cccc(S(C)(=O)=O)c2)c2cnn(-c3ccn[nH]3)c2n1
CC(C)(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CCC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CCCS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(cc1)S(=O)(=O)[C@@H]1CCOC1 |r|
CC(CCO)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CC(CN(C)C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CCS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CS(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CN(C)C(=O)c1ccc(cc1Cl)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Cc1cc2c(cccc2[nH]1)-c1nc(cc(n1)C1(CC1)S(C)(=O)=O)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]cnc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2NC(=O)Cc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc(N)c1)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1ccccc1)N1CCOCC1
O=S(=O)(c1ccccn1)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cc(Cl)cc2[nH]ccc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cc(F)cc2[nH]ccc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cc(cc2[nH]ccc12)C(N)=O)N1CCOCC1
Cc1c[nH]c2cccc(-c3nc(cc(n3)C3(CC3)S(C)(=O)=O)N3CCOCC3)c12
Cc1cc(-c2nc(cc(n2)C2(CC2)S(C)(=O)=O)N2CCOCC2)c2cc[nH]c2c1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]c(cc12)C(N)=O)N1CCOCC1
Cc1ccc(-c2nc(cc(n2)C2(CC2)S(C)(=O)=O)N2CCOCC2)c2cc[nH]c12
O=S(=O)(c1ccccc1)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
O=S(=O)(C1CCNCC1)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
O=S(=O)(C1CCOCC1)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CC(C)S(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CN1CCC(CC1)(c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1)S(C)(=O)=O
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc2[nH]ccc2c1)N1CCOCC1
CS(=O)(=O)C1(CCNCC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CS(=O)(=O)C1(CCOCC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CC(C)(c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1)S(C)(=O)=O
Cn1ccc2c(cccc12)-c1nc(CS(C)(=O)=O)cc(n1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1cccc2cc[nH]c12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cc(cc2[nH]ccc12)C#N)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]c(cc12)C#N)N1CCOCC1
CNC(=O)c1cc(-c2nc(cc(n2)C2(CC2)S(C)(=O)=O)N2CCOCC2)c2cc[nH]c2c1
CN(C)C(=O)c1cc(-c2nc(cc(n2)C2(CC2)S(C)(=O)=O)N2CCOCC2)c2cc[nH]c2c1
CS(=O)(=O)Cc1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
COc1cc(-c2nc(cc(n2)C2(CC2)S(C)(=O)=O)N2CCOCC2)c2cc[nH]c2c1
C[C@@H]1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)C1(CC1)S(C)(=O)=O |r|
C[C@H]1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)C1(CC1)S(C)(=O)=O |r|
CC[C@@H]1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)C1(CC1)S(C)(=O)=O |r|
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc2cc[nH]c2c1)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CC2CCC(C1)O2 |TLB:9:22:29:25.26|
COc1ccc(cc1OC)-c1ccc2ncc(-c3ccc(cc3)C(N)=O)n2n1
CN(C)S(=O)(=O)c1ccc(cc1)-c1cnc2ccc(nn12)-c1ccnc2[nH]ccc12
CN(C)S(=O)(=O)c1ccc(cc1)-c1cnn2CCN(Cc12)c1ccnc2[nH]ccc12
C[C@@H]1Cn2ncc(c2CN1c1ccnc2[nH]ccc12)-c1ccc(cc1)S(=O)(=O)N(C)C |r|
C[C@@H]1Cn2ncc(c2CN1c1ccnc2[nH]ccc12)-c1ccc(cc1)S(C)(=O)=O |r|
C[C@@H]1Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|
C[C@@H]1Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|
C[C@@H]1Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ncc12 |r|
C[C@@H]1Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1ccnc2[nH]cnc12 |r|
C[C@@H]1Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1ccnc(N)c1 |r|
CC1(C)Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12
C[C@@H]1[C@@H](C)n2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|
C[C@@H]1Cc2ncn(C3CCN(CC3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|
C[C@@H]1Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2C(=O)N1c1ccnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(cc2n(C)cnc12)-c1nncc2[nH]ccc12 |r|
CS(=O)(=O)Cn1cnc2c(nc(cc12)-c1cnc(N)nc1)N1C2CCC1COC2
C[C@@H]1COCCN1c1nc(cc2n(CS(C)(=O)=O)cnc12)-c1cnc(N)nc1 |r|
CS(=O)(=O)Cn1cnc2c(nc(cc12)-c1cncc2[nH]ccc12)N1C2CCC1COC2
C[C@@H]1COCCN1c1nc(cc2n(C)cnc12)-c1c(F)ncc2[nH]ccc12 |r|
C[C@H](n1cnc2c(nc(cc12)-c1cncc2[nH]ccc12)N1CCOC[C@H]1C)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1nc(cc2n(CS(C)(=O)=O)cnc12)-c1cccc2[nH]ccc12 |r|
CS(=O)(=O)Cn1cnc2c(nc(cc12)-c1cccc2[nH]ccc12)N1CCOCC1
C(C1CC1)n1cnc2c(nc(cc12)-c1cccc2[nH]ccc12)N1CCOCC1
O=C(NC1CC1)c1cn2c(nc(cc2n1)-c1cccc2[nH]ccc12)N1CCOCC1
C[C@@H]1COCCN1c1nc(cc2nccn12)-c1cccc2[nH]ccc12 |r|
C1CN(CCO1)c1nc(cc2nccn12)-c1cccc2[nH]ccc12
CC(C)(C#N)c1ccc(cc1)N1C(=O)OCc2cnc3ccc(cc3c12)-c1cnc2ccccc2c1
O=c1cc(oc2c(cccc12)-c1cccc2c3ccccc3sc12)N1CCOCC1
O=c1cc(oc2c3ccccc3ccc12)N1CCOCC1
O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCOCC1
O=c1cc(nc2c3ccccc3ccn12)N1CCOCC1
CC1CN(CCO1)c1cc(=O)c2ccc3ccccc3c2o1
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1CCOCC1 |r|
CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC(C)(C)C)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOCC1
CC(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOCC1
CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOCC1
CC(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CCOCC1
CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CCOCC1
[O-][N+](=O)c1cc(NC(=S)NC(NC(=O)C(c2ccccc2)c2ccccc2)C(Cl)(Cl)Cl)ccc1F
c1ccc2c(c1)Sc3cccc(c3S2)C4=CC(=O)C=C(O4)N5CCOCC5
Cn1cnc2c1C(=O)N(C(=O)N2C)C
COc1cc2CC(C)C(C)Cc3cc4OCOc4c(OC)c3-c2c(OC)c1OC
Nc1nccnc1C(=O)Nc1ccccc1
Nc1ncc(Br)nc1C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)C1CCCCC1
Nc1ncc(nc1C(=O)Nc1ccccc1)C1=CCCCC1 |t:18|
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccccc1C#N
CS(=O)c1ccccc1-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CS(=O)(=O)c1ccccc1-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccccc1O
COc1ccccc1-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccccc1Cl
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(O)c1
COc1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1cccc(Cl)c1
Cc1cccc(c1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(O)cc1
Nc1ncc(nc1C(=O)Nc1ccccc1)-c1ccc(Cl)cc1
Cc1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
NC(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CNC(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1ccccc1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)C(=O)NC1CCCCC1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc2ccccc2o1
CS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cc2ccccc2[nH]1
C(=S)(N)N
C1CCC(CC1)COc2c(c(nc(n2)N)N)N=O
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
Cc1ccc2[nH]ccc2c1-c1nc(cc(n1)C1(CC1)S(C)(=O)=O)N1CCOCC1
Cc1c(sc(n1)NC(=O)N2CCC[C@H]2C(=O)N)c3ccnc(c3)C(C)(C)C(F)(F)F
CCN1CCN(CC(=O)Nc2ccc(-c3cccc4c3oc(cc4=O)N3CCOCC3)c3sc4ccccc4c23)CC1
C[C@H](Nc1c(nnc2ccc(cc12)-c1ccc(OCCCN2CCCC2)nc1)C(N)=O)c1ccn(C)n1 |r|
COCc1ccc(cn1)-c1ccc2ncc(C(N)=O)c(N[C@@H](C)C3CCOCC3)c2c1 |r|
C[C@H](Nc1c(nnc2ccc(cc12)-c1ccc(OCCCN(C)C)nc1)C(N)=O)c1ccn(C)n1 |r|
C[C@H](Nc1c(nnc2ccc(cc12)-c1ccc(NCCN(C)C)nc1)C(N)=O)C1CCOCC1 |r|
CNC(=O)c1nnc2ccc(cc2c1N[C@@H](C)c1nn(C)cc1C)-c1ccc(OCCCN(C)C)nc1 |r|
COCc1ccc(cn1)-c1cc2c(N[C@@H](C)c3nn(C)cc3C)c(cnc2cc1F)C(N)=O |r|
COCc1ccc(cn1)-c1ccc2nnc(C(N)=O)c(N[C@@H](C)C3CCOCC3)c2c1 |r|
COCc1ccc(cn1)-c1ccc2nnc(C(N)=O)c(N[C@@H](C)c3ccn(C)n3)c2c1 |r|
CNC(=O)c1nnc2ccc(cc2c1N[C@@H](C)C1CCOCC1)-c1ccc(COC)nc1 |r|
C[C@H](Nc1c(nnc2ccc(cc12)-c1ccc(OCCCN(C)C)nc1)C(N)=O)c1nn(C)cc1C |r|
C[C@H](Nc1c(nnc2ccc(cc12)-c1ccc(OCCCN2CCCC2)nc1)C(N)=O)c1nn(C)cc1C |r|
C[C@H](Nc1c(nnc2ccc(cc12)-c1ccc(OCCN(C)C)nc1)C(N)=O)c1ccn(C)n1 |r|
CNC(=O)c1nnc2ccc(cc2c1N[C@@H](C)C1CCOCC1)-c1ccc(OCCN(C)C)nc1 |r|
C[C@H](Nc1c(nnc2ccc(cc12)-c1ccc(OCCCN(C)C)nc1)C(N)=O)C1CCOCC1 |r|
COCc1ccc(cn1)-c1cc2c(N[C@@H](C)c3ccn(C)n3)c(cnc2cc1F)C(N)=O |r|
COCc1ccc(cn1)-c1ccc2nnc(C(N)=O)c(N[C@@H](C)c3nn(C)cc3C)c2c1 |r|
C[C@H](Nc1c(nnc2ccc(cc12)-c1ccc(OCCCN2CCCC2)nc1)C(N)=O)C1CCOCC1 |r|
CNC(=O)c1nnc2ccc(cc2c1N[C@@H](C)C1CCOCC1)-c1ccc(OCCCN(C)C)nc1 |r|
COCc1ccc(cn1)-c1cc2c3n([C@@H](C)C4CCOCC4)c(=O)n(C)c3cnc2cc1F |r|
COCc1ccc(cn1)-c1cc2c3n([C@H]4C[C@@H](C4)OC)c(=O)n(C)c3cnc2cc1F |r,wU:14.14,wD:16.19,(5.2,-7.83,;6.54,-8.6,;7.87,-7.83,;9.21,-8.59,;10.55,-7.82,;11.88,-8.59,;11.88,-10.14,;10.55,-10.91,;9.22,-10.14,;13.21,-10.91,;14.54,-10.14,;15.88,-10.9,;17.2,-10.13,;17.51,-8.62,;16.47,-7.49,;14.93,-7.43,;15,-5.9,;16.53,-5.96,;13.95,-4.76,;14.41,-3.29,;19.03,-8.45,;19.79,-7.11,;19.67,-9.85,;21.18,-10.15,;18.54,-10.88,;18.55,-12.44,;17.21,-13.21,;15.88,-12.45,;14.54,-13.22,;13.21,-12.45,;11.87,-13.22,)|
COCc1ccc(cn1)-c1cc2c3n([C@@H]4C[C@@H](C4)OC)c(=O)n(C)c3cnc2cc1F |r,wU:14.14,16.19,(46.47,-34.32,;47.8,-35.09,;49.14,-34.31,;50.47,-35.08,;51.81,-34.31,;53.14,-35.08,;53.14,-36.62,;51.81,-37.39,;50.48,-36.63,;54.47,-37.39,;55.8,-36.62,;57.14,-37.39,;58.47,-36.61,;58.77,-35.11,;57.73,-33.98,;57.8,-32.45,;56.26,-32.38,;56.2,-33.92,;55.21,-31.25,;55.67,-29.78,;60.3,-34.94,;61.06,-33.59,;60.93,-36.33,;62.44,-36.64,;59.8,-37.37,;59.81,-38.92,;58.48,-39.7,;57.14,-38.93,;55.81,-39.71,;54.47,-38.94,;53.13,-39.71,)|
CCC(CC)CNc1c(cnc2cc(F)c(cc12)-c1cnc(NCCN2CCCC2)nc1)C(N)=O
CC(C)n1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1cccnc1
COCc1ccc(cn1)-c1cc2c3n([C@@H]4C[C@H](O)C4)c(=O)n(C)c3cnc2cc1F |r,wU:14.14,16.17,(5.35,-21.87,;6.69,-22.64,;8.02,-21.86,;9.36,-22.63,;10.7,-21.86,;12.03,-22.63,;12.03,-24.18,;10.7,-24.95,;9.36,-24.18,;13.36,-24.95,;14.69,-24.18,;16.03,-24.94,;17.35,-24.17,;17.66,-22.66,;16.62,-21.53,;16.68,-20,;15.14,-19.93,;14.1,-18.8,;15.08,-21.47,;19.18,-22.49,;19.94,-21.15,;19.82,-23.88,;21.33,-24.19,;18.69,-24.92,;18.7,-26.48,;17.36,-27.25,;16.03,-26.48,;14.69,-27.26,;13.36,-26.49,;12.02,-27.26,)|
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCC[N+](C)(C)[O-])nc1
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
CN(C)CCCOc1ccc(cn1)-c1ccc2nnc3n(C)c(=O)n(C4CCOCC4)c3c2c1
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCC(O)CC3)nc2)n(C)c1=O |r,wU:4.6,2.1,(20.74,-17.62,;20.29,-19.09,;21.33,-20.22,;22.86,-20.28,;22.8,-21.81,;21.27,-21.75,;23.84,-22.94,;23.53,-24.44,;24.87,-25.2,;24.88,-26.75,;23.55,-27.53,;22.21,-26.76,;20.88,-27.54,;19.54,-26.77,;19.54,-25.23,;20.87,-24.45,;22.21,-25.22,;18.21,-24.46,;18.22,-22.91,;16.88,-22.14,;15.55,-22.91,;14.21,-22.15,;12.88,-22.92,;11.55,-22.15,;10.21,-22.92,;8.88,-22.15,;8.88,-20.62,;7.56,-19.85,;6.22,-20.61,;4.89,-19.84,;6.22,-22.15,;7.55,-22.93,;15.55,-24.46,;16.89,-25.22,;26,-24.16,;27.51,-24.47,;25.36,-22.77,;26.12,-21.43,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(CS(C)(=O)=O)nc2)n(C)c1=O |r,wU:4.6,2.1,(34.14,-2.59,;33.68,-4.06,;34.73,-5.2,;36.26,-5.26,;36.2,-6.79,;34.66,-6.73,;37.24,-7.92,;36.93,-9.43,;38.27,-10.18,;38.28,-11.74,;36.95,-12.51,;35.61,-11.75,;34.27,-12.53,;32.94,-11.75,;31.6,-12.52,;32.94,-10.21,;34.27,-9.44,;35.61,-10.2,;31.61,-9.44,;31.61,-7.89,;30.28,-7.12,;28.94,-7.89,;27.6,-7.13,;26.27,-7.9,;24.93,-7.13,;27.03,-9.23,;25.5,-9.22,;28.95,-9.44,;30.28,-10.21,;39.4,-9.15,;40.91,-9.45,;38.77,-7.75,;39.52,-6.41,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(CO)nc2)n(C)c1=O |r,wU:4.6,2.1,(14.71,-32.7,;14.25,-34.17,;15.29,-35.31,;16.83,-35.37,;16.77,-36.9,;15.23,-36.84,;17.81,-38.04,;17.5,-39.54,;18.84,-40.29,;18.85,-41.85,;17.51,-42.63,;16.18,-41.86,;14.84,-42.64,;13.51,-41.87,;12.17,-42.64,;13.51,-40.32,;14.84,-39.55,;16.17,-40.31,;12.18,-39.55,;12.18,-38.01,;10.84,-37.24,;9.51,-38.01,;8.17,-37.24,;6.84,-38.01,;9.51,-39.56,;10.85,-40.32,;19.97,-39.26,;21.48,-39.56,;19.33,-37.86,;20.09,-36.52,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(NC(=O)CCCN(C)C)nc2)n(C)c1=O |r,wU:4.6,2.1,(57.12,-16.93,;56.67,-18.4,;57.71,-19.53,;59.24,-19.6,;59.18,-21.13,;57.65,-21.07,;60.22,-22.26,;59.91,-23.76,;61.25,-24.52,;61.26,-26.07,;59.92,-26.84,;58.59,-26.08,;57.26,-26.86,;55.92,-26.09,;54.59,-26.85,;55.92,-24.54,;57.25,-23.77,;58.59,-24.53,;54.59,-23.77,;54.6,-22.23,;53.26,-21.46,;51.93,-22.23,;50.59,-21.46,;49.26,-22.23,;49.26,-23.77,;47.93,-21.47,;46.59,-22.24,;45.26,-21.47,;43.93,-22.24,;42.59,-21.47,;43.93,-23.78,;51.93,-23.78,;53.27,-24.54,;62.38,-23.48,;63.89,-23.79,;61.74,-22.08,;62.5,-20.74,)|
COCc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2c1
COCc1ccc(cn1)-c1cc2c3n(C4CCOCC4)c(=O)n(C)c3cnc2cc1F
NC(=O)c1cnc2ccc(cc2c1NC1CCOCC1)-c1cccnc1
O=c1[nH]c2cnc3ccc(cc3c2n1C1CCOCC1)-c1cccnc1
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1cccnc1
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCOCC3)nc2)n(C)c1=O |r,wU:4.6,2.1,(21.66,-3.72,;21.2,-5.19,;22.24,-6.32,;23.78,-6.39,;23.71,-7.92,;22.18,-7.86,;24.76,-9.05,;24.45,-10.55,;25.78,-11.31,;25.8,-12.87,;24.46,-13.64,;23.12,-12.87,;21.79,-13.65,;20.45,-12.88,;20.46,-11.33,;21.79,-10.56,;23.12,-11.33,;19.12,-10.56,;19.13,-9.02,;17.79,-8.25,;16.46,-9.02,;15.12,-8.25,;13.79,-9.03,;12.45,-8.26,;11.12,-9.03,;9.78,-8.26,;9.79,-6.72,;8.46,-5.95,;7.12,-6.72,;7.12,-8.26,;8.46,-9.04,;16.46,-10.57,;17.8,-11.33,;26.92,-10.27,;28.43,-10.58,;26.28,-8.88,;27.04,-7.53,)|
COCc1ccc(cn1)-c1cc2c3n([C@H]4CC[C@@H](CC4)OC)c(=O)n(C)c3cnc2cc1F |r,wU:14.14,wD:17.21,(46.71,-18.13,;48.04,-18.9,;49.37,-18.13,;50.71,-18.9,;52.04,-18.13,;53.37,-18.9,;53.37,-20.44,;52.05,-21.21,;50.71,-20.45,;54.7,-21.21,;56.03,-20.44,;57.37,-21.2,;58.69,-20.43,;59,-18.93,;57.96,-17.8,;56.46,-18.13,;55.42,-16.99,;55.89,-15.52,;57.39,-15.2,;58.42,-16.33,;54.85,-14.38,;53.34,-14.71,;60.52,-18.75,;61.28,-17.41,;61.16,-20.15,;62.67,-20.45,;60.03,-21.18,;60.04,-22.74,;58.7,-23.51,;57.37,-22.75,;56.03,-23.52,;54.7,-22.75,;53.37,-23.52,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(nc2)C(=O)NCCN(C)C)n(C)c1=O |r,wU:4.6,2.1,(55.4,-1.13,;54.94,-2.6,;55.98,-3.73,;57.52,-3.79,;57.45,-5.33,;55.92,-5.27,;58.5,-6.46,;58.19,-7.96,;59.53,-8.71,;59.54,-10.27,;58.2,-11.04,;56.87,-10.28,;55.53,-11.06,;54.2,-10.28,;52.86,-11.05,;54.2,-8.74,;55.53,-7.97,;56.86,-8.73,;52.87,-7.97,;52.87,-6.43,;51.54,-5.66,;50.2,-6.43,;50.21,-7.98,;51.54,-8.74,;48.86,-5.66,;48.86,-4.12,;47.53,-6.43,;46.2,-5.66,;44.86,-6.44,;43.53,-5.67,;42.19,-6.44,;43.52,-4.13,;60.66,-7.68,;62.17,-7.98,;60.02,-6.28,;60.78,-4.94,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(nc2)N(C)CCN(C)C)n(C)c1=O |r,wU:4.6,2.1,(33.93,-31.06,;33.47,-32.53,;34.52,-33.66,;36.05,-33.73,;35.99,-35.26,;34.45,-35.2,;37.03,-36.39,;36.73,-37.89,;38.06,-38.65,;38.07,-40.2,;36.74,-40.98,;35.4,-40.21,;34.06,-40.99,;32.73,-40.22,;31.39,-40.99,;32.73,-38.67,;34.06,-37.9,;35.4,-38.67,;31.4,-37.9,;31.4,-36.36,;30.07,-35.59,;28.73,-36.36,;28.74,-37.91,;30.07,-38.67,;27.4,-35.59,;27.39,-34.05,;26.06,-36.37,;24.73,-35.6,;23.39,-36.37,;22.06,-35.6,;23.4,-37.91,;39.19,-37.61,;40.7,-37.92,;38.56,-36.22,;39.31,-34.87,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(NCCN(C)C)nc2)n(C)c1=O |r,wU:4.6,2.1,(34.23,-16.26,;33.77,-17.73,;34.82,-18.87,;36.35,-18.93,;36.29,-20.46,;34.75,-20.4,;37.33,-21.59,;37.02,-23.1,;38.36,-23.85,;38.37,-25.41,;37.03,-26.18,;35.7,-25.41,;34.36,-26.19,;33.03,-25.42,;31.69,-26.19,;33.03,-23.88,;34.36,-23.11,;35.7,-23.87,;31.7,-23.11,;31.7,-21.56,;30.37,-20.79,;29.03,-21.56,;27.69,-20.8,;26.36,-21.57,;25.02,-20.8,;23.69,-21.57,;22.35,-20.8,;23.69,-23.11,;29.04,-23.11,;30.37,-23.88,;39.49,-22.81,;41,-23.12,;38.85,-21.42,;39.61,-20.08,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCN(C)C)nc2)n(C)c1=O |r,wU:4.6,2.1,(15.94,-4.52,;15.48,-5.99,;16.52,-7.13,;18.06,-7.19,;17.99,-8.72,;16.46,-8.66,;19.03,-9.85,;18.73,-11.36,;20.06,-12.11,;20.07,-13.67,;18.74,-14.44,;17.4,-13.67,;16.07,-14.45,;14.73,-13.68,;13.4,-14.45,;14.73,-12.14,;16.06,-11.37,;17.4,-12.13,;13.4,-11.37,;13.4,-9.82,;12.07,-9.05,;10.73,-9.82,;9.4,-9.05,;8.07,-9.83,;6.73,-9.06,;5.4,-9.83,;4.06,-9.06,;5.4,-11.37,;10.74,-11.37,;12.07,-12.14,;21.19,-11.07,;22.7,-11.38,;20.56,-9.68,;21.32,-8.34,)|
Nc1ncnc2n(nc(-c3cnc4cc[nH]c4c3)c12)C1CCc2ccccc2C1
Nc1nc2CCC(Cc2s1)n1nc(-c2cc(F)c3[nH]ccc3c2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cnc4[nH]ccc4c3)c12)C1CCc2ccccc2C1
Nc1ncnc2n(nc(-c3ccc(Br)c(O)c3)c12)C1Cc2ccccc2C1
CS(=O)(=O)c1ccc(cc1)-n1nc(-c2cnc3[nH]ccc3c2)c2c(N)ncnc12
Nc1nc2CCC(Cc2s1)n1nc(-c2cnc3[nH]ccc3c2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cnc4[nH]ccc4c3)c12)C1Cc2ccccc2C1
Nc1ncnc2n(nc(-c3ccc(nc3)N3CCCC3)c12)C1CCc2ccccc2C1
Cn1ccc2cc(cnc12)-c1nn(C2CCc3ccccc3C2)c2ncnc(N)c12
Nc1ncnc2n(nc(-c3cnc4[nH]ccc4c3)c12)C1CCCC1
Nc1ncnc2n(nc(-c3cccnc3)c12)C1CCc2ccccc2C1
Nc1ncnc2n(nc(-c3ccc4[nH]ccc4c3)c12)C1CCc2ccccc2C1
Nc1ccnc2n(nc(-c3cnc4[nH]ccc4c3)c12)C1CCc2ccccc2C1
Nc1ncnc2n(nc(-c3ccc(Br)c(O)c3)c12)C1CCc2ccccc12
CS(=O)(=O)N1CCC(CC1)n1nc(-c2cnc3[nH]ccc3c2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cnc4[nH]c(=O)ccc4c3)c12)C1CCc2ccccc2C1
Nc1ccc(cn1)-c1nn(C2CCc3ccccc3C2)c2ncnc(N)c12
C1Cc2ccccc2CC1n1nc(-c2cnc3[nH]ccc3c2)c2cncnc12
Nc1ncnc2n(nc(-c3c[nH]c4ncccc34)c12)C1CCc2ccccc2C1
O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1
CN1CCN(CCCOc2cccc(CC(=O)Nc3nc(cs3)-c3c[nH]c4ncccc34)c2)CC1
O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12
[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)S(C)(=O)=O)-c1c(NC)cnc2[nH]ccc12 |r|
[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)S(C)(=O)=O)-n1ccnc1NC |r|
[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)S(C)(=O)=O)N(C)c1ccn[nH]1 |r|
[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)O)-c1c(NC)cnc2[nH]ccc12 |r|
[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)S(C)(=O)=O)-n1c(NC)nc2ccccc12 |r|
[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)S(C)(=O)=O)-c1c(NCC)cnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2ccccc12)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2ccc(F)cc12)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2c(Cl)cccc12)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2c(F)cccc12)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2cc(F)ccc12)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2cccc(F)c12)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1(CC1)[S@@+](C)[O-] |r|
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOCC1
C[C@@H]1COCCN1c1cc(nc(n1)-c1cncc2[nH]ccc12)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(NC(C)=O)nc2ccccc12)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2cc(ccc12)C#N)C1(CC1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1(CC1)[S@+](C)[O-] |r|
COc1ccc2n(c(N)nc2c1)-c1nc(cc(n1)C1(CC1)S(C)(=O)=O)N1CCOC[C@H]1C |r|
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-n1c(N)nc2ccccc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)C1=CCOCC1 |t:26|
CNc1nc2ccccc2n1-c1nc(cc(n1)C1(CC1)S(C)(=O)=O)N1CCOC[C@H]1C |r|
COc1cccc2n(c(N)nc12)-c1nc(cc(n1)C1(CC1)S(C)(=O)=O)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2cc(Cl)ccc12)C1(CC1)S(C)(=O)=O |r|
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cncc2[nH]ccc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cncc2[nH]ccc12)N1CC2CCC(C1)O2
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cncc2[nH]ccc12)N1C2CCC1COC2
CNc1nc2ccccc2n1-c1nc(cc(n1)C1(CC1)[S@@](C)(=N)=O)N1CCOC[C@H]1C |r|
C[C@H]1COCCN1c1cc(nc(n1)-c1cncc2[nH]ccc12)C1(CC1)S(C)(=O)=O |r|
Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4cccc(c4)C(F)(F)F)c3c2c1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(cc1)[C@@H](C)N |r|
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1noc(n1)-c1ccccc1
CNCc1ccc(-c2cc(on2)-c2nc(cnc2N)-c2ccc(cc2)S(=O)(=O)C(C)C)c(Cl)c1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(CNC2CCOCC2)cc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nnc(s1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1ncc(o1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1nc(no1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cc(no1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cc(no1)-c1ccc(cc1)[C@H](C)N |r|
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cc(on1)-c1ccccc1
CC(C)S(=O)(=O)c1ccc(cc1)-c1cnc(N)c(n1)-c1cnc(o1)-c1ccccc1
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cc[nH]n1 |r|
Cc1cc2ncnn2cc1Nc3ncc4c(n3)N(C(=O)N4C)C5CCOCC5
CNC(=O)c1cnc2ccc(cc2c1N[C@H](C)c1ccc(Cl)cc1)-c1cccnc1 |r|
CCC(CC)CNc1c(cnc2ccc(cc12)-c1cccnn1)C(N)=O
CCC(CC)CNc1c(C(N)=O)c(C)nc2ccc(cc12)-c1cccnc1
COc1cc2ncnc(-n3nc(nc3N)-c3ccccn3)c2cc1OC
CCC(CC)CNc1c(cnc2ccc(cc12)-c1cccnc1)C(N)=O
CCC(CC)CNc1c(cnc2ccc(cc12)C#N)C(N)=O
C[C@@H](Nc1c(cnc2ccc(cc12)-c1cccnc1)C(N)=O)c1ccc(Cl)cc1 |r|
C[C@@H](Nc1c(cnc2ccc(cc12)-c1cccnc1)C(O)=O)c1ccc(Cl)cc1 |r|
CCC(CC)COc1c(cnc2ccc(cc12)-c1cccnc1)C(N)=O
NC(=O)c1cnc2ccc(cc2c1NC1CCCC1)-c1cccnc1
NC(=O)c1cnc2ccc(cc2c1NC1CCCCC1)-c1cccnc1
NC(=O)c1cnc2ccc(cc2c1NCC1CCCCC1)-c1cccnc1
CCC(CC)CNc1c(cnc2ccc(cc12)-c1ccncc1)C(N)=O
CCC(CC)CNc1c(cnc2ccc(cc12)-c1ccnnc1)C(N)=O
CCC(CC)CNc1c(cnc2ccc(cc12)-c1cncnc1)C(N)=O
CCC(CC)CNc1c(cnc2ccc(cc12)-c1ccc(COC)cc1)C(N)=O
CCC(CC)CNc1c(cnc2ccc(cc12)-c1ccc(CS(C)(=O)=O)cc1)C(N)=O
CCC(CC)CNc1c(cnc2ccc(cc12)-c1ccc(COC)nc1)C(N)=O
CCC(CC)CNc1c(cnc2ccc(cc12)-c1ccc(CS(C)(=O)=O)nc1)C(N)=O
NC(=O)c1cnc2ccc(c(F)c2c1NC1CCOCC1)-c1cccnc1
NC(=O)c1cnc2cc(Cl)c(cc2c1NC1CCOCC1)-c1cccnc1
NC(=O)c1cnc2c(F)cc(cc2c1NC1CCOCC1)-c1cccnc1
COCc1ccc(cn1)-c1cc2c(N[C@@H](C)C3CCOCC3)c(cnc2cc1F)C(N)=O |r|
COCc1ccc(c(F)n1)-c1ccc2ncc(C(N)=O)c(N[C@@H](C)c3ccn(C)n3)c2c1 |r|
CCC(CC)CNc1c(cnc2ccc(cc12)-c1cnn(C)c1)C(N)=O
C[C@@H](Nc1c(cnc2ccc(cc12)-c1cccnc1)C(N)=O)c1ccn(C)n1 |r|
CCC(CC)CNc1c(cnc2c(C)cc(cc12)-c1cccnc1)C(N)=O
COCc1ccc(cn1)-c1cc2c(N[C@@H](C)c3nn(C)cc3F)c(cnc2cc1F)C(N)=O |r|
C[C@@H](Nc1c(cnc2ccc(cc12)C#N)C(N)=O)c1ccc(Cl)cc1 |r|
NC(=O)c1cnc2ccc(cc2c1NCC1CCOCC1)-c1cccnc1
C[C@@H](Nc1c(cnc2ccc(cc12)-c1cccnc1)C(N)=O)C1CCOCC1 |r|
O=c1cc(oc(c1)-c1cccc2Cc3ccccc3Sc12)N1CCOCC1
C[C@@H](Nc1ccnc2ccc(cc12)-c1cccnc1)c1ccc(Cl)cc1 |r|
NC(=O)c1cnc2ccc(cc2c1SC1CCCC1)-c1cccnc1
C[C@H](Nc1c(cnc2ccc(cc12)-c1cccnc1)C(N)=O)C1CCOCC1 |r|
C[C@H](Nc1c(cnc2ccc(cc12)-c1cccnc1)C(N)=O)c1ccn(C)n1 |r|
CCC(CC)CNc1c(cnc2ccc(cc12)-c1ccc(C)nc1)C(N)=O
CCC(CC)CNc1c(cnc2ccc(cc12)-c1ccc(CO)nc1)C(N)=O
NC(=O)c1cnc2cc(F)c(cc2c1NC1CCOCC1)-c1cccnc1
NC(=O)c1cnc2c(Cl)cc(cc2c1NC1CCOCC1)-c1cccnc1
COCc1ccc(c(F)n1)-c1cc2c(N[C@@H](C)c3ccn(C)n3)c(cnc2cc1F)C(N)=O |r|
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1C2CCC1COC2
[H][C@]12CN(c3cc(OC(C)C)c4ccnc(-c5ccn[nH]5)c4n3)[C@]([H])(CO1)C2 |r|
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@@H]1C |r|
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCO[C@H](C)C1 |r|
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC2CC12
CCC1COCCN1c1cc(OC(C)C)c2ccnc(-c3ccn[nH]3)c2n1
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCO[C@@H](C)C1 |r|
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1C(F)(F)F
[H][C@@]12COC[C@]1([H])CN(C2)c1cc(OC(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CC(F)(F)OC(F)(F)C1
CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1(C)C
COC1(C)CN(C1)c1cc(OC(C)C)c2ccnc(-c3ccn[nH]3)c2n1
CC(C)Oc1cc(nc2c(nccc12)-c1ccc[nH]1)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)C(N)=O)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1cnc[nH]1)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1cn[nH]c1)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1[nH]ncc1C)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1ccnn1C)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1cc(C)[nH]n1)N1CCOCC1
COc1cccc(n1)-c1nccc2c(OC(C)C)cc(nc12)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1cccc(c1)C(N)=O)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1cccnc1)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1cc2ccccc2[nH]1)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1nnn[nH]1)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1ccc[nH]c1=O)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)-c1cccc(=O)[nH]1)N1CCOCC1
CC(C)Oc1cc(nc2c(nccc12)C1CCNC1)N1CCOCC1
CNC(=O)c1nccc2c(OC(C)C)cc(nc12)N1CCOCC1
CC(C)Oc1cc(nc2cnccc12)N1CCOCC1
C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccn[nH]3)c2n1)C(C)(O)C(C)(C)C |r|
C[C@@H]1COCCN1c1cc(N2CCN(CC2)S(C)(=O)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(N(C)c2ccc(F)cc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2ccc(nc2C)S(C)(=N)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-c2cnc3CCCn23)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccn[nH]3)c2n1)C1(CC1)S(C)(=O)=O |r|
CCS(=O)(CC)=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(C#Cc2cccnc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|
C[C@@H]1COCCN1c1cc(-n2ccnc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
CCP(=O)(CC)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|
CS(=O)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1
CC(C)Oc1cc(nc2c(cccc12)-c1ccn[nH]1)N1CCOCC1
C[C@H]1CN(CC(=O)Nc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)C[C@@H](C)O1
COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
C[C@H](CN1C[C@H](C)O[C@H](C)C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
FC(F)CN1CC[C@H](C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
COC[C@@H](C)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
O=c1cc(oc(c1)-c1cccc2Cc3cc(OC4COC4)ccc3Sc12)N1CCOCC1
O=c1cc(cc([nH]1)N1CCCCC[C@@H]1Cc1ccccc1)N1CCOCC1 |r|
[H][C@]12C[C@@]1([H])[C@H](Cc1ccccc1)N(C2)c1cc(cc(=O)[nH]1)N1CCOCC1 |r|
[H][C@@]12C[C@]1([H])[C@H](Cc1ccccc1)N(C2)c1cc(cc(=O)[nH]1)N1CCO[C@H](C)C1 |r|
C[C@@H]1CCN([C@H]1Cc1ccccc1)c1nc(cc(=O)[nH]1)N1CCOCC1 |r|
O=c1cc(cc([nH]1)N1CCCC[C@@H]1Cc1ccccc1)N1CCOCC1 |r|
FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4=CCCOCC4)n3c2c1 |t:20|
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1(CC1)S(C)(=N)=O |r|
CC(C)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O
CC(C)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O
Cc1cc2c(cccn2)cc1Nc3ncc4c(n3)N(C(=O)N4C)[C@@H]5CNC[C@H]5F
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccccc1)-c1cccc2[nH]ccc12 |r|
CC1COCCN1c1nc(nc2ccc(cc12)-c1ccncc1)-c1cccc2[nH]ccc12
CC1COCCN1c1nc(nc2ccc(cc12)-c1cccnc1)-c1cccc2[nH]ccc12
CC1COCCN1c1nc(nc2ccc(cc12)-c1ccc(nc1)C#N)-c1cccc2[nH]ccc12
CC1COCCN1c1nc(nc2ccc(cc12)-c1ccc(nc1)N1CCOCC1)-c1cccc2[nH]ccc12
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccc(=O)n(C)c1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccsc1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccoc1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1cccn1C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1cnn(C)c1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1cnc(C)s1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1cncn1C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1c(C)noc1C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cccc2[nH]ccc12 |r|
CCn1nccc1-c1ccc2nc(nc(N3CCOC[C@H]3C)c2c1)-c1cccc2[nH]ccc12 |r|
CC(C)n1nccc1-c1ccc2nc(nc(N3CCOC[C@H]3C)c2c1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C1CCCCO1)-c1cccc2[nH]ccc12 |r|
CCOC(c1ccc2nc(nc(N3CCOC[C@H]3C)c2c1)-c1cccc2[nH]ccc12)n1cccn1 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1ccnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1c(C)ccc2[nH]ncc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cc(cc2[nH]ccc12)C(F)(F)F |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cc(F)cc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1c[nH]c2ccccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1c[nH]c2ncccc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1c[nH]c2ncc(F)cc12 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cnc2[nH]ccc2c1 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cc[nH]n1 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cn[nH]c1 |r|
C[C@@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cnn(c1)C1CCNCC1 |r|
Cn1nccc1-c1ccc2nc(nc(N3CCOCC3)c2c1)-c1cccc2[nH]ccc12
C[C@H]1COCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cccc2[nH]ccc12 |r|
Cn1nccc1-c1ccc2nc(nc(N3CC4CCC(C3)O4)c2c1)-c1cccc2[nH]ccc12
Cn1nccc1-c1ccc2nc(nc(N3C4CCC3COC4)c2c1)-c1cccc2[nH]ccc12 |TLB:13:14:19.20.21:16.17|
Cn1nccc1-c1ccc2nc(nc(N3CC4CC3CO4)c2c1)-c1cccc2[nH]ccc12
C[C@H]1CN(C[C@@H](C)O1)c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cccc2[nH]ccc12 |r|
COC(=O)C1CN(CCO1)c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cccc2[nH]ccc12
C[C@@H]1CNCCN1c1nc(nc2ccc(cc12)-c1ccnn1C)-c1cccc2[nH]ccc12 |r|
Cn1nccc1-c1ccc2nc(nc(N3CCN(CC3)S(C)(=O)=O)c2c1)-c1cccc2[nH]ccc12
Cn1nccc1-c1ccc2nc(nc(N3CCC(N)C3)c2c1)-c1cccc2[nH]ccc12
Cn1nccc1-c1ccc2nc(nc(N3CC[C@H](N)C3)c2c1)-c1cccc2[nH]ccc12 |r|
Cn1nccc1-c1ccc2nc(nc(N3CCC[C@H](N)C3)c2c1)-c1cccc2[nH]ccc12 |r|
Cn1nccc1-c1ccc2nc(nc(N3CCC[C@@H](N)C3)c2c1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1cc[nH]c2nccc12)C1(CC1)[S@](C)(=N)=O |r|
C[C@H](c1ccccc1)n1nnc2cnc3ccc(cc3c12)-c1ccc(OCCCN(C)C)nc1 |r|
C[C@@H]1COCCN1c1nc(nc2ccsc12)-c1ccnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-c1ccnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=N)=O)-c1ccnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)C(C)=O)-c1ccnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)C(N)=O)-c1ccnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)C#N)-c1ccnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)C(C)=C)-c1ccnc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)C(C)(C)O)-c1ccnc2[nH]ccc12 |r|
CC(O)c1csc2c(nc(nc12)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-c1cc(F)cc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-c1cc(Cl)cc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-c1cc(cc2[nH]ccc12)C(F)(F)F |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-c1c(F)ncc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-c1cccc2[nH]ncc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-c1cccc2NC(=O)Cc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-c1cccc2NCCc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-c1c[nH]c2ccccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1cnc2ccccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1nnc2ccccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1c(C)nc2ccccc12 |r|
CCc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2scc(c2n1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1c(nc2ccccc12)C(F)F |r|
CSc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2scc(c2n1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1c2ccccc2[nH]c1=O |r|
CNc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2scc(c2n1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1c(nc2ccccc12)N(C)C |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1c(N)nc2ccccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1c(N)nc2ccc(F)cc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1c(N)nc2cc(F)ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1c(N)nc2c(F)cccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c(csc12)S(C)(=O)=O)-n1c(NC(C)=O)nc2ccccc12 |r|
CCS(=O)(=O)c1csc2c(nc(nc12)-n1c(NC)nc2ccccc12)N1CCOC[C@H]1C |r|
CNc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2scc(c2n1)S(=O)(=O)C1CC1 |r|
CCCS(=O)(=O)c1csc2c(nc(nc12)-n1c(NC)nc2ccccc12)N1CCOC[C@H]1C |r|
CNc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2scc(c2n1)S(=O)(=O)C(C)C |r|
CNc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2scc([S+](C)[O-])c2n1 |r|
CNc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2scc(SC)c2n1 |r|
CNc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2scc(c2n1)S(C)(=N)=O |r|
CNc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2scc(c2n1)P(C)(C)=O |r|
CCP(=O)(CC)c1csc2c(nc(nc12)-n1c(NC)nc2ccccc12)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C2(C)C)S(C)(=O)=O)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(C)=O)C2(C)C)-c1cccc2[nH]ccc12 |r|
CC(C)C(=O)N1CCc2c(nc(nc2C1(C)C)-c1cccc2[nH]ccc12)N1CCOC[C@H]1C |r|
CCC(=O)N1CCc2c(nc(nc2C1(C)C)-c1cccc2[nH]ccc12)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)C(C)(C)C)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)C1CC1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)C1CCC1)C2(C)C)-c1cccc2[nH]ccc12 |r|
COC(=O)N1CCc2c(nc(nc2C1(C)C)-c1cccc2[nH]ccc12)N1CCOC[C@H]1C |r|
CCOC(=O)N1CCc2c(nc(nc2C1(C)C)-c1cccc2[nH]ccc12)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)C=C)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)c1ccccc1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)Cc1cccs1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)Cc1ccccc1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)CN(C)C)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)CN1CCN(C)CC1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)c1cccc(c1)C(F)(F)F)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)c1cccc(F)c1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)c1cccc(Cl)c1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)c1cccc(C)c1)C2(C)C)-c1cccc2[nH]ccc12 |r|
COc1cccc(c1)C(=O)N1CCc2c(nc(nc2C1(C)C)-c1cccc2[nH]ccc12)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)c1ccc(cc1)C(F)(F)F)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)c1ccc(F)cc1)C2(C)C)-c1cccc2[nH]ccc12 |r|
COc1ccc(cc1)C(=O)N1CCc2c(nc(nc2C1(C)C)-c1cccc2[nH]ccc12)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(C)=O)C21CCC1)-c1cccc2[nH]ccc12 |r|
CC(C)C(=O)N1CCc2c(nc(nc2C11CCC1)-c1cccc2[nH]ccc12)N1CCOC[C@H]1C |r|
CCC(=O)N1CCc2c(nc(nc2C11CCC1)-c1cccc2[nH]ccc12)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(=O)C1CC1)C21CCC1)-c1cccc2[nH]ccc12 |r|
COc1cccc(c1)C(=O)N1CCc2c(nc(nc2C11CCC1)-c1cccc2[nH]ccc12)N1CCOC[C@H]1C |r|
COc1ccc(cc1)C(=O)N1CCc2c(nc(nc2C11CCC1)-c1cccc2[nH]ccc12)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc2CN(CCc12)C(C)=O)-c1cccc2[nH]ccc12 |r|
CC(C)C(=O)N1CCc2c(C1)nc(nc2N1CCOC[C@H]1C)-c1cccc2[nH]ccc12 |r|
CCC(=O)N1CCc2c(C1)nc(nc2N1CCOC[C@H]1C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2CN(CCc12)C(=O)C1CC1)-c1cccc2[nH]ccc12 |r|
COc1cccc(c1)C(=O)N1CCc2c(C1)nc(nc2N1CCOC[C@H]1C)-c1cccc2[nH]ccc12 |r|
COc1ccc(cc1)C(=O)N1CCc2c(C1)nc(nc2N1CCOC[C@H]1C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2CCN(Cc12)C(C)=O)-c1cccc2[nH]ccc12 |r|
CC(C)C(=O)N1CCc2nc(nc(N3CCOC[C@H]3C)c2C1)-c1cccc2[nH]ccc12 |r|
CCC(=O)N1CCc2nc(nc(N3CCOC[C@H]3C)c2C1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2CCN(Cc12)C(=O)C1CC1)-c1cccc2[nH]ccc12 |r|
COc1cccc(c1)C(=O)N1CCc2nc(nc(N3CCOC[C@H]3C)c2C1)-c1cccc2[nH]ccc12 |r|
COc1ccc(cc1)C(=O)N1CCc2nc(nc(N3CCOC[C@H]3C)c2C1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(C)=O)C2(C)C)-c1cccc2[nH]ccc12 |r|
CC(C)C(=O)N1Cc2c(nc(nc2N2CCOC[C@H]2C)-c2cccc3[nH]ccc23)C1(C)C |r|
CCC(=O)N1Cc2c(nc(nc2N2CCOC[C@H]2C)-c2cccc3[nH]ccc23)C1(C)C |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)C(C)(C)C)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)C1CC1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)C1CCC1)C2(C)C)-c1cccc2[nH]ccc12 |r|
COc1cccc(c1)C(=O)N1Cc2c(nc(nc2N2CCOC[C@H]2C)-c2cccc3[nH]ccc23)C1(C)C |r|
COc1ccc(cc1)C(=O)N1Cc2c(nc(nc2N2CCOC[C@H]2C)-c2cccc3[nH]ccc23)C1(C)C |r|
COc1ccc(cc1OC)C(=O)N1Cc2c(nc(nc2N2CCOC[C@H]2C)-c2cccc3[nH]ccc23)C1(C)C |r|
COc1cc(cc(OC)c1OC)C(=O)N1Cc2c(nc(nc2N2CCOC[C@H]2C)-c2cccc3[nH]ccc23)C1(C)C |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1ccc3OCOc3c1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1ccc3OCCOc3c1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1ccc(cc1)S(C)(=O)=O)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1cccc(c1)S(C)(=O)=O)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1ccc(OC(F)F)cc1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1ccc(OC(F)(F)F)cc1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1ccc(cc1)C(C)=O)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1cccc(c1)C(C)=O)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cc[nH]n1 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cc(O)ccc1F |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1ccccn1 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1nccs1 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cscn1 |r|
C[C@@H]1COCCN1c1cc(nc2[nH]c(nc12)-c1ccccn1)N1C2CCC1COC2 |r|
C[C@@H]1COCCN1c1cc(nc2sc(nc12)-c1cc[nH]n1)-c1cncnc1 |r|
CC(C)c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cc[nH]n1 |r|
C[C@@H]1COCCN1c1cc(nc2sc(nc12)-c1cc[nH]n1)C1(CC1)C#N |r|
C[C@@H]1COCCN1c1cc(nc2sc(nc12)-c1cc[nH]n1)C1(CCOCC1)C#N |r|
Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1cnc2ccccc2c1
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
C[C@@H]1COCCN1c1cc(C2(S(C)(=O)=O)CC2)nc(Nc2cn[nH]c2)n1
C[C@@H]1COCCN1c1cc(C2(S(C)(=O)=O)CC2)nc(Nc2cc[nH]n2)n1
Cc1c[nH]nc1Nc1nc(N2CCOC[C@H]2C)cc(C2(S(C)(=O)=O)CC2)n1
C[C@@H]1COCCN1c1cc(C2(S(C)(=O)=O)CC2)nc(S(=O)(=O)c2cc[nH]n2)n1
C[C@@H]1COCCN1c1cc(C2(S(C)(=O)=O)CC2)nc(Cc2cc[nH]n2)n1
C[C@@H]1COCCN1c1ccc2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(I)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(-c2ccccc2C(N)=O)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(N2CCNCC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc(N2CCN(CC(F)(F)F)CC2)c2cnn(-c3cc[nH]n3)c2n1
[2H]C1([2H])C([2H])([2H])C([2H])([2H])C(O)(c2cc(N3CCOC[C@H]3C)nc3c2cnn3-c2cc[nH]n2)C([2H])([2H])C1([2H])[2H]
C[C@@H]1COCCN1c1cc(C2(O)CCC(F)(F)CC2)c2cnn(-c3cc[nH]n3)c2n1
C[C@@H]1COCCN1c1cc([C@@]2(O)CCCOC2)c2cnn(-c3cc[nH]n3)c2n1
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C
CCOc1cc(ccc1Nc2ncc3c(n2)N(c4ccccc4C(=O)N3C)C)N5CCC(CC5)O
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1