5148 SMILES Strings for Proto-oncogene tyrosine-protein kinase Src

Compound Name
SMILES String
Nc1ncnc2n(nc(-c3ccccc3)c12)-c1ccccc1
Nc1nc(N)c2c(Nc3cccc(Cl)c3)[nH]nc2n1
Nc1ncnc2n[nH]c(Nc3cccc(Cl)c3)c12
N(c1[nH]nc2ncnc(Nc3ccccc3)c12)c1ccccc1
Clc1cccc(Nc2[nH]nc3ncnc(Nc4ccccc4)c23)c1
Clc1cccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1
Clc1cccc(Nc2[nH]nc3ncnc(Nc4cccc(Br)c4)c23)c1
Cc1cccc(Nc2ncnc3n[nH]c(Nc4cccc(Cl)c4)c23)c1
COc1ccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
Oc1ccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
COc1cccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1
Oc1cccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1
CC(C)(C)OC(=O)Nc1ccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
Nc1ccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
CN(C)c1ccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
Clc1cccc(Nc2ncnc3n[nH]c(NCc4ccccc4)c23)c1
Clc1cccc(CNc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1
COc1cccc(CNc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1
COc1ccc(CNc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
Clc1cccc(Nc2ncnc3n[nH]c(-c4ccccc4)c23)c1
Oc1cccc(c1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
COc1ccc(cc1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
Oc1ccc(cc1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
[O-][N+](=O)c1cccc(c1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
Nc1cccc(c1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
CC(C)(C)OC(=O)Nc1ccc(cc1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
Nc1ccc(cc1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
Clc1cccc(Nc2[nH]nc3ncnc(Oc4cccc(Cl)c4)c23)c1
Clc1cccc(Nc2[nH]nc3ncnc(NCc4ccccc4)c23)c1
COc1cc2ncnc(Nc3cccc(Br)c3)c2cc1OC
Cn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CC(=O)Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-10.82,-.43,;-9.48,.34,;-9.48,1.88,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
Cc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
Cn1c2nc(=O)[nH]cc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
CCNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
CC(C)Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-9.48,-2.74,;-8.15,-1.97,;-6.82,-2.74,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
CCCCNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-6.5,-5.16,;-7.59,-4.08,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
Cn1c2nc(NC3CCCCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.81,-2.74,;-6.81,-4.28,;-8.14,-5.05,;-9.48,-4.29,;-9.48,-2.75,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(NCCO)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.75,;-9.88,-4.23,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(NCc3ccccc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.74,;-10.82,-1.97,;-12.15,-2.74,;-12.15,-4.28,;-10.82,-5.05,;-9.48,-4.28,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CN(C)c1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-8.15,-1.97,;-8.15,-.43,;-9.48,.34,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
CCN(CC)CCCNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-6.72,-6.82,;-8.2,-7.22,;-9.29,-6.13,;-10.38,-7.22,;-11.71,-6.45,;-8.52,-4.79,;-8.92,-3.31,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
Cn1c2nc(NCCCN3CCOCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-8.92,-3.31,;-8.52,-4.79,;-9.18,-6.13,;-8.09,-7.22,;-8.49,-8.7,;-9.97,-9.1,;-11.06,-8.01,;-10.66,-6.53,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CN1CCN(CCCNc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)CC1 |(-10.37,-10.59,;-9.97,-9.1,;-8.49,-8.7,;-8.09,-7.22,;-9.18,-6.13,;-8.52,-4.79,;-8.92,-3.31,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-10.66,-6.53,;-11.06,-8.01,)|
CN1CCN(CCCCNc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)CC1 |(-8.54,-12.22,;-8.54,-10.68,;-7.27,-9.81,;-7.39,-8.28,;-8.78,-7.61,;-9.18,-6.13,;-8.52,-4.79,;-8.92,-3.31,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-10.05,-8.49,;-9.93,-10.02,)|
CN1CCN(CCCCCNc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)CC1 |(-9.18,-13.72,;-9.18,-12.18,;-7.84,-11.41,;-7.84,-9.87,;-9.18,-9.1,;-8.78,-7.61,;-9.18,-6.13,;-8.52,-4.79,;-8.92,-3.31,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-10.51,-9.87,;-10.51,-11.41,)|
Cn1c2nc(NCc3ccccn3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-8.92,-3.31,;-10.45,-3.09,;-11.4,-4.3,;-10.82,-5.73,;-9.3,-5.95,;-8.35,-4.73,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(NCc3cccnc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-8.92,-3.31,;-10.46,-3.31,;-11.23,-4.64,;-10.46,-5.97,;-8.92,-5.97,;-8.15,-4.64,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(NCCc3ccccn3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-8.92,-3.31,;-8.15,-4.64,;-8.9,-5.99,;-8.1,-7.31,;-6.56,-7.28,;-5.82,-5.93,;-6.61,-4.61,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(NCCCCCC(O)=O)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-8.92,-3.31,;-8.15,-4.64,;-8.92,-5.97,;-8.52,-7.46,;-9.61,-8.55,;-9.61,-10.09,;-10.94,-7.78,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3ccccc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.81,-2.74,;-6.81,-4.28,;-8.14,-5.05,;-9.48,-4.29,;-9.48,-2.75,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CCn1c2nc(Nc3ccccc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.73,-3.06,;-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.81,-2.74,;-6.81,-4.28,;-8.14,-5.05,;-9.48,-4.29,;-9.48,-2.75,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3cccnc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.74,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
COc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cn1 |(-7.06,-7.68,;-8.15,-6.59,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-6.82,-2.74,;-6.82,-4.28,)|
Cn1c2nc(Nc3ccncc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CCn1c2nc(Nc3ccncc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.73,-3.06,;-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3ccc(Cl)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3cccc(Br)c3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.74,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-5.48,-5.05,;-6.82,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-8.15,-6.59,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-6.82,-2.74,;-6.82,-4.28,)|
COc1ccccc1Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-12.15,-2.74,;-10.82,-1.97,;-9.48,-2.74,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
COc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 |(-12.15,-4.28,;-10.82,-5.05,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,)|
COc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-7.06,-7.68,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
Cn1c2nc(Nc3cccc(O)c3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-9.48,-4.28,;-10.82,-5.05,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3ccc(O)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CN1c2c(cnc(n2)Nc3cccc(c3)CO)C=C(C1=O)c4c(cccc4Cl)Cl
COc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1C |(-7.06,-7.68,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,;-10.82,-5.05,)|
COc1cc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc(OC)c1 |(-12.15,-4.28,;-10.82,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-6.82,-2.74,;-6.82,-4.28,;-5.48,-5.05,;-4.15,-4.28,;-8.15,-5.05,)|
CCOC(=O)c1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 |(-14.82,-4.28,;-13.49,-5.05,;-12.15,-4.28,;-10.82,-5.05,;-10.82,-6.59,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,)|
CCOC(=O)c1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-4.15,-7.36,;-5.48,-6.59,;-6.82,-7.36,;-8.15,-6.59,;-9.48,-7.36,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CCOC(=O)CCCc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-.15,-6.59,;-1.48,-7.36,;-2.82,-6.59,;-4.15,-7.36,;-4.15,-8.9,;-5.48,-6.59,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-6.82,-2.74,;-6.82,-4.28,)|
Cn1c2nc(Nc3ccc(OCCN)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-6.82,-7.36,;-6.82,-8.9,;-5.48,-9.67,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CCNCCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-2.66,-9.3,;-4.15,-8.9,;-5.48,-9.67,;-6.82,-8.9,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CN(C)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-4.15,-8.9,;-5.48,-9.67,;-5.48,-11.21,;-6.82,-8.9,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CN(C)CCCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-4.15,-11.98,;-5.48,-11.21,;-6.82,-11.98,;-5.48,-9.67,;-6.82,-8.9,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CCN(CC)CCOc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 |(-13.08,-10.99,;-11.59,-10.59,;-10.82,-9.26,;-9.48,-10.03,;-8.4,-8.94,;-11.59,-7.93,;-10.82,-6.59,;-10.82,-5.05,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,)|
CCN(CC)CCOc1ccc(cc1)Nc2ncc3c(n2)N(C(=O)C(=C3)c4c(cccc4Cl)Cl)C
CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(CC)c3n2)cc1 |(-8.3,-10.68,;-6.82,-11.08,;-5.73,-9.99,;-4.24,-10.39,;-3.15,-9.3,;-6.82,-8.9,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-1.48,-2.74,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
Cn1c2nc(Nc3ccc(OCCN4CCCCC4)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-6.82,-7.36,;-5.48,-6.59,;-4.15,-7.36,;-4.19,-8.9,;-2.88,-9.71,;-1.53,-8.98,;-1.48,-7.44,;-2.79,-6.63,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CN1CCN(CC1)c1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-8.03,-11.21,;-8.03,-9.67,;-9.39,-8.95,;-9.45,-7.41,;-8.15,-6.59,;-6.79,-7.31,;-6.73,-8.85,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CN1CCN(Cc2ccc(Nc3ncc4cc(-c5c(Cl)cccc5Cl)c(=O)n(C)c4n3)cc2)CC1 |(-13.49,-9.67,;-12.15,-8.9,;-12.15,-7.36,;-10.82,-6.59,;-9.48,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-6.82,-2.74,;-6.82,-4.28,;-9.48,-8.9,;-10.82,-9.67,)|
Cn1c2nc(Nc3cccc(c3)C(O)=O)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-10.82,-5.05,;-12.15,-4.28,;-10.82,-6.59,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3ccc(CC(O)=O)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.74,;-9.48,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-7.38,-7.93,;-5.84,-7.93,;-8.15,-9.26,;-6.82,-4.28,;-6.82,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3ccc(CCCC(O)=O)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.74,;-9.48,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-7.38,-7.93,;-8.15,-9.26,;-7.06,-10.35,;-5.57,-10.75,;-7.83,-11.68,;-6.82,-4.28,;-6.82,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(Cl)cccc1Cl |(4.56,-3.94,;3.23,-3.17,;1.89,-3.94,;3.23,-4.71,;3.23,-1.63,;1.89,-.86,;.56,-1.63,;1.89,.68,;.56,1.45,;-.77,.68,;-2.11,1.45,;-3.44,.68,;-4.78,1.45,;-6.11,.68,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;1.89,3.76,;1.89,5.3,;.56,6.07,;3.23,6.07,;4.56,5.3,;4.56,3.76,;3.23,2.99,;3.23,1.45,)|
Nc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-6.11,.68,;-4.78,1.45,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;.56,1.45,;1.89,.68,;-.77,.68,;-2.11,1.45,;-3.44,.68,;1.89,3.76,;1.89,5.3,;.56,6.07,;3.23,6.07,;4.56,5.3,;4.56,3.76,;3.23,2.99,;3.23,1.45,)|
CCN(CC)CCCNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-13.7,2.41,;-12.93,1.08,;-11.44,.68,;-11.24,-.85,;-9.82,-1.44,;-10.11,1.45,;-8.78,.68,;-7.44,1.45,;-6.11,.68,;-4.78,1.45,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;.56,1.45,;1.89,.68,;-.77,.68,;-2.11,1.45,;-3.44,.68,;1.89,3.76,;1.89,5.3,;.56,6.07,;3.23,6.07,;4.56,5.3,;4.56,3.76,;3.23,2.99,;3.23,1.45,)|
CCN(CC)CCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-13.7,2.41,;-12.93,1.08,;-11.44,.68,;-11.24,-.85,;-9.82,-1.44,;-10.11,1.45,;-8.78,.68,;-7.44,1.45,;-6.11,.68,;-4.78,1.45,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;.56,1.45,;1.89,.68,;1.89,-.86,;.56,-1.63,;3.23,-1.63,;4.56,-.86,;5.89,-1.63,;4.56,.68,;5.89,-.09,;-.77,.68,;-2.11,1.45,;-3.44,.68,;1.89,3.76,;1.89,5.3,;.56,6.07,;3.23,6.07,;4.56,5.3,;4.56,3.76,;3.23,2.99,;3.23,1.45,)|
Cc1cccc(C)c1-c1cc2cnc(N)nc2nc1N |(3.23,1.45,;3.23,2.99,;4.56,3.76,;4.56,5.3,;3.23,6.07,;1.89,5.3,;.56,6.07,;1.89,3.76,;.56,2.99,;-.77,3.76,;-2.11,2.99,;-3.44,3.76,;-4.78,2.99,;-4.78,1.45,;-6.11,.68,;-3.44,.68,;-2.11,1.45,;-.77,.68,;.56,1.45,;1.89,.68,)|
Cc1cccc(C)c1-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(3.23,1.45,;3.23,2.99,;4.56,3.76,;4.56,5.3,;3.23,6.07,;1.89,5.3,;.56,6.07,;1.89,3.76,;.56,2.99,;-.77,3.76,;-2.11,2.99,;-3.44,3.76,;-4.78,2.99,;-4.78,1.45,;-6.11,.68,;-3.44,.68,;-2.11,1.45,;-.77,.68,;.56,1.45,;1.89,.68,;1.89,-.86,;.56,-1.63,;3.23,-1.63,;4.56,-.86,;5.89,-1.63,;4.56,.68,;5.89,-.09,)|
CCN(CC)CCCNc1ncc2cc(c(N)nc2n1)-c1c(C)cccc1C |(-14.11,.68,;-12.78,1.45,;-11.44,.68,;-11.44,-.86,;-12.78,-1.63,;-10.11,1.45,;-8.78,.68,;-7.44,1.45,;-6.11,.68,;-4.78,1.45,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;.56,1.45,;1.89,.68,;-.77,.68,;-2.11,1.45,;-3.44,.68,;1.89,3.76,;3.23,2.99,;3.23,1.45,;4.56,3.76,;4.56,5.3,;3.23,6.07,;1.89,5.3,;.56,6.07,)|
CCN(CC)CCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(C)cccc1C |(-13.18,.33,;-11.84,1.1,;-10.51,.33,;-10.51,-1.21,;-9.18,-1.98,;-9.18,1.1,;-7.84,.33,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
Nc1ncc2cc(c(N)nc2n1)-c1c(Br)cccc1Br |(-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(Br)cccc1Br |(5.49,-4.29,;4.16,-3.52,;2.83,-4.29,;4.16,-5.06,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCNc1ncc2cc(c(N)nc2n1)-c1c(Br)cccc1Br |(-13.18,.33,;-11.84,1.1,;-10.51,.33,;-10.51,-1.21,;-9.42,-2.3,;-9.18,1.1,;-7.84,.33,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Br)cccc1Br |(-13.18,.33,;-11.84,1.1,;-10.51,.33,;-10.51,-1.21,;-9.42,-2.3,;-9.18,1.1,;-7.84,.33,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
Cc1cc(C)c(C)c(c1C)-c1cc2cnc(N)nc2nc1N |(4.16,7.26,;4.16,5.72,;5.49,4.95,;5.49,3.41,;6.83,2.64,;4.16,2.64,;4.16,1.1,;2.83,3.41,;2.83,4.95,;1.49,5.72,;1.49,2.64,;.16,3.41,;-1.17,2.64,;-2.51,3.41,;-3.84,2.64,;-3.84,1.1,;-5.18,.33,;-2.51,.33,;-1.17,1.1,;.16,.33,;1.49,1.1,;2.83,.33,)|
Cc1cc(C)c(C)c(c1C)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(4.16,7.26,;4.16,5.72,;5.49,4.95,;5.49,3.41,;6.83,2.64,;4.16,2.64,;4.16,1.1,;2.83,3.41,;2.83,4.95,;1.49,5.72,;1.49,2.64,;.16,3.41,;-1.17,2.64,;-2.51,3.41,;-3.84,2.64,;-3.84,1.1,;-5.18,.33,;-2.51,.33,;-1.17,1.1,;.16,.33,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.67,-3.92,;5.49,-4.29,;4.16,-5.06,)|
COc1cc(OC)cc(c1)-c1cc2cnc(N)nc2nc1N
COc1cc(OC)cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
CCN(CC)CCNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-11.34,.05,;-10.57,1.39,;-9.09,1.79,;-8.69,3.27,;-7.2,3.67,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCNC(=O)Nc1nc2nc(NCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |(5.49,-4.29,;4.16,-3.52,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.34,.05,;-8.69,3.27,;-7.2,3.67,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-11.34,.05,;-10.57,1.39,;-9.09,1.79,;-8.69,3.27,;-7.2,3.67,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCNC(=O)Nc1nc2nc(NCCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |(2.83,-4.29,;4.16,-3.52,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.66,2.48,;-13.15,2.08,;-10.57,-.15,;-11.91,-.92,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCNc1ncc2cc(c(NC(=O)NC(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-13.15,2.08,;-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-11.91,-.92,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.83,-4.29,;5.49,-4.29,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCCNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-13.55,.59,;-13.15,2.08,;-11.66,2.48,;-11.26,3.96,;-9.78,4.36,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCNC(=O)Nc1nc2nc(NCCCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |(5.49,-4.29,;4.16,-3.52,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.66,2.48,;-13.15,2.08,;-13.55,.59,;-11.26,3.96,;-9.78,4.36,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-13.55,.59,;-13.15,2.08,;-11.66,2.48,;-11.26,3.96,;-9.78,4.36,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCCNc1ncc2cc(c(NC(=O)NC3CCCCC3)nc2n1)-c1c(Cl)cccc1Cl |(-13.55,.59,;-13.15,2.08,;-11.66,2.48,;-11.26,3.96,;-9.78,4.36,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.83,-4.29,;2.83,-5.83,;4.16,-6.6,;5.49,-5.83,;5.49,-4.29,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCCNc1ncc2cc(c(NC(=O)Nc3ccccc3)nc2n1)-c1c(Cl)cccc1Cl |(-13.55,.59,;-13.15,2.08,;-11.66,2.48,;-11.26,3.96,;-9.78,4.36,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.83,-4.29,;2.83,-5.83,;4.16,-6.6,;5.49,-5.83,;5.49,-4.29,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CCCNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CCCN(C)c1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-5.18,-1.21,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CCCN(C)c1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-5.18,-1.21,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.4,-1.8,;3.92,-2.3,;3.92,-3.84,;2.58,-4.61,;5.25,-4.61,;3.92,-5.38,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CC(C)(C)CNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-8.4,-.79,;-7.6,2.19,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CC(C)(C)CNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-8.4,-.79,;-7.6,2.19,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
Nc1nc2nc(NCCCN3CCOCC3)ncc2cc1-c1c(Cl)cccc1Cl |(2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.91,2.16,;-13.24,1.39,;-13.24,-.15,;-11.91,-.92,;-10.57,-.15,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CC(C)(C)NC(=O)Nc1nc2nc(NCCCN3CCOCC3)ncc2cc1-c1c(Cl)cccc1Cl |(5.49,-4.29,;4.16,-3.52,;2.83,-4.29,;4.16,-5.06,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.91,2.16,;-13.24,1.39,;-13.24,-.15,;-11.91,-.92,;-10.57,-.15,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CC1CCCCN1CCCNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-11.91,3.7,;-11.91,2.16,;-13.24,1.39,;-13.24,-.15,;-11.91,-.92,;-10.57,-.15,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CC1CCCCN1CCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-11.91,3.7,;-11.91,2.16,;-13.24,1.39,;-13.24,-.15,;-11.91,-.92,;-10.57,-.15,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.34,-1.61,;4.05,-2.15,;5.47,-1.56,;6.69,-2.5,;6.96,-1.16,;4.98,-.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN1CCN(CCCNc2ncc3cc(c(N)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.57,-.92,;-13.24,-.15,;-13.24,1.39,;-11.91,2.16,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.57,-.15,;-11.91,-.92,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.57,-.92,;-13.24,-.15,;-13.24,1.39,;-11.91,2.16,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.34,-1.61,;4.05,-2.15,;5.47,-1.56,;6.69,-2.5,;6.96,-1.16,;4.98,-.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.57,-.15,;-11.91,-.92,)|
CN1CCN(CCCCNc2ncc3cc(c(N)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-15.76,4.51,;-14.27,4.11,;-12.91,4.83,;-11.61,4.02,;-11.66,2.48,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-13.02,1.76,;-14.33,2.57,)|
CN1CCN(CCCCNc2ncc3cc(c(NC(=O)NC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-15.76,4.51,;-14.27,4.11,;-12.91,4.83,;-11.61,4.02,;-11.66,2.48,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-13.02,1.76,;-14.33,2.57,)|
CN1CCN(CCCNc2ncc3cc(c(NC(N)=O)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.64,-.8,;-13.31,-.03,;-13.24,1.51,;-11.87,2.22,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;4.16,-1.98,;1.49,-1.98,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.64,-.15,;-12.01,-.86,)|
CCNC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(5.49,-4.29,;4.16,-3.52,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.87,2.22,;-13.24,1.51,;-13.31,-.03,;-14.64,-.8,;-12.01,-.86,;-10.64,-.15,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NCC=C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.64,-.8,;-13.31,-.03,;-13.24,1.51,;-11.87,2.22,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;5.49,-5.83,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.64,-.15,;-12.01,-.86,)|
CC(C)NC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(5.49,-4.29,;4.16,-3.52,;2.83,-4.29,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.87,2.22,;-13.24,1.51,;-13.31,-.03,;-14.64,-.8,;-12.01,-.86,;-10.64,-.15,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCCCCCCCNC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(-1.17,-11.22,;.16,-10.45,;.16,-8.91,;1.49,-8.14,;1.49,-6.6,;2.83,-5.83,;2.83,-4.29,;4.16,-3.52,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.87,2.22,;-13.24,1.51,;-13.31,-.03,;-14.64,-.8,;-12.01,-.86,;-10.64,-.15,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NCc4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.64,-.8,;-13.31,-.03,;-13.24,1.51,;-11.87,2.22,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.83,-4.29,;1.49,-3.52,;.16,-4.29,;.16,-5.83,;1.49,-6.6,;2.83,-5.83,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.64,-.15,;-12.01,-.86,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NC4CCCCC4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.64,-.8,;-13.31,-.03,;-13.24,1.51,;-11.87,2.22,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.8,-4.24,;2.74,-5.78,;4.04,-6.6,;5.4,-5.88,;5.46,-4.34,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.64,-.15,;-12.01,-.86,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NC45CC6CC(CC(C6)C4)C5)nc3n2)-c2c(Cl)cccc2Cl)CC1 |TLB:27:22:29:28.26.25,27:26:29:21.22.23,THB:25:24:21:28.26.27,25:26:21:29.24.23,(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;26.9,-20.31,;26.9,-22.76,;28.89,-23.49,;31.09,-22.83,;29.48,-25.41,;27.66,-24.12,;24.83,-24.68,;27.66,-21.18,;31.09,-20.41,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NCCNC(=O)OC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;30.36,-19.89,;30.36,-21.43,;31.7,-22.2,;33.03,-21.43,;31.7,-23.74,;33.03,-24.51,;34.36,-23.74,;33.03,-26.05,;34.36,-25.28,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN(C)CCNC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(29.03,-22.2,;30.36,-21.43,;31.7,-22.2,;30.36,-19.89,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;16.87,-14.9,;15.78,-13.81,;14.29,-14.21,;13,-13.38,;11.63,-14.08,;11.56,-15.62,;10.23,-16.39,;12.86,-16.45,;14.22,-15.75,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCN(CC)C(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(30.36,-19.89,;29.03,-19.12,;29.03,-17.58,;30.36,-16.81,;31.7,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;16.87,-14.9,;15.78,-13.81,;14.29,-14.21,;13,-13.38,;11.63,-14.08,;11.56,-15.62,;10.23,-16.39,;12.86,-16.45,;14.22,-15.75,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;30.29,-21.47,;30.34,-19.93,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccc(Cl)cc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;28.88,-23.74,;30.29,-21.47,;30.34,-19.93,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccc(Br)cc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;28.88,-23.74,;30.29,-21.47,;30.34,-19.93,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccc(cc4)C(F)(F)F)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;30.29,-21.47,;30.34,-19.93,;28.88,-23.74,;27.34,-23.74,;28.48,-25.22,;30.41,-23.96,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccc(Cl)c(Cl)c4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;28.93,-23.74,;30.29,-21.47,;31.62,-22.24,;30.34,-19.93,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccc(C)cc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;28.93,-23.74,;30.29,-21.47,;30.34,-19.93,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
COc1ccccc1NC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(33.16,-19.56,;31.67,-19.16,;30.34,-19.93,;30.29,-21.47,;28.93,-22.2,;27.62,-21.39,;27.67,-19.85,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;16.87,-14.9,;15.78,-13.81,;14.29,-14.21,;13,-13.38,;11.63,-14.08,;11.56,-15.62,;10.23,-16.39,;12.86,-16.45,;14.22,-15.75,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
COc1cccc(NC(=O)Nc2nc3nc(NCCCN4CCN(C)CC4)ncc3cc2-c2c(Cl)cccc2Cl)c1 |(32.95,-21.55,;31.6,-22.28,;30.29,-21.47,;28.93,-22.2,;27.62,-21.39,;27.67,-19.85,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;16.87,-14.9,;15.78,-13.81,;14.29,-14.21,;13,-13.38,;11.63,-14.08,;11.56,-15.62,;10.23,-16.39,;12.86,-16.45,;14.22,-15.75,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;30.34,-19.93,)|
COc1ccc(NC(=O)Nc2nc3nc(NCCCN4CCN(C)CC4)ncc3cc2-c2c(Cl)cccc2Cl)cc1 |(30.19,-24.55,;28.88,-23.74,;28.93,-22.2,;27.62,-21.39,;27.67,-19.85,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;16.87,-14.9,;15.78,-13.81,;14.29,-14.21,;13,-13.38,;11.63,-14.08,;11.56,-15.62,;10.23,-16.39,;12.86,-16.45,;14.22,-15.75,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;30.34,-19.93,;30.29,-21.47,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4cccc5ccccc45)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;30.34,-19.93,;30.29,-21.47,;28.93,-22.2,;27.62,-21.39,;26.26,-22.11,;24.96,-21.3,;25,-19.76,;26.36,-19.03,;27.67,-19.85,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CCN(CC)CCCNc1ncc2cc(c(NC(=O)CC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(12.63,-13.01,;13.02,-14.5,;14.36,-15.27,;14.36,-16.81,;13.59,-18.14,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.69,-19.89,;30.36,-19.89,;29.03,-20.66,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCN(CC)CCCNc1ncc2cc(c(\N=C\N(C)C)nc2n1)-c1c(Cl)cccc1Cl |(12.63,-13.01,;13.02,-14.5,;14.36,-15.27,;14.36,-16.81,;13.59,-18.14,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;29.03,-17.58,;29.03,-19.12,;30.52,-17.18,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCNC(=S)Nc1nc2nc(NCCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |(30.36,-19.89,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;17.02,-15.27,;15.69,-14.5,;14.36,-15.27,;13.02,-14.5,;12.63,-13.01,;14.36,-16.81,;13.59,-18.14,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCNC(N)=Nc1nc2nc(NCCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |w:5.5,(30.36,-19.89,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;17.02,-15.27,;15.69,-14.5,;14.36,-15.27,;13.02,-14.5,;12.63,-13.01,;14.36,-16.81,;13.59,-18.14,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCN(CC)CCCCNc1ncc2cc(c(NC(=S)NCCCN3CCOCC3)nc2n1)-c1c(Cl)cccc1Cl |(11.69,-12.19,;13.02,-12.96,;13.02,-14.5,;11.69,-15.27,;11.69,-16.81,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;30.36,-19.89,;30.36,-21.43,;31.7,-22.2,;31.64,-23.74,;32.95,-24.55,;34.31,-23.83,;34.36,-22.29,;33.05,-21.48,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCCC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(30.36,-19.89,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;17.02,-15.27,;15.69,-14.5,;14.36,-15.27,;13.02,-14.5,;11.69,-15.27,;11.69,-16.81,;10.36,-17.58,;13.02,-17.58,;14.36,-16.81,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)CC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;28.26,-20.45,;30.57,-19.12,;29.8,-20.45,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Cc4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.69,-19.89,;27.69,-21.43,;29.03,-22.2,;30.36,-21.43,;30.36,-19.89,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
CN1CCN(CCCNc2ncc3cc(c(NS(=O)(=O)c4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-16.04,;28.46,-18.14,;28.46,-19.68,;29.8,-20.45,;31.13,-19.68,;31.13,-18.14,;29.8,-17.37,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
CN1CCN(CCCNc2ncc3cc(c(N=C(N)Nc4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |w:16.15,(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.69,-19.89,;27.69,-21.43,;29.03,-22.2,;30.36,-21.43,;30.36,-19.89,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
CC(C)NC(NC(C)C)=Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(25.03,-19.89,;26.36,-19.12,;27.69,-19.89,;26.36,-17.58,;27.69,-16.81,;29.03,-17.58,;30.52,-17.18,;31.6,-18.27,;30.91,-15.69,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;17.02,-15.27,;15.69,-14.5,;14.36,-15.27,;13.02,-14.5,;11.69,-15.27,;11.69,-16.81,;10.36,-17.58,;13.02,-17.58,;14.36,-16.81,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=S)NC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;30.52,-17.18,;31.6,-18.27,;30.91,-15.69,;32,-16.78,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=S)Nc4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.64,-19.79,;27.53,-21.32,;28.8,-22.19,;30.19,-21.52,;30.3,-19.98,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
c1nc2ccccc2n1-c1ccccc1
Oc1cccc2n(cnc12)-c1ccccc1
Oc1ccc2n(cnc2c1)-c1ccccc1
COc1ccc2n(cnc2c1)-c1ccccc1
CCOc1ccc2n(cnc2c1)-c1ccccc1
CCCOc1ccc2n(cnc2c1)-c1ccccc1
CC(C)Oc1ccc2n(cnc2c1)-c1ccccc1
CCCCOc1ccc2n(cnc2c1)-c1ccccc1
C=CCOc1ccc2n(cnc2c1)-c1ccccc1
OCCCCOc1ccc2n(cnc2c1)-c1ccccc1
C(Oc1ccc2n(cnc2c1)-c1ccccc1)C1CO1
OCC(O)COc1ccc2n(cnc2c1)-c1ccccc1
NCCOc1ccc2n(cnc2c1)-c1ccccc1
CN(C)CCOc1ccc2n(cnc2c1)-c1ccccc1
CN(C)CCCOc1ccc2n(cnc2c1)-c1ccccc1
CN(C)CCCCOc1ccc2n(cnc2c1)-c1ccccc1
C(CN1CCOCC1)Oc1ccc2n(cnc2c1)-c1ccccc1
C(COc1ccc2n(cnc2c1)-c1ccccc1)CN1CCOCC1
C(CCN1CCOCC1)COc1ccc2n(cnc2c1)-c1ccccc1
COc1ccc2n(cnc2c1)-c1ccc(N)cc1
Sc1ccc2n(cnc2c1)-c1ccccc1
CSc1ccc2n(cnc2c1)-c1ccccc1
C(CSc1ccc2n(cnc2c1)-c1ccccc1)CN1CCOCC1
CN(C)C(=S)Oc1ccc2n(cnc2c1)-c1ccccc1
Oc1ccc2n(cnc2c1O)-c1ccccc1
COc1ccc2n(cnc2c1O)-c1ccccc1
COc1c(O)ccc2n(cnc12)-c1ccccc1
COc1ccc2n(cnc2c1OC)-c1ccccc1
Oc1ccc2n(cnc2c1Br)-c1ccccc1
Brc1c(OCC=C)ccc2n(cnc12)-c1ccccc1
Oc1ccc2n(cnc2c1CC=C)-c1ccccc1
CC1Cc2c(O1)ccc1n(cnc21)-c1ccccc1
COc1cc2ncn(-c3ccccc3)c2cc1OC
Oc1cc2ncn(-c3ccccc3)c2cc1O
C1Oc2cc3ncn(-c4ccccc4)c3cc2O1
COc1cc2ncn(-c3ccccc3)c2cc1C
Cc1cc2n(cnc2cc1O)-c1ccccc1
COc1cc2ncn(-c3ccccc3)c2cc1C(O)=O
OC(=O)c1cc2n(cnc2cc1O)-c1ccccc1
COC(=O)c1cc2n(cnc2cc1OC)-c1ccccc1
COc1cc2ncn(-c3ccccc3)c2cc1CO
COc1cc2ncn(-c3ccccc3)c2cc1C=O
CCn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-.32,-3.56,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
CCCn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-.32,-5.1,;-.32,-3.56,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
CCCCn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(1.02,-5.87,;-.32,-5.1,;-.32,-3.56,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
CC(C)Cn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-.32,-5.1,;-.32,-3.56,;1.02,-2.79,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
COC(=O)Cn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(2.35,-3.56,;1.02,-2.79,;-.32,-3.56,;-.32,-5.1,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
CC(C)(C)OC(=O)Cn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(3.69,-2.79,;2.35,-3.56,;2.35,-5.1,;3.69,-4.33,;1.02,-2.79,;-.32,-3.56,;-.32,-5.1,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(CC(O)=O)c2n1 |(-6.98,-1.25,;-5.65,-.48,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,;-1.65,-1.25,;-1.65,-2.79,;-.32,-3.56,;1.02,-2.79,;-.32,-5.1,;-2.98,-.48,;-4.32,-1.25,)|
Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(Cc3ccccc3)c2n1 |(-6.98,-1.25,;-5.65,-.48,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,;-1.65,-1.25,;-1.65,-2.79,;-.32,-3.56,;-.32,-5.1,;1.02,-5.87,;2.35,-5.1,;2.35,-3.56,;1.02,-2.79,;-2.98,-.48,;-4.32,-1.25,)|
Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(Cc3ccncc3)c2n1 |(-6.98,-1.25,;-5.65,-.48,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,;-1.65,-1.25,;-1.65,-2.79,;-.32,-3.56,;-.32,-5.1,;1.02,-5.87,;2.35,-5.1,;2.35,-3.56,;1.02,-2.79,;-2.98,-.48,;-4.32,-1.25,)|
CN(C)CCCn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(1.02,-7.41,;1.02,-5.87,;2.35,-5.1,;-.32,-5.1,;-.32,-3.56,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(CCCOCc3ccccc3)c2n1 |(-6.98,-1.25,;-5.65,-.48,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,;-1.65,-1.25,;-1.65,-2.79,;-.32,-3.56,;-.32,-5.1,;1.02,-5.87,;1.02,-7.41,;2.35,-8.18,;2.35,-9.72,;3.69,-10.49,;5.02,-9.72,;5.02,-8.18,;3.69,-7.41,;-2.98,-.48,;-4.32,-1.25,)|
Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(CCCO)c2n1 |(-6.98,-1.25,;-5.65,-.48,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,;-1.65,-1.25,;-1.65,-2.79,;-.32,-3.56,;-.32,-5.1,;1.02,-5.87,;-2.98,-.48,;-4.32,-1.25,)|
Cn1c2nc(Nc3ccccc3)ncc2cc(-c2ccccc2)c1=O
Cn1c2nc(Nc3ccccc3)ncc2cc(-c2ccsc2)c1=O
Cn1c2nc(Nc3ccncc3)ncc2cc(-c2ccccc2)c1=O
Cn1c2nc(Nc3ccncc3)ncc2cc(-c2ccsc2)c1=O
CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4ccccc4)c(=O)n(C)c3n2)cc1
CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4ccsc4)c(=O)n(C)c3n2)cc1
Cn1c2nc(N)ncc2cc(-c2ccsc2)c1=O
CNc1ncc2cc(-c3ccsc3)c(=O)n(C)c2n1
Cn1c2nc(Nc3ccccc3)ncc2cc(-c2cccs2)c1=O
Cn1c2nc(Nc3ccccc3)ncc2cc(-c2ccc(cc2)-c2ccccc2)c1=O
CCn1c2nc(Nc3ccccc3)ncc2cc(-c2ccccc2)c1=O
CCn1c2nc(Nc3ccccc3)ncc2cc(-c2ccsc2)c1=O
CCn1c2nc(Nc3ccncc3)ncc2cc(-c2ccccc2)c1=O
CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4ccccc4)c(=O)n(CC)c3n2)cc1
c1c2c-3c(c(c1O)O)OC(=O)c4c3c(c(c(c4)O)O)OC2=O
Oc1cc2[nH]c(=O)c3cc(O)c(O)cc3c2cc1O
Oc1ccc2c3cc(O)c(O)cc3[nH]c(=O)c2c1O
CCn1c2cc(O)c(O)cc2c2cc(O)c(O)cc2c1=O
CCn1c2cc(O)c(O)cc2c2ccc(O)c(O)c2c1=O
Oc1cc2n(Cc3ccccc3)c(=O)c3cc(O)c(O)cc3c2cc1O
Oc1cc2n(Cc3ccccc3)c(=O)c3c(O)c(O)ccc3c2cc1O
Oc1cc2n(Cc3ccc(cc3)[N+]([O-])=O)c(=O)c3cc(O)c(O)cc3c2cc1O
Oc1ccc2c3cc(O)c(O)cc3n(Cc3ccc(cc3)[N+]([O-])=O)c(=O)c2c1O
Oc1cc2n(Cc3ccc(Cl)c(Cl)c3)c(=O)c3cc(O)c(O)cc3c2cc1O
Oc1ccc2c3cc(O)c(O)cc3n(Cc3ccc(Cl)c(Cl)c3)c(=O)c2c1O
Oc1cc2n(Cc3ccc(cc3)S(=O)(=O)c3ccccc3)c(=O)c3cc(O)c(O)cc3c2cc1O
Oc1ccc2c3cc(O)c(O)cc3n(Cc3ccc(cc3)S(=O)(=O)c3ccccc3)c(=O)c2c1O
Oc1cc2[nH]c3cc(O)c(O)cc3c2cc1O
Oc1ccc2c([nH]c3cc(O)c(O)cc23)c1O
Oc1cc2[nH]c3c(O)c(O)cc(Br)c3c2cc1O
Oc1cc2n(Cc3ccccc3)c3cc(O)c(O)cc3c2cc1O
Oc1cc2n(Cc3ccccc3)c3c(O)c(O)ccc3c2cc1O
Oc1cc2n(C(=O)c3ccccc3)c3cc(O)c(O)cc3c2cc1O
Oc1cc2n(C(=O)c3ccccc3)c3c(O)c(O)ccc3c2cc1O
Oc1cc2n(Cc3cccnc3)c3cc(O)c(O)cc3c2cc1O
Oc1ccc2c3cc(O)c(O)cc3n(CCCc3ccccc3)c2c1O
Oc1cc2n(Cc3ccc(cc3)C#N)c3c(O)c(O)ccc3c2cc1O
Oc1cc2n(Cc3ccc(cc3)C#N)c3c(O)c(O)cc(Br)c3c2cc1O
Oc1cc2n(Cc3ccc(cc3)C(F)(F)F)c3c(O)c(O)ccc3c2cc1O
Oc1cc2n(Cc3c(Cl)cccc3Cl)c3c(O)c(O)ccc3c2cc1O
Oc1cc2n(Cc3ccc(Br)cc3)c3c(O)c(O)ccc3c2cc1O
Cc1cccc(Cn2c3cc(O)c(O)cc3c3ccc(O)c(O)c23)c1
Oc1cc2n(Cc3ccc(cc3)S(=O)(=O)c3ccccc3)c3c(O)c(O)ccc3c2cc1O
Oc1cc2n(C(=O)c3ccc(Br)cc3)c3c(O)c(O)ccc3c2cc1O
Oc1cc2n(C(=O)c3ccc(cc3)-c3ccccc3)c3c(O)c(O)ccc3c2cc1O
Oc1ccc2c3cc(O)c(O)cc3n(C(=O)c3ccc4ccccc4c3)c2c1O
Oc1ccc2c(c1O)n(C(=O)c1cccc(c1)[N+]([O-])=O)c1cc(O)c(O)cc21
Oc1cc2n(C(=O)c3ccc(cc3)C(F)(F)F)c3c(O)c(O)ccc3c2cc1O
Oc1cc2n(C(=O)c3ccc(cc3)C(F)(F)F)c3c(O)c(O)cc(Br)c3c2cc1O
CC(C)(C)c1ccc(cc1)C(=O)n1c2cc(O)c(O)cc2c2ccc(O)c(O)c12
CC(C)(C)c1ccc(cc1)C(=O)n1c2cc(O)c(O)cc2c2c(Br)cc(O)c(O)c12
CS(=O)(=O)c1ccc(cc1)C(=O)n1c2cc(O)c(O)cc2c2ccc(O)c(O)c12
CS(=O)(=O)c1ccc(cc1)C(=O)n1c2cc(O)c(O)cc2c2c(Br)cc(O)c(O)c12
Oc1ccc2c3cc(O)c(O)cc3n(C(=O)CCc3ccccc3)c2c1O
Oc1cc2n(c3cc(O)c(O)cc3c2cc1O)S(=O)(=O)c1ccccc1
Oc1ccc2c3cc(O)c(O)cc3n(c2c1O)S(=O)(=O)c1ccccc1
Oc1cc2n(c3c(O)c(O)ccc3c2cc1O)S(=O)(=O)c1cc(Cl)ccc1Cl
Oc1cc2n(c3c(O)c(O)ccc3c2cc1O)S(=O)(=O)Cc1ccccc1
Oc1ccc2c(c1O)n(c1cc(O)c(O)cc21)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Cn1c2cc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
CNc1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-6.52,-3.49,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CN(C)c1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-6.52,-3.49,;-6.52,-1.95,;-7.85,-1.18,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CCN(CC)CCNc1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-9.18,1.13,;-10.52,.36,;-10.52,-1.18,;-11.85,-1.95,;-13.19,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CCN(CC)CCCNc1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-13.19,-4.26,;-11.85,-3.49,;-11.85,-1.95,;-13.19,-1.18,;-13.19,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CCN(CC)CCCCNc1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-11.85,1.13,;-13.19,.36,;-13.19,-1.18,;-14.52,-1.95,;-14.52,-3.49,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CCN(CC)CCCCCNc1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-15.85,-4.26,;-14.52,-3.49,;-14.52,-1.95,;-15.85,-1.18,;-15.85,.36,;-13.19,-1.18,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CN1CCN(CCCNc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-15.61,-4.58,;-14.52,-3.49,;-14.52,-1.95,;-13.19,-1.18,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-11.85,-3.49,;-13.19,-4.26,)|
CN1CCN(CCCCNc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-17.31,.81,;-15.82,.41,;-14.47,1.16,;-13.16,.36,;-13.19,-1.18,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-14.53,-1.92,;-15.85,-1.13,)|
CN1CCN(CCCCCNc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-18.56,-3.32,;-17.18,-2.64,;-17.09,-1.1,;-15.71,-.41,;-14.43,-1.26,;-12.94,-.86,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-14.52,-2.8,;-15.9,-3.48,)|
Cn1c2cc(NCCCN3CCOCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-9.18,-1.95,;-10.52,-1.18,;-11.85,-1.95,;-13.19,-1.18,;-14.52,-1.95,;-14.52,-3.49,;-13.19,-4.26,;-11.85,-3.49,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
Cn1c2cc(NCCCCN3CCOCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-9.18,-1.95,;-10.52,-1.18,;-11.85,-1.95,;-13.19,-1.18,;-13.05,.36,;-14.31,1.24,;-15.7,.59,;-15.84,-.94,;-14.58,-1.83,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
Cn1c2cc(NCCCn3ccnc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-9.18,-1.95,;-10.52,-1.18,;-11.85,-1.95,;-12.33,-3.41,;-13.87,-3.41,;-14.34,-1.95,;-13.1,-1.04,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
Cn1c2cc(Nc3ccccc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-7.85,.36,;-9.18,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
Cn1c2cc(Nc3ccncc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-7.85,.36,;-9.18,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
COc1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-11.85,2.67,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,)|
CCN(CC)CCOc1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-14.52,7.29,;-14.52,5.75,;-13.19,4.98,;-11.85,5.75,;-10.52,4.98,;-13.19,3.44,;-11.85,2.67,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,)|
CCN(CC)CCCOc1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-15.85,8.06,;-14.52,7.29,;-14.52,5.75,;-15.85,4.98,;-15.85,3.44,;-13.19,4.98,;-13.19,3.44,;-11.85,2.67,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,)|
CN1CCN(CCOc2ccc(Nc3cc4n(C)c(=O)c(cc4cn3)-c3c(Cl)cccc3Cl)cc2)CC1 |(-13.19,9.6,;-13.19,8.06,;-14.52,7.29,;-14.52,5.75,;-13.19,4.98,;-13.19,3.44,;-11.85,2.67,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,;-11.85,5.75,;-11.85,7.29,)|
CN1CCN(CCCOc2ccc(Nc3cc4n(C)c(=O)c(cc4cn3)-c3c(Cl)cccc3Cl)cc2)CC1 |(-18.38,8.29,;-17.09,7.44,;-15.72,8.14,;-14.43,7.29,;-14.52,5.75,;-13.19,4.98,;-13.19,3.44,;-11.85,2.67,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,;-15.9,5.06,;-17.18,5.91,)|
CN1CCN(CC1)c1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-15.85,3.44,;-14.52,2.67,;-13.19,3.44,;-11.85,2.67,;-11.85,1.13,;-13.19,.36,;-14.52,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,)|
Cn1c2cc(Nc3ccc(cc3)N3CCOCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-9.18,-1.95,;-10.52,-1.18,;-10.52,.36,;-9.18,1.13,;-7.85,.36,;-11.85,1.13,;-11.85,2.67,;-13.19,3.44,;-14.52,2.67,;-14.52,1.13,;-13.19,.36,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
CCN(CC)C(=O)c1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-10.52,4.98,;-10.52,3.44,;-11.85,2.67,;-13.19,3.44,;-14.52,2.67,;-11.85,1.13,;-13.19,.36,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,)|
CCN(CC)CCCCNc1cc2[nH]c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-15.85,-1.18,;-14.52,-1.95,;-13.19,-1.18,;-13.19,.36,;-11.85,1.13,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CN1CCN(CCCNc2cc3[nH]c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-15.95,-4.09,;-14.58,-3.37,;-14.52,-1.84,;-13.15,-1.12,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-11.92,-3.49,;-13.28,-4.2,)|
CCN(CC)CCCOc1ccc(Nc2cc3[nH]c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-18.31,-.65,;-18.31,.89,;-16.98,1.66,;-16.98,3.2,;-15.65,3.97,;-15.65,.89,;-14.31,1.66,;-13.04,.79,;-11.65,1.45,;-10.39,.57,;-10.51,-.96,;-9.24,-1.84,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.73,.36,;-8.99,1.23,)|
Cn1c2nc(N)ccc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
CCN(CC)CCCNc1ccc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-13.58,.31,;-13.19,-1.18,;-11.85,-1.95,;-11.85,-3.49,;-13.19,-4.26,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,;-1.18,-1.89,;-1.18,-3.43,;-2.52,-1.12,;-3.85,-1.95,)|
CN1CCN(CCCNc2ccc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)CC1 |(-15.93,-4.12,;-14.6,-3.35,;-14.52,-1.81,;-13.14,-1.11,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,;-1.18,-1.89,;-1.18,-3.43,;-2.52,-1.12,;-3.85,-1.95,;-11.93,-3.49,;-13.31,-4.19,)|
Cn1c2nc(Nc3ccccc3)ccc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-7.85,.36,;-9.18,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
COc1ccc(Nc2ccc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-13.19,.36,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,;-1.18,-1.89,;-1.18,-3.43,;-2.52,-1.12,;-3.85,-1.95,;-7.85,.36,;-9.18,1.13,)|
CCN(CC)CCOc1ccc(Nc2ccc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-18.34,1.74,;-16.85,2.14,;-15.76,1.05,;-16.16,-.44,;-15.07,-1.52,;-14.27,1.45,;-13.19,.36,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,;-1.18,-1.89,;-1.18,-3.43,;-2.52,-1.12,;-3.85,-1.95,;-7.85,.36,;-9.18,1.13,)|
CCN(CC)CCNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-12.59,.48,;-11.1,.88,;-10.01,-.21,;-10.78,-1.54,;-10.01,-2.88,;-8.53,-.61,;-7.19,.16,;-5.86,-.61,;-4.53,.16,;-4.53,1.7,;-3.19,2.47,;-1.86,1.7,;-.52,2.47,;.81,1.7,;2.14,2.47,;2.14,4.01,;.81,4.78,;3.48,4.78,;4.81,4.01,;4.81,2.47,;3.48,1.7,;3.48,.16,;.81,.16,;2.14,-.61,;-.52,-.61,;-.52,-2.15,;-1.86,.16,;-3.19,-.61,)|
Cn1c2nc(Nc3ccc(cc3)N3CCOCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-.52,-2.15,;-.52,-.61,;-1.86,.16,;-3.19,-.61,;-4.53,.16,;-5.86,-.61,;-7.19,.16,;-8.55,-.56,;-9.86,.26,;-9.8,1.8,;-8.44,2.52,;-7.14,1.7,;-11.11,2.62,;-11.11,4.16,;-12.44,4.93,;-13.78,4.16,;-13.78,2.62,;-12.44,1.85,;-4.53,1.7,;-3.19,2.47,;-1.86,1.7,;-.52,2.47,;.81,1.7,;2.14,2.47,;2.14,4.01,;.81,4.78,;3.48,4.78,;4.81,4.01,;4.81,2.47,;3.48,1.7,;3.48,.16,;.81,.16,;2.14,-.61,)|
CCN(CC)C(=O)c1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-13.8,4.21,;-13.8,2.67,;-12.47,1.9,;-12.47,.36,;-13.8,-.41,;-11.11,2.62,;-11.05,4.16,;-9.8,1.8,;-9.86,.26,;-8.55,-.56,;-7.19,.16,;-5.86,-.61,;-4.53,.16,;-4.53,1.7,;-3.19,2.47,;-1.86,1.7,;-.52,2.47,;.81,1.7,;2.14,2.47,;2.14,4.01,;.81,4.78,;3.48,4.78,;4.81,4.01,;4.81,2.47,;3.48,1.7,;3.48,.16,;.81,.16,;2.14,-.61,;-.52,-.61,;-.52,-2.15,;-1.86,.16,;-3.19,-.61,;-7.14,1.7,;-8.44,2.52,)|
COc1cc2ncc(C#N)c(Nc3ccc(Cl)cc3Cl)c2cc1OC
COc1cc2ncnc(Nc3ccc(Cl)cc3Cl)c2cc1OC
COc1cc2nccc(Nc3ccc(Cl)cc3Cl)c2cc1OC
COc1cc2ncc(C#N)c(Oc3ccc(Cl)cc3Cl)c2cc1OC
COc1cc2ncc(C#N)c(Sc3ccc(Cl)cc3Cl)c2cc1OC
COc1cc2ncc(C#N)c(NCc3ccc(Cl)cc3Cl)c2cc1OC
COc1cc2ncc(C#N)c(N(C)c3ccc(Cl)cc3Cl)c2cc1OC
COc1cc2ncc(C=O)c(Nc3ccc(Cl)cc3Cl)c2cc1OC
COc1cccc2ncc(C#N)c(Nc3ccc(Cl)cc3Cl)c12
COc1ccc2ncc(C#N)c(Nc3ccc(Cl)cc3Cl)c2c1
COc1ccc2c(Nc3ccc(Cl)cc3Cl)c(cnc2c1)C#N
COc1cc(OC)c2c(Nc3ccc(Cl)cc3Cl)c(cnc2c1)C#N
CCOc1cc2ncc(C#N)c(Nc3ccc(Cl)cc3Cl)c2cc1OCC
CCCCOc1cc2ncc(C#N)c(Nc3ccc(Cl)cc3Cl)c2cc1OCCCC
COc1cc2ncc(C#N)c(Nc3ccccc3Cl)c2cc1OC
COc1cc2ncc(C#N)c(Nc3ccc(Cl)cc3)c2cc1OC
COc1cc2ncc(C#N)c(Nc3cccc(Cl)c3Cl)c2cc1OC
COc1cc2ncc(C#N)c(Nc3cc(Cl)ccc3Cl)c2cc1OC
COc1cc2ncc(C#N)c(Nc3c(Cl)cccc3Cl)c2cc1OC
COc1cc2ncc(C#N)c(Nc3cc(Cl)cc(Cl)c3)c2cc1OC
COc1cc2ncc(C#N)c(Nc3ccc(Cl)c(Cl)c3)c2cc1OC
COc1cc2ncc(C#N)c(Nc3ccc(Cl)cc3F)c2cc1OC
COc1cc2ncc(C#N)c(Nc3ccc(Cl)cc3Br)c2cc1OC
COc1cc2ncc(C#N)c(Nc3ccc(Cl)cc3I)c2cc1OC
COc1cc2ncc(C#N)c(Nc3ccc(I)cc3Cl)c2cc1OC
COc1cc2ncc(C#N)c(Nc3ccc(Br)cc3Cl)c2cc1OC
Clc1ccc(Nc2c(cnc3cc(OCCCN4CCOCC4)c(OCCCN4CCOCC4)cc23)C#N)c(Cl)c1
COc1cc2ncc(C#N)c(Nc3ccc(Cl)cc3Cl)c2cc1OCCCN1CCOCC1
COc1cc2c(Nc3ccc(Cl)cc3Cl)c(cnc2cc1OCCCN1CCOCC1)C#N
COc1cc2c(Nc3ccc(Cl)cc3Cl)c(cnc2cc1OCCCN1CCN(C)CC1)C#N
COc1cc2c(Nc3ccc(Cl)cc3Cl)c(cnc2cc1OCCCN1CCC(O)CC1)C#N
COc1ccc(Cl)c(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)c1
COc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)c(Cl)cc1Cl
CCOc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)c(Cl)cc1Cl
CCCOc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc2ncc(C#N)c(Nc3cc(O)c(Cl)cc3Cl)c2cc1OC
COc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)c(F)cc1Cl
COc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)c(Br)cc1Cl
COc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)c(C)cc1Cl
COc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)c(Cl)cc1C
COc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)c(C)cc1C
COc1cc(Nc2ncnc3cc(OC)c(OC)cc23)c(Cl)cc1Cl
COc1cc(Nc2ccnc3cc(OC)c(OC)cc23)c(Cl)cc1Cl
COc1ccc(Cl)c(Nc2c(cnc3cc(OCCCN4CCOCC4)c(OC)cc23)C#N)c1
COc1cc(Nc2c(cnc3cc(OCCCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCN4CCOCC4)c(OC)cc23)C#N)c(Br)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCN4CCOCC4)c(OC)cc23)C#N)c(C)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCN4CCOCC4)c(OC)cc23)C#N)c(C)cc1C
COc1cc(Nc2c(cnc3cc(OCCCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1C
COc1cc(Nc2c(cnc3cc(OC)c(OCCCN4CCOCC4)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCCCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC
CCN1CCN(CCCOc2cc3ncc(C#N)c(Nc4cc(OC)c(Cl)cc4Cl)c3cc2OC)CC1
COc1cc(Nc2c(cnc3cc(OCCCN4C[C@H](C)N(C)[C@H](C)C4)c(OC)cc23)C#N)c(Cl)cc1Cl |r|
CCCN1CCN(CCCOc2cc3ncc(C#N)c(Nc4cc(OC)c(Cl)cc4Cl)c3cc2OC)CC1
COc1cc(Nc2c(cnc3cc(OCCCN4CCNCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCN4CCN(CCO)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCN4CCCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCN4CCCCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCN4CCC(O)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCn4nccn4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCn4ccnn4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCn4ccnc4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCNCCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCN(C)CCN(C)C)c(OC)cc23)C#N)c(Cl)cc1Cl
Nc1cc2nc(N)c(cc2cn1)-c1ccccc1
CCNC(=O)Nc1nc2cc(N)ncc2cc1-c1ccccc1
CC(C)(C)NC(=O)Nc1nc2cc(N)ncc2cc1-c1ccccc1
Nc1cc2nc(N)c(cc2cn1)-c1c(Cl)cccc1Cl |(-5.57,-1.95,;-4.23,-1.18,;-2.9,-1.95,;-1.57,-1.18,;-.23,-2.01,;1.1,-1.24,;2.43,-2.01,;1.1,.3,;-.23,1.07,;-1.57,.36,;-2.9,1.13,;-4.23,.36,;2.43,1.07,;3.78,.32,;3.78,-1.22,;5.1,1.11,;5.08,2.65,;3.73,3.4,;2.41,2.61,;1.08,3.38,)|
CCNC(=O)Nc1nc2cc(N)ncc2cc1-c1c(Cl)cccc1Cl |(-.23,-6.63,;1.1,-5.86,;1.1,-4.32,;2.43,-3.55,;3.77,-4.32,;2.43,-2.01,;1.1,-1.24,;-.23,-2.01,;-1.57,-1.18,;-2.9,-1.95,;-4.23,-1.18,;-5.57,-1.95,;-4.23,.36,;-2.9,1.13,;-1.57,.36,;-.23,1.07,;1.1,.3,;2.43,1.07,;3.78,.32,;3.78,-1.22,;5.1,1.11,;5.08,2.65,;3.73,3.4,;2.41,2.61,;1.08,3.38,)|
CC(C)(C)NC(=O)Nc1nc2cc(N)ncc2cc1-c1c(Cl)cccc1Cl |(-.23,-6.63,;1.1,-5.86,;1.1,-7.4,;2.59,-6.26,;1.1,-4.32,;2.43,-3.55,;3.77,-4.32,;2.43,-2.01,;1.1,-1.24,;-.23,-2.01,;-1.57,-1.18,;-2.9,-1.95,;-4.23,-1.18,;-5.57,-1.95,;-4.23,.36,;-2.9,1.13,;-1.57,.36,;-.23,1.07,;1.1,.3,;2.43,1.07,;3.78,.32,;3.78,-1.22,;5.1,1.11,;5.08,2.65,;3.73,3.4,;2.41,2.61,;1.08,3.38,)|
COc1cc(OC)cc(c1)-c1cc2cnc(N)cc2nc1N
CNC(=O)Nc1nc2cc(N)ncc2cc1-c1cc(OC)cc(OC)c1
CCNC(=O)Nc1nc2cc(N)ncc2cc1-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(N)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(N)cc2nc1NC(=O)Nc1ccccc1
COc1cc(OC)cc(c1)-c1cc2cnc(NC(C)=O)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NC(=O)C(F)(F)F)cc2nc1N
COc1cc(OC)cc(c1)-c1cc2cnc(NC(=O)NC(C)(C)C)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCN3CCOCC3)cc2nc1NC(=O)NC(C)(C)C
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1ccccc1
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1cccc(Cl)c1Cl
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(Cl)ccc(Cl)c1Cl |(6.86,-1.2,;5.37,-.8,;4.97,.69,;6.46,.29,;4.28,-1.89,;2.8,-1.49,;1.71,-2.58,;2.4,-0,;.91,.4,;-.42,-.37,;-1.76,.4,;-3.09,-.37,;-4.43,.4,;-5.76,-.37,;-4.43,1.94,;-3.09,2.71,;-1.76,1.94,;-.42,2.71,;.91,1.94,;2.24,2.71,;3.58,1.94,;3.58,.4,;4.91,2.71,;4.91,4.25,;3.58,5.02,;3.58,6.56,;2.24,4.25,;.91,5.02,)|
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(Cl)cccc1Br |(6.86,-1.2,;5.37,-.8,;4.97,.69,;6.46,.29,;4.28,-1.89,;2.8,-1.49,;1.71,-2.58,;2.4,-0,;.91,.4,;-.42,-.37,;-1.76,.4,;-3.09,-.37,;-4.43,.4,;-5.76,-.37,;-4.43,1.94,;-3.09,2.71,;-1.76,1.94,;-.42,2.71,;.91,1.94,;2.24,2.71,;3.58,1.94,;3.58,.4,;4.91,2.71,;4.91,4.25,;3.58,5.02,;2.24,4.25,;.91,5.02,)|
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(F)cccc1F |(6.86,-1.2,;5.37,-.8,;4.97,.69,;6.46,.29,;4.28,-1.89,;2.8,-1.49,;1.71,-2.58,;2.4,-0,;.91,.4,;-.42,-.37,;-1.76,.4,;-3.09,-.37,;-4.43,.4,;-5.76,-.37,;-4.43,1.94,;-3.09,2.71,;-1.76,1.94,;-.42,2.71,;.91,1.94,;2.24,2.71,;2.24,4.25,;.91,5.02,;3.58,5.02,;4.91,4.25,;4.91,2.71,;3.58,1.94,;3.58,.4,)|
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1cc(F)cc(F)c1
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Cc1ccccc1-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
Cc1ccc(cc1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
Cc1cccc(c1C)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
Cc1cc(C)cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
Cc1cc(C)c(c(C)c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(6.24,5.02,;4.91,4.25,;3.58,5.02,;2.24,4.25,;.91,5.02,;2.24,2.71,;3.58,1.94,;3.51,.4,;4.82,2.53,;.91,1.94,;-.42,2.71,;-1.76,1.94,;-3.09,2.71,;-4.43,1.94,;-4.43,.4,;-5.76,-.37,;-3.09,-.37,;-1.76,.4,;-.42,-.37,;.91,.4,;2.4,-0,;2.8,-1.49,;1.71,-2.58,;4.28,-1.89,;5.37,-.8,;6.86,-1.2,;4.97,.69,;6.46,.29,)|
CCN(CC)CCOc1ccc(C)c(c1C)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(7.58,11.95,;6.24,11.18,;6.24,9.64,;7.58,8.87,;8.91,9.64,;4.91,8.87,;4.91,7.33,;3.58,6.56,;3.58,5.02,;4.91,4.25,;4.82,2.53,;3.58,1.94,;3.51,.4,;2.24,2.71,;2.24,4.25,;.91,5.02,;.91,1.94,;-.42,2.71,;-1.76,1.94,;-3.09,2.71,;-4.43,1.94,;-4.43,.4,;-5.76,-.37,;-3.09,-.37,;-1.76,.4,;-.42,-.37,;.91,.4,;2.4,-0,;2.8,-1.49,;1.71,-2.58,;4.28,-1.89,;5.37,-.8,;6.86,-1.2,;4.97,.69,;6.46,.29,)|
CCc1ccccc1-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
CCc1cc(CC)cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
COc1ccccc1-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
COc1cccc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
COc1ccc(cc1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
COc1ccc(cc1OC)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
CCOc1cccc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
CCOc1cc(OCC)cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
CN(C)c1cc(cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C)N(C)C
Cc1c(C)c(C)c(c(C)c1C)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(6.26,4.98,;4.91,4.25,;3.58,5.02,;3.58,6.56,;2.24,4.25,;.91,5.02,;2.24,2.71,;3.58,1.94,;3.51,.4,;4.82,2.53,;6.1,1.67,;.91,1.94,;-.42,2.71,;-1.76,1.94,;-3.09,2.71,;-4.43,1.94,;-4.43,.4,;-5.76,-.37,;-3.09,-.37,;-1.76,.4,;-.42,-.37,;.91,.4,;2.4,-0,;2.8,-1.49,;1.71,-2.58,;4.28,-1.89,;5.37,-.8,;6.86,-1.2,;4.97,.69,;6.46,.29,)|
Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1
O=C1Nc2ccccc2\C1=C\c1cc2CCCCc2[nH]1
Brc1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1
NS(=O)(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1
OC(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1
COc1ccc2\C(=C\c3cc4CCCCc4[nH]3)C(=O)Nc2c1
O=C1Nc2cc(ccc2\C1=C\c1cc2CCCCc2[nH]1)-c1ccccc1
COc1cccc(c1)-c1ccc2\C(=C\c3cc4CCCCc4[nH]3)C(=O)Nc2c1
COc1ccccc1-c1ccc2\C(=C\c3cc4CCCCc4[nH]3)C(=O)Nc2c1
COc1ccc(cc1)-c1ccc2\C(=C\c3cc4CCCCc4[nH]3)C(=O)Nc2c1
Cc1c[nH]c(\C=C2/C(=O)Nc3ccccc23)c1CCC(O)=O
OC(=O)CCc1c(\C=C2/C(=O)Nc3ccccc23)[nH]c2CCCCc12
OC(=O)CCc1c(\C=C2/C(=O)Nc3ccc(Br)cc23)[nH]c2CCCCc12
NS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCC(O)=O)c2c1
OC(=O)CCc1c(\C=C2/C(=O)Nc3ccc(cc23)C(O)=O)[nH]c2CCCCc12
COc1ccc2\C(=C\c3[nH]c4CCCCc4c3CCC(O)=O)C(=O)Nc2c1
OC(=O)CCc1c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccccc2)[nH]c2CCCCc12
COc1cccc(c1)-c1ccc2\C(=C\c3[nH]c4CCCCc4c3CCC(O)=O)C(=O)Nc2c1
COc1ccccc1-c1ccc2\C(=C\c3[nH]c4CCCCc4c3CCC(O)=O)C(=O)Nc2c1
COc1ccc(cc1)-c1ccc2\C(=C\c3[nH]c4CCCCc4c3CCC(O)=O)C(=O)Nc2c1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(Cc2ccc(C)cc2)no1 |r|
CC(C)c1ccc(Cc2noc(n2)[C@H](CCC(N)=O)NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC(C)=O)cc1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(Cc2ccc(Cl)cc2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(Cc2cccc(Cl)c2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(Cc2ccc(Cl)cc2Cl)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(Cc2c(C)cc(C)cc2C)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(Cc2cccc3ccccc23)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(CCc2ccccc2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(C)cc2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(Cl)cc2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2cccc(Cl)c2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2cccc(c2)C(F)(F)F)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(F)cc2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(Br)cc2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(I)cc2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(Br)c(Br)c2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(Cl)c(Br)c2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(I)c(Cl)c2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(I)c(Br)c2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NC(C)(C)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCc1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCCc1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CC(N)=O)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
CC[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CO)c1nc(Cc2ccc(Cl)cc2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CO)c1nc(Cc2ccc(F)cc2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CO)c1nc(Cc2ccc(Br)cc2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CO)c1nc(Cc2ccc(I)cc2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)Cc1ccccc1)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)Cc1cccs1)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)Cc1ccc(F)c(F)c1)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
COc1ccc(CC(=O)N[C@@H](Cc2ccc(OP(O)(O)=O)cc2)C(=O)N[C@@H](C)c2nc(Cc3ccc(cc3)C(F)(F)F)no2)cc1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)Cc1ccc2ccccc2c1)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)Cc1c[nH]c2ccccc12)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(Cc2ccccc2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(Cc2ccc(Cl)c(Cl)c2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(Cc2ccc3ccccc3c2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(Cl)c(Cl)c2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc3ccccc3c2)no1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CO)c1nc(Cc2ccc(Cl)c(Cl)c2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CO)c1nc(Cc2ccc3ccccc3c2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CO)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCc1ccccc1)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCc1ccccc1)c1nc(Cc2ccc3ccccc3c2)no1 |r|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCc1ccccc1)c1nc(Cc2ccc(Cl)c(Cl)c2)no1 |r|
OC[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)Cc1ccccc1)c1nc(Cc2ccc(cc2)C(F)(F)F)no1 |r|
OC[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)Cc1ccccc1)c1nc(Cc2ccc(Cl)c(Cl)c2)no1 |r|
OC[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)Cc1ccccc1)c1nc(Cc2ccc3ccccc3c2)no1 |r|
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(cc2)N2CCOCC2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN3CCN(C)CC3)cc2)C#N)c(Cl)cc1Cl
CCN1CCN(Cc2ccc(cc2)-c2cc3ncc(C#N)c(Nc4cc(OC)c(Cl)cc4Cl)c3s2)CC1
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN3CCNCC3)cc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN3CCN(CCO)CC3)cc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN3CCCCC3)cc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN3CCSCC3)cc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN(C)C)cc2)C#N)c(Cl)cc1Cl
CCCCNCc1ccc(cc1)-c1cc2ncc(C#N)c(Nc3cc(OC)c(Cl)cc3Cl)c2s1
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(cc2)C(=O)N2CCN(C)CC2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(cc2)C(=O)N(C)C)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(cc2)N(C)C)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CCN(C)C)cc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CCN3CCN(C)CC3)cc2)C#N)c(Cl)cc1Cl
CN1CCN(Cc2ccc(cc2)-c2cc3ncc(C#N)c(Nc4ccc(Cl)cc4Cl)c3s2)CC1
CCOc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN3CCN(C)CC3)cc2)C#N)c(Cl)cc1Cl
CN1CCN(Cc2ccc(cc2)-c2cc3ncc(C#N)c(Nc4ccc(Oc5ccccc5)cc4)c3s2)CC1
CN(C)Cc1ccc(cc1)-c1cc2ncc(C#N)c(Nc3ccc(Cl)cc3Cl)c2s1
COc1cc(Nc2c(cnc3cc(sc23)-c2csc(CN3CCN(C)CC3)c2)C#N)c(Cl)cc1Cl
CN1CCN(Cc2cc(cs2)-c2cc3ncc(C#N)c(Nc4ccc(Cl)cc4Cl)c3s2)CC1
CCOc1cc(Nc2c(cnc3cc(sc23)-c2csc(CN3CCN(C)CC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2csc(CN(C)C)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN3CCN(C)CC3)s2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccsc2CN2CCN(C)CC2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCC4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCC4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCCCC4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OC4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCC4CCCCN4C)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(OCC4CCCN(C)C4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc2c(Nc3ccc(Cl)cc3Cl)c(cnc2cc1OCC1CCN(C)CC1)C#N
COc1cc2c(Nc3cc(OC)c(OC)c(OC)c3)c(cnc2cc1OCC1CCN(C)CC1)C#N
COc1ccc(Cl)c(Nc2c(cnc3cc(OCC4CCN(C)CC4)c(OC)cc23)C#N)c1
COc1ccc(C)c(Nc2c(cnc3cc(OCC4CCN(C)CC4)c(OC)cc23)C#N)c1
COc1cc2c(Nc3ccc(C)cc3C)c(cnc2cc1OCC1CCN(C)CC1)C#N
COc1cc(Nc2c(cnc3cc(OCC4CCN(C)CC4)c(OC)cc23)C#N)c(C)cc1C
CCOc1cc(Nc2c(cnc3cc(OCC4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2csc(CN3CCOCC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCOCC3)s2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2cc(CN3CCOCC3)cs2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccsc2CN2CCOCC2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2cscc2CN2CCOCC2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2csc(CN3CCN(C)CC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2csc(CN3CCC(O)CC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCN(C)CC3)s2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCC(O)CC3)s2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCCCC3)s2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCSCC3)s2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3ccc(cc23)-c2csc(CN3CCOCC3)c2)C#N)c(Cl)cc1Cl
COc1cc2c(Nc3cc(OC)c(OC)c(OC)c3)c(cnc2cc1OCCCN1CCN(C)CC1)C#N
COCCOc1cc2ncc(C#N)c(Nc3cc(OC)c(Cl)cc3Cl)c2cc1OCCOC
COCCOc1cc2ncc(C#N)c(Nc3ccc(Cl)cc3Cl)c2cc1OCCOC
COCCOc1cc2ncc(C#N)c(Nc3cc(OC)c(OC)c(OC)c3)c2cc1OCCOC
COCCOc1cc2ncc(C#N)c(Nc3cc(OC)c(Cl)cc3Cl)c2cc1OC
COCCOc1cc2ncc(C#N)c(Nc3ccc(Cl)cc3Cl)c2cc1OC
COCCOc1cc2ncc(C#N)c(Nc3cc(OC)c(OC)c(OC)c3)c2cc1OC
Clc1ccc(Nc2c(cnc3cc4nc[nH]c4cc23)C#N)c(Br)c1
COc1cc(Nc2c(cnc3cc4nc[nH]c4cc23)C#N)c(Br)cc1Cl
COc1ccc(Cl)c(Nc2c(cnc3cc4nc[nH]c4cc23)C#N)c1
COc1cc(Nc2c(cnc3cc4nc[nH]c4cc23)C#N)cc(OC)c1OC
COc1cc(Nc2c(cnc3cc4nc(NCCN5CCOCC5)[nH]c4cc23)C#N)cc(OC)c1OC
COc1ccc(C)c(Nc2c(cnc3cc4nc(NCCN5CCOCC5)[nH]c4cc23)C#N)c1
COc1cc(Nc2c(cnc3cc4nc(CN5CCOCC5)[nH]c4cc23)C#N)cc(OC)c1OC
COc1ccc(Cl)c(Nc2c(cnc3cc4n(CCN5CCOCC5)cnc4cc23)C#N)c1
COc1ccc(C)c(Nc2c(cnc3cc4n(CCN5CCOCC5)cnc4cc23)C#N)c1
COc1cc(Nc2c(cnc3cc4n(CCN5CCOCC5)cnc4cc23)C#N)c(C)cc1Cl
COc1cc(Nc2c(cnc3cc4n(CCN5CCOCC5)cnc4cc23)C#N)c(Br)cc1Cl
COc1cc(Nc2c(cnc3cc4n(CCN5CCOCC5)cnc4cc23)C#N)cc(OC)c1OC
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCN3CCN(C)CC3)cc2nc1N
CCNC(=O)Nc1nc2cc(NCCCN3CCN(C)CC3)ncc2cc1-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCN3CCN(C)CC3)cc2nc1NC(=O)NC(C)(C)C
CCN(CC)CCCNc1cc2nc(NC(=O)NC(C)(C)C)c(cc2cn1)-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCN3CCOCC3)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCN3CCN(C)CC3)cc2nc1NC(=O)NC(C)(C)C
CCN(CC)CCCCNc1cc2nc(N)c(cc2cn1)-c1cc(OC)cc(OC)c1
CCNC(=O)Nc1nc2cc(NCCCCN(CC)CC)ncc2cc1-c1cc(OC)cc(OC)c1
CCN(CC)CCCCNc1cc2nc(NC(=O)NC(C)(C)C)c(cc2cn1)-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCCN3CCOCC3)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCCN3CCN(C)CC3)cc2nc1NC(=O)NC(C)(C)C
CCN(CC)CCCCCNc1cc2nc(NC(=O)NC(C)(C)C)c(cc2cn1)-c1cc(OC)cc(OC)c1
CN1CCN(CCCNc2cc3nc(N)c(cc3cn2)-c2ccccc2)CC1
CN1CCN(CCCNc2cc3nc(NC(=O)NC(C)(C)C)c(cc3cn2)-c2ccccc2)CC1
CN1CCN(CCCNc2cc3nc(NCCCN4CCN(C)CC4)c(cc3cn2)-c2ccccc2)CC1
CCN(CC)CCCCNc1cc2nc(N)c(cc2cn1)-c1ccccc1
CCN(CC)CCCCNc1cc2nc(NC(=O)NC(C)(C)C)c(cc2cn1)-c1ccccc1
CN1CCN(CCCNc2cc3nc(N)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-11.94,-2.96,;-10.6,-2.19,;-10.6,-.65,;-9.27,.12,;-7.94,-.65,;-6.85,.44,;-5.36,.04,;-4.27,1.13,;-2.78,.73,;-1.45,1.5,;-.12,.73,;1.22,1.5,;2.55,.73,;3.88,1.5,;5.22,.73,;3.88,3.05,;2.55,3.82,;1.22,3.05,;-.12,3.82,;-1.45,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,;-7.94,-2.19,;-9.27,-2.96,)|
CCNC(=O)Nc1nc2cc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(2.8,-4.2,;3.88,-3.12,;3.88,-1.58,;5.22,-.81,;6.55,-1.58,;5.22,.73,;3.88,1.5,;2.55,.73,;1.22,1.5,;-.12,.73,;-1.45,1.5,;-2.78,.73,;-4.27,1.13,;-5.36,.04,;-6.85,.44,;-7.94,-.65,;-9.27,.12,;-10.6,-.65,;-10.6,-2.19,;-11.94,-2.96,;-9.27,-2.96,;-7.94,-2.19,;-1.45,3.05,;-.12,3.82,;1.22,3.05,;2.55,3.82,;3.88,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,)|
CN1CCN(CCCNc2cc3nc(NC(=O)NC(C)(C)C)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-11.94,-2.96,;-10.6,-2.19,;-10.6,-.65,;-9.27,.12,;-7.94,-.65,;-6.85,.44,;-5.36,.04,;-4.27,1.13,;-2.78,.73,;-1.45,1.5,;-.12,.73,;1.22,1.5,;2.55,.73,;3.88,1.5,;5.22,.73,;5.22,-.81,;6.55,-1.58,;3.88,-1.58,;3.88,-3.12,;2.55,-3.89,;5.22,-3.89,;3.88,-4.66,;3.88,3.05,;2.55,3.82,;1.22,3.05,;-.12,3.82,;-1.45,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,;-7.94,-2.19,;-9.27,-2.96,)|
CCN(CC)CCCCNc1cc2nc(N)c(cc2cn1)-c1c(Cl)cccc1Cl |(-11.31,1.64,;-9.82,1.24,;-9.42,-.25,;-10.51,-1.34,;-12,-.94,;-7.94,-.65,;-6.85,.44,;-5.36,.04,;-4.27,1.13,;-2.78,.73,;-1.45,1.5,;-.12,.73,;1.22,1.5,;2.55,.73,;3.88,1.5,;5.22,.73,;3.88,3.05,;2.55,3.82,;1.22,3.05,;-.12,3.82,;-1.45,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,)|
CCNC(=O)Nc1nc2cc(NCCCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |(2.55,-3.89,;3.88,-3.12,;3.88,-1.58,;5.22,-.81,;6.55,-1.58,;5.22,.73,;3.88,1.5,;2.55,.73,;1.22,1.5,;-.12,.73,;-1.45,1.5,;-2.78,.73,;-4.27,1.13,;-5.36,.04,;-6.85,.44,;-7.94,-.65,;-9.42,-.25,;-9.82,1.24,;-11.31,1.64,;-10.51,-1.34,;-12,-.94,;-1.45,3.05,;-.12,3.82,;1.22,3.05,;2.55,3.82,;3.88,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,)|
CCN(CC)CCCCNc1cc2nc(NC(=O)NC(C)(C)C)c(cc2cn1)-c1c(Cl)cccc1Cl |(-11.31,1.64,;-9.82,1.24,;-9.42,-.25,;-10.51,-1.34,;-12,-.94,;-7.94,-.65,;-6.85,.44,;-5.36,.04,;-4.27,1.13,;-2.78,.73,;-1.45,1.5,;-.12,.73,;1.22,1.5,;2.55,.73,;3.88,1.5,;5.22,.73,;5.22,-.81,;6.55,-1.58,;3.88,-1.58,;3.88,-3.12,;2.55,-3.89,;5.22,-3.89,;3.88,-4.66,;3.88,3.05,;2.55,3.82,;1.22,3.05,;-.12,3.82,;-1.45,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,)|
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCOCc1ccccc1)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCCOCc1ccccc1)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCCCOCc1ccccc1)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCO)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCCO)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCCCO)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCOCc3ccccc3)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCOCc3ccccc3)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCCOCc3ccccc3)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCO)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCO)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCCO)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCOCc1ccccc1)C(C)=O |c:20|
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCCOCc1ccccc1)C(C)=O |c:20|
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCCCOCc1ccccc1)C(C)=O |c:20|
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCO)C(C)=O |c:20|
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCCO)C(C)=O |c:20|
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCCCO)C(C)=O |c:20|
CCNC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCN3CCN(C)CC3)nc2nc1NC(=O)NC(C)(C)C
CCNC(=O)Nc1nc2nc(NCCCCN(CC)CC)ncc2cc1-c1cc(OC)cc(OC)c1
CCN(CC)CCCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCO)nc2nc1NC(=O)NC(C)(C)C
COc1cccc(Nc2ncnc3cc(OC)c(OC)cc23)c1
COc1cccc(Nc2ncnc3cc(OCCCN4CCOCC4)c(OC)cc23)c1
COc1ccccc1Nc1ncnc2cc(OCCCN3CCOCC3)c(OC)cc12
COc1ccc(Nc2ncnc3cc(OCCCN4CCOCC4)c(OC)cc23)cc1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)c(OC)cc23)c1
CCOc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)c(OC)cc23)c1
COc1ccc(Cl)c(Nc2ncnc3cc(OCC4CCN(C)CC4)c(OC)cc23)c1
COc1cc2c(Nc3cccc4occc34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3c(Cl)ccc4occc34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3cccc4ccoc34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3c(Cl)ccc4ccoc34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3cccc4CCOc34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3cccc4c(Cl)coc34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3cccc4[nH]ccc34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3cccc4n(C)ccc34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3cccc4cc[nH]c34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3cccc4c(Cl)c[nH]c34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3cccc4OCOc34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3c4OCOc4ccc3Cl)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3c4OCOc4ccc3Br)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3c4OCOc4ccc3F)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3cccc4OC(F)(F)Oc34)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3ccc4OCOc4c3)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3cccc4OCCOc34)ncnc2cc1OCCCN1CCOCC1
Clc1ccc2OCOc2c1Nc1ncnc2cc(OCCCN3CCOCC3)ccc12
COc1cc2ncnc(Nc3c4OCOc4ccc3Cl)c2cc1OCCCN1CCOCC1
COc1cc2c(Nc3c4OCOc4ccc3Cl)ncnc2cc1OCC1CCN(C)CC1
COc1cc2c(cc1OCCCN3CCCCC3)ncnc2Nc4c(ccc5c4OCO5)Cl
COc1cc2c(Nc3c4OCOc4ccc3Cl)ncnc2cc1OCc1ccnc(c1)C#N
COc1cc(Nc2c(cnc3ccsc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccccc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN3CCOCC3)cc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2cccc(CN3CCN(C)CC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccccc2CN2CCN(C)CC2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3c(csc23)-c2ccc(CN3CCOCC3)cc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3sc(cc23)-c2ccc(CN3CCOCC3)cc2)C#N)c(Cl)cc1Cl
CN1CCN(Cc2ccc(cc2)-c2cc3ncc(C#N)c(Oc4ccc(Cl)cc4Cl)c3s2)CC1
CN1CCN(Cc2ccc(cc2)-c2cc3ncc(C#N)c(NCc4ccc(Cl)cc4Cl)c3s2)CC1
COc1cc(Nc2c(cnc3cc(sc23)-c2coc(CN3CCN(C)CC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN3CCN(C)CC3)o2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2csc(CN3CCN(C)CC3)n2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN3CCN(C)CC3)cn2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2cccc(CN3CCN(C)CC3)n2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)C#CCN2CCN(C)CC2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(CN(C)C)cn2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(sc23)-c2ccc(cn2)C(=O)N2CCN(C)CC2)C#N)c(Cl)cc1Cl
CN1CCN(Cc2ccc(nc2)-c2cc3ncc(C#N)c(Nc4ccc(Cl)cc4Cl)c3s2)CC1
COc1cc(Nc2c(cnc3cc4cc(OC)c(OCCN5CCOCC5)cc4cc23)C#N)c(C)cc1Cl
COc1cc(Nc2c(cnc3cc4cc(OC)c(OCCN5CCN(C)CC5)cc4cc23)C#N)c(C)cc1Cl
COc1cc(Nc2c(cnc3cc4cc(OC)c(OCCN5CCOCC5)cc4cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc4cc(OC)c(OCCN5CCN(C)CC5)cc4cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc4cc(OC)c(OCCN5CCC(O)CC5)cc4cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc4cc(OC)c(OCCN5CCOCC5)cc4cc23)C#N)c(Cl)cc1C
COc1cc2cc3ncc(C#N)c(Nc4cc(OC)c(OC)c(OC)c4)c3cc2cc1OCCN1CCN(C)CC1
COc1cc2cc3ncc(C#N)c(Nc4cc(OC)c(OC)c(OC)c4)c3cc2cc1OCCN1CCOCC1
COc1cc2cc3ncc(C#N)c(Nc4ccc(Cl)cc4Cl)c3cc2cc1OCCN1CCOCC1
COc1cc(Nc2c(cnc3cc4cc(OCCN5CCOCC5)c(OC)cc4cc23)C#N)c(C)cc1Cl
COc1cc(Nc2c(cnc3cc4cc(OCCN5CCN(C)CC5)c(OC)cc4cc23)C#N)c(C)cc1Cl
COc1cc(Nc2c(cnc3cc4cc(OCCN5CCOCC5)c(OC)cc4cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc4cc(OCCN5CCN(C)CC5)c(OC)cc4cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc4cc(OCCN5CCC(O)CC5)c(OC)cc4cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc4cc(OCCN5CCOCC5)c(OC)cc4cc23)C#N)c(Cl)cc1C
COc1cc(Nc2c(cnc3cc4cc(OCCN5CCC(O)CC5)c(OC)cc4cc23)C#N)c(Cl)cc1C
COc1cc(Nc2c(cnc3cc4cc(OCCN5CCOCC5)c(OC)cc4cc23)C#N)c(Cl)cc1F
COc1cc(Nc2c(cnc3cc4cc(OC)c(OC)cc4cc23)C#N)c(C)cc1Cl
COc1cc2cc3c(Nc4cc(OC)c(OC)c(OC)c4)c(cnc3cc2cc1OCCN1CCN(C)CC1)C#N
COc1cc2cc3c(Nc4cc(OC)c(OC)c(OC)c4)c(cnc3cc2cc1OCCN1CCOCC1)C#N
COc1cc2cc3c(Nc4ccc(Cl)cc4Cl)c(cnc3cc2cc1OCCN1CCOCC1)C#N
COc1cc(Nc2c(cnc3cc(c(OC)cc23)-c2cccc(CN3CCOCC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(c(OC)cc23)-c2ccc(CN3CCOCC3)cc2)C#N)c(Cl)cc1Cl
CCN1CCN(Cc2ccc(cc2)-c2cc3ncc(C#N)c(Nc4cc(OC)c(Cl)cc4Cl)c3cc2OC)CC1
COc1cc(Nc2c(cnc3cc(c(OC)cc23)-c2cccc(CCN3CCOCC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(c(OC)cc23)-c2ccc(CCN3CCOCC3)cc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2cccc(CN3CCOCC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCOCC3)cc2)C#N)c(Cl)cc1Cl
CCN1CCN(Cc2ccc(cc2)-c2ccc3c(Nc4cc(OC)c(Cl)cc4Cl)c(cnc3c2)C#N)CC1
COc1cc(Nc2c(cnc3cc(ccc23)-c2cccc(CCN3CCOCC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CCN3CCOCC3)cc2)C#N)c(Cl)cc1Cl
CCN1CCN(CCc2ccc(cc2)-c2ccc3c(Nc4cc(OC)c(Cl)cc4Cl)c(cnc3c2)C#N)CC1
COc1cc(Nc2c(cnc3cc(ccc23)-c2cccc(CN3CCN(C)CC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCN(C)CC3)cc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCN(CCO)CC3)cc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccccc2CN2CCOCC2)C#N)c(Cl)cc1Cl
COc1cc2ncnc(Nc3cc(OC)c(OC)c(OC)c3)c2cc1OC
CCOc1c(OC)cc(Nc2ncnc3cc(OC)c(OC)cc23)cc1OC
CCCCOc1c(OC)cc(Nc2ncnc3cc(OC)c(OC)cc23)cc1OC
COc1cc2ncnc(Nc3cc(OC)c(OC(C)C)c(OC)c3)c2cc1OC
COc1cc(Nc2ncnc3cc(OC)c(OC)cc23)cc(OC)c1OC(C)(C)C
CCCCCCCCCCCCOc1c(OC)cc(Nc2ncnc3cc(OC)c(OC)cc23)cc1OC
COc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)cc(OC)c1OC
CCOc1c(OC)cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)cc1OC
COc1cc2ncc(C#N)c(Nc3cc(OC)c(OC(C)C)c(OC)c3)c2cc1OC
CCCCCCCCCCCCOc1c(OC)cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)cc1OC
COc1cc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)cc(OC)c1
COc1ccc(Nc2c(cnc3cc(OC)c(OC)cc23)C#N)cc1OC
COc1cc2ncc(C#N)c(Nc3cc(OC)c(OC)c(OC)c3C)c2cc1OC
COc1cc2ncc(C#N)c(Nc3cc(OC)c(OC)c(OC)c3Br)c2cc1OC
COc1cc(Nc2ccnc3cc(OC)c(OC)cc23)cc(OC)c1OC
CCOC(=O)c1cnc2cc(OC)c(OC)cc2c1Nc1cc(OC)c(OC)c(OC)c1
COc1cc(Nc2c(CO)cnc3cc(OC)c(OC)cc23)cc(OC)c1OC
COc1cc(Oc2c(cnc3cc(OC)c(OC)cc23)C#N)cc(OC)c1OC
COc1cc2ncc(C#N)c(NCc3cc(OC)c(OC)c(OC)c3)c2cc1OC
COc1cc(Nc2c(cnc3cc(\C=C\c4ccncc4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4ccncc4)ccc23)C#N)c(Cl)cc1Cl
Clc1ccc(Nc2c(cnc3cc(\C=C\c4ccncc4)ccc23)C#N)c(Cl)c1
COc1cc(Nc2c(cnc3cc(C#Cc4cccnc4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)C#Cc2cccnc2)C#N)c(Cl)cc1Cl
COc1ccc(Cl)c(Nc2c(cnc3cc(\C=C\c4ccncc4)ccc23)C#N)c1
COc1ccc(C)c(Nc2c(cnc3cc(\C=C\c4ccncc4)ccc23)C#N)c1
Cc1ccc(Nc2c(cnc3cc(\C=C\c4ccncc4)ccc23)C#N)c(C)c1
COc1cc(Nc2c(cnc3cc(\C=C\c4ccncc4)ccc23)C#N)cc(OC)c1OC
COc1cc(Nc2c(cnc3cc(ccc23)C#Cc2cccnc2)C#N)cc(OC)c1OC
COc1ccc(Cl)c(Nc2c(cnc3cc(\C=C\c4ccncc4)c(OC)cc23)C#N)c1
COc1cc(Nc2c(cnc3cc(\C=C\c4ccncc4)c(OC)cc23)C#N)cc(OC)c1OC
COc1cc(Nc2c(cnc3cc(C#Cc4cccnc4)c(OC)cc23)C#N)cc(OC)c1OC
COc1cc(Nc2c(cnc3ccc(\C=C\c4ccncc4)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3ccc(\C=C\c4ccncc4)cc23)C#N)cc(OC)c1OC
COc1cc(Nc2c(cnc3ccc(cc23)C#Cc2cccnc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3ccc(cc23)C#Cc2cccnc2)C#N)cc(OC)c1OC
COc1cc(Nc2c(cnc3cc(\C=C\c4cnccn4)ccc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4cnccn4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\n4ccnc4)ccc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\n4ccnc4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4cc[n+]([O-])cc4)ccc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4cc[n+]([O-])cc4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc2c(Nc3cc(OC)c(OC)c(OC)c3)c(cnc2cc1\C=C\c1cc[n+]([O-])cc1)C#N
Clc1ccc(Nc2c(cnc3cc(ccc23)C#Cc2cccnc2)C#N)c(Cl)c1
CCOc1cc(Nc2c(cnc3cc(\C=C\c4ccncc4)ccc23)C#N)c(Cl)cc1Cl
Clc1cc(Cl)cc(CNc2c(cnc3cc(\C=C\c4ccncc4)ccc23)C#N)c1
Clc1ccc(Oc2c(cnc3cc(\C=C\c4ccncc4)ccc23)C#N)c(Cl)c1
CCOC(=O)c1cnc2cc(\C=C\c3ccncc3)ccc2c1Nc1ccc(Cl)cc1Cl
OC(=O)c1cnc2cc(\C=C\c3ccncc3)ccc2c1Nc1ccc(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C=C)ccc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4ccccc4)ccc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4ccc(cc4)-c4ccccc4)ccc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4ccc5ccccc5c4)ccc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4ccccn4)ccc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4cccnc4)ccc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)C#Cc2ccccc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)C#Cc2ccc(cc2)-c2ccccc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)C#Cc2ccccn2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)C#Cc2ccncc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(CCc4ccncc4)ccc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4ccccc4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4cccnc4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#Cc4ccccc4)c(OC)cc23)C#N)c(Cl)cc1Cl
CN1c2c(cnc(n2)Nc3cccc(c3)SC)C=C(C1=O)c4c(cccc4Cl)Cl
Cn1c2nc(Nc3ccc(F)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-.18,-.45,;-.18,1.09,;-1.51,1.86,;-2.84,1.08,;-4.18,1.85,;-5.51,1.08,;-6.84,1.86,;-6.84,3.4,;-8.18,4.17,;-9.51,3.4,;-10.84,4.17,;-9.51,1.86,;-8.18,1.08,;-4.18,3.39,;-2.84,4.16,;-1.51,3.4,;-.18,4.17,;1.16,3.4,;2.49,4.17,;2.49,5.71,;1.16,6.48,;3.83,6.48,;5.16,5.71,;5.16,4.17,;3.83,3.39,;3.83,1.85,;1.16,1.86,;2.49,1.09,)|
CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-13.51,4.17,;-12.18,3.4,;-10.84,4.17,;-9.51,3.4,;-9.51,1.86,;-8.18,1.08,;-6.84,1.86,;-5.51,1.08,;-4.18,1.85,;-4.18,3.39,;-2.84,4.16,;-1.51,3.4,;-.18,4.17,;1.16,3.4,;2.49,4.17,;2.49,5.71,;1.16,6.48,;3.83,6.48,;5.16,5.71,;5.16,4.17,;3.83,3.39,;3.83,1.85,;1.16,1.86,;2.49,1.09,;-.18,1.09,;-.18,-.45,;-1.51,1.86,;-2.84,1.08,;-6.84,3.4,;-8.18,4.17,)|
CCN(CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1)C(C)=O |(-17.51,3.4,;-16.18,4.17,;-14.85,3.4,;-13.51,4.17,;-12.18,3.4,;-10.84,4.17,;-9.51,3.4,;-9.51,1.86,;-8.18,1.08,;-6.84,1.86,;-5.51,1.08,;-4.18,1.85,;-4.18,3.39,;-2.84,4.16,;-1.51,3.4,;-.18,4.17,;1.16,3.4,;2.49,4.17,;2.49,5.71,;1.16,6.48,;3.83,6.48,;5.16,5.71,;5.16,4.17,;3.83,3.39,;3.83,1.85,;1.16,1.86,;2.49,1.09,;-.18,1.09,;-.18,-.45,;-1.51,1.86,;-2.84,1.08,;-6.84,3.4,;-8.18,4.17,;-14.85,1.86,;-13.51,1.09,;-16.18,1.09,)|
Cc1cc(ccc1F)Nc2ncc3c(n2)N(C(=O)C(=C3)c4c(cccc4Cl)Cl)C
O=C(Nc1ccccn1)Nc1cccc2C(=O)N3CCC[C@@H]3c12 |r|
COc1ccc2NC(=O)C(=Cc3cnc[nH]3)c2c1 |w:10.10|
COc1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
NS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
CC(C)NS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
CN(C)S(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
OC(=O)c1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
Fc1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
Clc1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
Brc1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
Cc1cccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c12
OCCc1cccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c12
O=C1Nc2cccc(C3CCNCC3)c2\C1=C\c1[nH]cc2c1CCOC2=O
COc1ccc2\C(=C\c3[nH]cc4c3CCOC4=O)C(=O)Nc2c1
O=C1Nc2cc(ccc2\C1=C\c1[nH]cc2c1CCOC2=O)-c1ccccc1
CN1CCN(CC1)[C@H]1CC[C@@H](CC1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12 |r,wU:10.14,wD:7.7,(-.91,-10.51,;-1.37,-9.04,;-2.87,-8.71,;-3.34,-7.24,;-2.3,-6.11,;-.8,-6.44,;-.33,-7.91,;-2.72,-4.63,;-1.64,-3.52,;-2.06,-2.04,;-3.55,-1.66,;-4.63,-2.76,;-4.21,-4.25,;-4.03,-.2,;-3.12,1.05,;-4.03,2.3,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;-.48,10.15,;1.05,10.33,;1.96,9.09,;1.35,7.68,;-.18,7.5,;-1.75,5.73,;-2.08,4.23,;-5.49,1.82,;-6.82,2.59,;-6.82,4.13,;-8.16,1.82,;-8.16,.28,;-6.82,-.49,;-5.49,.28,)|
CN1CCN(CC1)[C@H]1CC[C@@H](CC1)n1nc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12 |r,wU:10.14,wD:7.7,(-.91,-10.51,;-1.37,-9.04,;-2.87,-8.71,;-3.34,-7.24,;-2.3,-6.11,;-.8,-6.44,;-.33,-7.91,;-2.72,-4.63,;-1.64,-3.52,;-2.06,-2.04,;-3.55,-1.66,;-4.63,-2.76,;-4.21,-4.25,;-4.03,-.2,;-3.12,1.05,;-4.03,2.3,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;-.48,10.15,;1.05,10.33,;1.96,9.09,;1.35,7.68,;-.18,7.5,;-1.75,5.73,;-2.08,4.23,;-5.49,1.82,;-6.82,2.59,;-6.82,4.13,;-8.16,1.82,;-8.16,.28,;-6.82,-.49,;-5.49,.28,)|
CN1CCN(CC1)[C@H]1CC[C@@H](CC1)n1nc(-c2ccc(Nc3ccccc3)cc2)c2c(N)ncnc12 |r,wU:10.14,wD:7.7,(-.91,-10.51,;-1.37,-9.04,;-2.87,-8.71,;-3.34,-7.24,;-2.3,-6.11,;-.8,-6.44,;-.33,-7.91,;-2.72,-4.63,;-1.64,-3.52,;-2.06,-2.04,;-3.55,-1.66,;-4.63,-2.76,;-4.21,-4.25,;-4.03,-.2,;-3.12,1.05,;-4.03,2.3,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;-.51,10.17,;1.01,10.37,;1.96,9.15,;1.37,7.73,;-.15,7.52,;-1.75,5.73,;-2.08,4.23,;-5.49,1.82,;-6.82,2.59,;-6.82,4.13,;-8.16,1.82,;-8.16,.28,;-6.82,-.49,;-5.49,.28,)|
CN1CCN(CC1)[C@H]1CC[C@@H](CC1)n1nc(-c2ccc(cc2)C(=O)c2ccccc2)c2c(N)ncnc12 |r,wU:10.14,wD:7.7,(-.91,-10.51,;-1.37,-9.04,;-2.87,-8.71,;-3.34,-7.24,;-2.3,-6.11,;-.8,-6.44,;-.33,-7.91,;-2.72,-4.63,;-1.64,-3.52,;-2.06,-2.04,;-3.55,-1.66,;-4.63,-2.76,;-4.21,-4.25,;-4.03,-.2,;-3.12,1.05,;-4.03,2.3,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-1.75,5.73,;-2.08,4.23,;-2.56,8.27,;-3.7,9.31,;-1.1,8.74,;-.51,10.17,;1.01,10.37,;1.96,9.15,;1.37,7.73,;-.15,7.52,;-5.49,1.82,;-6.82,2.59,;-6.82,4.13,;-8.16,1.82,;-8.16,.28,;-6.82,-.49,;-5.49,.28,)|
COc1cc(ccc1NC(=O)c1ccccc1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:20.21,wD:23.28,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;.04,7.7,;-.77,10.25,;-1.86,11.33,;-1.46,12.82,;.02,13.22,;1.12,12.14,;.72,10.65,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
COc1cc(ccc1NC(=O)OCc1ccccc1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:22.23,wD:25.30,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;.04,7.7,;-.77,10.25,;.7,10.71,;1.03,12.22,;-.05,13.31,;.36,14.8,;1.85,15.19,;2.93,14.09,;2.52,12.61,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
COc1cc(ccc1NC(=O)Nc1ccccc1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:21.22,wD:24.29,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;.04,7.7,;-.77,10.25,;.7,10.71,;1.24,12.15,;2.76,12.4,;3.74,11.21,;3.2,9.77,;1.68,9.52,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
COc1cc(ccc1NS(=O)(=O)c1ccccc1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:21.22,wD:24.29,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;.44,8.74,;-1.1,7.2,;-.77,10.25,;-1.89,11.3,;-1.53,12.8,;-.06,13.24,;1.06,12.19,;.71,10.69,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
COc1cc(ccc1NS(=O)(=O)Nc1ccccc1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:22.23,wD:25.30,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;.44,8.74,;-1.1,7.2,;-.77,10.25,;.7,10.71,;1.21,12.17,;2.72,12.45,;3.73,11.28,;3.22,9.83,;1.7,9.54,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
COc1cc(ccc1NCc1ccccc1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:19.20,wD:22.27,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;-.77,10.25,;-1.85,11.34,;-1.45,12.82,;.04,13.22,;1.13,12.12,;.72,10.64,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
COc1cc(ccc1NC(=O)CCc1ccccc1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:22.23,wD:25.30,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;.04,7.7,;-.77,10.25,;.72,10.64,;1.13,12.12,;.1,13.28,;.59,14.74,;2.1,15.05,;3.12,13.9,;2.63,12.44,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
COc1cc(ccc1NC(=O)C(C)(C)Cc1ccccc1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:24.25,wD:27.32,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;.04,7.7,;-.77,10.25,;-1.88,11.31,;-.38,11.74,;.72,10.64,;1.13,12.12,;.1,13.28,;.59,14.74,;2.1,15.05,;3.12,13.9,;2.63,12.44,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
COc1cc(ccc1NC(=O)CC(C)(C)c1ccccc1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:24.25,wD:27.32,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;.04,7.7,;-.77,10.25,;.72,10.64,;.72,9.1,;2.25,10.43,;1.13,12.12,;.1,13.28,;.59,14.74,;2.1,15.05,;3.12,13.9,;2.63,12.44,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
COc1cc(ccc1NC(=O)[C@@H]1C[C@H]1c1ccccc1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:23.25,13.15,wD:26.32,11.11,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;.04,7.7,;-.77,10.25,;-1.28,11.7,;.24,11.41,;1.69,11.93,;2,13.43,;3.46,13.92,;4.61,12.89,;4.3,11.38,;2.84,10.9,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
COc1cc(ccc1NC(=O)c1cc2ccccc2o1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |r,wU:23.25,wD:26.32,(.85,5.16,;-.29,6.2,;-1.75,5.73,;-2.08,4.23,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;.04,7.7,;-.77,10.25,;.65,10.85,;.52,12.38,;1.57,13.51,;1.12,14.98,;-.38,15.33,;-1.43,14.2,;-.98,12.73,;-1.78,11.41,;-4.03,2.3,;-3.12,1.05,;-4.03,-.2,;-3.55,-1.66,;-2.06,-2.04,;-1.64,-3.52,;-2.72,-4.63,;-4.21,-4.25,;-4.63,-2.76,;-2.3,-6.11,;-3.34,-7.24,;-2.87,-8.71,;-1.37,-9.04,;-.91,-10.51,;-.33,-7.91,;-.8,-6.44,;-5.49,.28,;-6.82,-.49,;-8.16,.28,;-8.16,1.82,;-6.82,2.59,;-6.82,4.13,;-5.49,1.82,)|
CN1CCN(CC1)[C@H]1CC[C@@H](CC1)n1nc(-c2ccc(NCc3cc4ccccc4[nH]3)cc2)c2c(N)ncnc12 |r,wU:10.14,wD:7.7,(-.91,-10.51,;-1.37,-9.04,;-2.87,-8.71,;-3.34,-7.24,;-2.3,-6.11,;-.8,-6.44,;-.33,-7.91,;-2.72,-4.63,;-1.64,-3.52,;-2.06,-2.04,;-3.55,-1.66,;-4.63,-2.76,;-4.21,-4.25,;-4.03,-.2,;-3.12,1.05,;-4.03,2.3,;-3.55,3.76,;-4.69,4.8,;-4.36,6.3,;-2.89,6.77,;-2.56,8.27,;-1.1,8.74,;-.77,10.25,;.65,10.85,;.52,12.38,;1.57,13.51,;1.12,14.98,;-.38,15.33,;-1.43,14.2,;-.98,12.73,;-1.78,11.41,;-1.75,5.73,;-2.08,4.23,;-5.49,1.82,;-6.82,2.59,;-6.82,4.13,;-8.16,1.82,;-8.16,.28,;-6.82,-.49,;-5.49,.28,)|
COc1ccc(Cl)c(Nc2ncnc3cccc(OC4CCN(C)CC4)c23)c1
COc1ccc(Cl)c(Nc2ncnc3cccc(OC4CCOCC4)c23)c1
CN1CCC(CC1)Oc1cccc2ncnc(Nc3c4OCOc4ccc3Cl)c12
COc1ccc(Cl)c(Nc2ncnc3cc(OC)cc(OCCCN4CCOCC4)c23)c1
COc1ccc(Cl)c(Nc2ncnc3cc(OC)cc(OC4CCN(C)CC4)c23)c1
COc1cc(OC2CCN(C)CC2)c2c(Nc3c4OCOc4ccc3Cl)ncnc2c1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC4CCOCC4)c23)c1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC4CCCCC4)c23)c1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC4CCOC4)c23)c1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC(C)C)c23)c1
C(COc1cc(OC2CCOCC2)c2c(Nc3cccc4OCOc34)ncnc2c1)CN1CCCC1
COc1cc(OC2CCN(C)CC2)c2c(Nc3cccc4OCOc34)ncnc2c1
COc1cc(OC2CCN(C)CC2)c2c(Nc3cccc4OCCOc34)ncnc2c1
C(CN1CCCC1)Oc1cc(OC2CCOCC2)c2c(Nc3cccc4OCOc34)ncnc2c1
Clc1ccc2OCOc2c1Nc1ncnc2cc(OCCCN3CCCC3)cc(OC3CCOCC3)c12
Clc1ccc2OCOc2c1Nc1ncnc2cc(OCCN3CCCC3)cc(OC3CCOCC3)c12
C(CN1CCCC1)Oc1cc(OC2CCOCC2)c2c(Nc3cccc4OCCOc34)ncnc2c1
CN1CCC(COc2cc(OC3CCOCC3)c3c(Nc4c5OCOc5ccc4Cl)ncnc3c2)CC1
Clc1ccc2OCOc2c1Nc1ncnc2cc(OCCOc3ccncc3)cc(OC3CCOCC3)c12
Clc1ccc2OCOc2c1Nc1ncnc2cc(OCCN3CCCC3)cc(N3CCOCC3)c12
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCN(C)CC4)cc(OC4CCOCC4)c23)c1
COc1ccc(Cl)c(Nc2ncnc3cc(OC)c(OC)cc23)c1
Clc1ccc2OCOc2c1Nc1ncnc2cccc(OC3CCNCC3)c12
COc1cc(OC2CCNCC2)c2c(Nc3c4OCOc4ccc3Cl)ncnc2c1
CN1CCN(CCCOc2cc(OC3CCOCC3)c3c(Nc4c5OCOc5ccc4Cl)ncnc3c2)CC1
CN1CCC(COc2cccc3ncnc(Nc4c5OCOc5ccc4Cl)c23)CC1
CC(C)Oc1cc(OC2CCN(C)CC2)c2c(Nc3c4OCOc4ccc3Cl)ncnc2c1
CN1CCC(CC1)Oc1cc(OCCF)cc2ncnc(Nc3c4OCOc4ccc3Cl)c12
CC(C)COc1cc(OC2CCN(C)CC2)c2c(Nc3c4OCOc4ccc3Cl)ncnc2c1
CC(C)Oc1cc(OCCCN2CCCC2)cc2ncnc(Nc3c4OCOc4ccc3Cl)c12
CC(C)Oc1cc(OCCN2CCOCC2)cc2ncnc(Nc3c4OCOc4ccc3Cl)c12
CC(C)Oc1cc(OCCN2CCN(CC2)C(C)=O)cc2ncnc(Nc3c4OCOc4ccc3F)c12
CN1CCN(CC1)CCOc2cc3c(c(c2)OC4CCOCC4)c(ncn3)Nc5c(ccc6c5OCO6)Cl
COc1cc(OCCCN2CCCC2)cc2ncnc(Nc3c4OCOc4ccc3Cl)c12
COc1cc2c(Nc3c4OCOc4ccc3Cl)ncnc2cc1OCCCN1CCCC1
COc1ccc(Cl)c(Nc2ncnc3ccc(OC)c(OC4CCN(C)CC4)c23)c1
COc1ccc(Cl)c(Nc2ncnc3cc(OC)cc(OC)c23)c1
COc1ccc(Cl)c(Nc2ncnc3ccc(OCCCN4CCN(C)CC4)c(OC4CCOCC4)c23)c1
Clc1ccc2OCCOc2c1Nc1ncnc2cc(OCCN3CCCC3)cc(OC3CCOCC3)c12
CN1CCN(CCOc2cc(OC3CCOCC3)c3c(Nc4c(Cl)ccc5OCCOc45)ncnc3c2)CC1
COc1cc(Nc2c(cnc3cc(ccc23)-c2coc(CN3CCN(C)CC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCN(C)CC3)o2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(-c4coc(CN5CCN(C)CC5)c4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(-c4ccc(CN5CCN(C)CC5)o4)c(OC)cc23)C#N)c(Cl)cc1Cl
CN1CCN(Cc2cc(co2)-c2ccc3c(Nc4ccc(Cl)cc4Cl)c(cnc3c2)C#N)CC1
COc1cc(Nc2c(cnc3ccc(cc23)-c2coc(CN3CCN(C)CC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(-c4coc(CN5CCOCC5)c4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(-c4coc(CN(C)C)c4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(-c4coc(CN5CCN(CC5)c5ccccc5)c4)c(OC)cc23)C#N)c(Cl)cc1Cl
CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
CNC(=O)c1cc(Oc2ccc3oc(Nc4ccc(Cl)c(OC[C@@H]5CCCN5C)c4)nc3c2)ccn1 |r|
CN1CCN(CC1)c1ccc(Nc2nccc(n2)N(C(=O)Oc2c(C)cccc2C)c2ccccc2)cc1
COc1ccccc1N(C(=O)Oc1c(C)cccc1C)c1ccnc(Nc2ccc(cc2)N2CCN(C)CC2)n1
COc1ccc(cc1)N(C(=O)Oc1c(C)cccc1C)c1ccnc(Nc2ccc(cc2)N2CCN(C)CC2)n1
CC(C)Oc1cc(F)ccc1N(C(=O)Oc1c(C)cccc1C)c1ccnc(Nc2ccc(cc2)N2CCN(C)CC2)n1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(cc3)N3CCN(C)CC3)n2)c(OC)c1
COc1ccc(OC)c(CN(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(cc3)N3CCN(C)CC3)n2)c1
CN1CCN(CC1)c1ccc(Nc2nccc(n2)N(C(=O)Oc2c(C)cccc2C)c2ccc3ccccc3c2)cc1
CN1CCN(CC1)c1ccc(Nc2nccc(n2)N(C(=O)Oc2c(C)cccc2C)c2ccc(cc2)-c2ccccc2)cc1
CN1CCN(CC1)c1ccc(Nc2nccc(n2)N(C(=O)Oc2c(C)cccc2C)c2cccc(c2)-c2ccccc2)cc1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(N4CCN(C)CC4)c(OC)c3)n2)c(OC)c1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3cc(OC)c(N4CCN(C)CC4)c(OC)c3)n2)c(OC)c1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(N4CCN(C)CC4)c(F)c3)n2)c(OC)c1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(OCCN(C)C)cc3)n2)c(OC)c1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(OCCCN(C)C)cc3)n2)c(OC)c1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(OCCN4CCN(C)CC4)c(F)c3)n2)c(OC)c1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3cc(OC)c(OCCN4CCN(C)CC4)c(OC)c3)n2)c(OC)c1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3cc(OC)c(OCCN4CCOCC4)c(OC)c3)n2)c(OC)c1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(OCCCN4CCCCC4)cc3)n2)c(OC)c1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(OCCCN4CCN(C)CC4)c(OC)c3)n2)c(OC)c1
Cc1cccc(c1OC(=O)N(c2ccc(cc2OC)OC)c3ccnc(n3)Nc4cc(c(c(c4)OC)OCCCN5CCN(CC5)C)OC)C
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(OCCCN4CCN(C)CC4)c(F)c3)n2)c(OC)c1
COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(OCCCN4CCCCC4)c(F)c3)n2)c(OC)c1
CC1(CNc2c1ccc(c2)NC(=O)c3cccnc3NCc4ccncc4)C
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
CC(C)(C)c1cc(NC(=O)Nc2ccc(Cl)cc2)n(n1)-c1cccc(N)c1
CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1cccc(N)c1
CCC(=O)Nc1ccc2c(c1)c(ncn2)Nc3cccc(c3)Br
Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl
Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1ccc(Nc2ncnc3ccc(cc23)[N+]([O-])=O)cc1)C(C)(C)C
Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1ccc(Nc2ncnc3ccc(N)cc23)cc1)C(C)(C)C
CCC(=O)Nc1ccc2ncnc(Nc3ccc(NC(=O)Nc4cc(nn4-c4cccc(C)c4)C(C)(C)C)cc3)c2c1
Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Nc2ncnc3ccc(cc23)[N+]([O-])=O)c1)C(C)(C)C
Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Nc2ncnc3ccc(N)cc23)c1)C(C)(C)C
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
CC(C)(C)c1cc(NC(=O)Nc2ccccc2)n(n1)-c1cccc(N)c1
CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1cccc(c1)[N+]([O-])=O
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F
CCOc1cc2c(cc1NC(=O)/C=C/CN(C)C)c(c(cn2)C#N)Nc3ccc(c(c3)Cl)F
COCCOc1cc2c(cc1OCCOC)ncnc2Nc3cccc(c3)C#C
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
COc1cc2c(cc1OCCCN3CCOCC3)c(ncn2)Nc4ccc(c(c4)Cl)F
OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
[H][C@@]12C[C@@H]([C@H](OC)[C@@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |TLB:11:10:9:4.3.2,17:33:9:4.3.2,THB:24:32:9:4.3.2,5:4:9:10.31.33.32,30:31:9:4.3.2|
CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl
CN1CCC(CC1)COc2cc3c(cc2OC)c(ncn3)Nc4ccc(cc4F)Br
Cc1cc(C)n2B(F)[N+]3=C(CCC(=O)NCCCCC(=O)NCCOc4ccc(Nc5ncnc(n5)-c5cccnc5Nc5cc(NC(=O)c6cccc(c6)C(F)(F)F)ccc5C)cc4)C=CC3=Cc12 |c:8,70,73|
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1ncccc1-c1ncnc(Nc2ccc(OCCNC(=O)COCCOCCOCCOCCN)cc2)n1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1ncccc1-c1cc(Nc2ccc(OCCNC(=O)COCCOCCOCCOCCN)cc2)ncn1
CC(C)[C@H](CO)Nc1nc(Nc2cccc(Cl)c2)c2ncn(C(C)C)c2n1
CC(C)n1cnc2c(Nc3cccc(Cl)c3)nc(NCCO)nc12
OCCNc1nc(Nc2cccc(Cl)c2)c2ncn(CCc3cccc(O)c3)c2n1
OCCNc1nc(Nc2ccccc2)c2ncn(CCc3cccc(O)c3)c2n1
Oc1cccc(CCn2cnc3c(Nc4ccccc4)nc(nc23)C2CCCC2)c1
CP(=O)(C)c1ccc(cc1)Nc2c3c(nc(n2)C4CCCC4)n(cn3)CCc5cccc(c5)O
CC(C)n1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(NCCO)nc12
CC(C)n1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(NC3CCC(N)CC3)nc12 |(2.18,-.85,;.69,-.46,;-.37,-1.57,;.21,1.01,;1.12,2.25,;.21,3.5,;-1.25,3.02,;-2.58,3.8,;-2.58,5.34,;-1.25,6.11,;-1.25,7.65,;.08,8.42,;1.42,7.65,;1.42,6.11,;.08,5.33,;2.75,8.42,;2.87,6.66,;2.75,9.96,;4.08,9.19,;5.42,8.42,;6.75,9.19,;6.75,7.65,;5.42,6.88,;-3.92,3.02,;-3.92,1.48,;-5.25,.71,;-6.59,1.48,;-6.59,3.03,;-7.92,3.8,;-9.25,3.03,;-10.59,3.79,;-9.25,1.48,;-7.92,.71,;-2.58,.71,;-1.25,1.48,)|
CCn1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(NC3CCC(N)CC3)nc12 |(2.18,-.85,;.69,-.46,;.21,1.01,;1.12,2.25,;.21,3.5,;-1.25,3.02,;-2.58,3.8,;-2.58,5.34,;-1.25,6.11,;-1.25,7.65,;.08,8.42,;1.42,7.65,;1.42,6.11,;.08,5.33,;2.75,8.42,;2.87,6.66,;2.75,9.96,;4.08,9.19,;5.42,8.42,;6.75,9.19,;6.75,7.65,;5.42,6.88,;-3.92,3.02,;-3.92,1.48,;-5.25,.71,;-6.59,1.48,;-6.59,3.03,;-7.92,3.8,;-9.25,3.03,;-10.59,3.79,;-9.25,1.48,;-7.92,.71,;-2.58,.71,;-1.25,1.48,)|
CCn1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(nc12)C1CCNCC1
CCn1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(CC3CCNCC3)nc12
CCn1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(CCC3CCNCC3)nc12
CCn1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(CC3CCCNC3)nc12
CCn1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(nc12)[C@H]1CC[C@H](N)CC1 |r,wU:26.28,wD:29.32,(30.94,-9.82,;29.4,-9.81,;28.64,-8.49,;29.54,-7.24,;28.63,-6,;27.17,-6.48,;25.83,-5.71,;25.82,-4.17,;27.15,-3.4,;28.49,-4.17,;29.82,-3.4,;29.82,-1.86,;28.47,-1.09,;27.14,-1.87,;31.15,-1.08,;31.03,-2.56,;31.14,.46,;32.48,-1.85,;33.81,-1.07,;35.15,-1.84,;33.8,-2.61,;33.81,.47,;24.5,-6.48,;24.5,-8.02,;25.83,-8.79,;27.17,-8.02,;23.17,-8.79,;23.17,-10.33,;21.82,-11.1,;20.49,-10.33,;19.16,-11.1,;20.49,-8.79,;21.82,-8.01,)|
CCn1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(C[C@H]3CC[C@H](N)CC3)nc12 |r,wU:25.25,wD:28.29,(-4.33,-3.25,;-3.3,-2.11,;-3.77,-.64,;-2.87,.6,;-3.77,1.85,;-5.24,1.37,;-6.57,2.14,;-6.57,3.68,;-5.24,4.45,;-5.24,5.99,;-3.91,6.76,;-2.57,5.99,;-2.57,4.45,;-3.91,3.68,;-1.24,6.76,;-1.24,5.22,;-1.24,8.3,;.1,5.99,;1.43,6.76,;2.76,5.99,;1.43,5.22,;1.43,8.3,;-7.91,1.37,;-7.91,-.17,;-9.24,-.94,;-10.78,-.94,;-11.55,-2.27,;-13.09,-2.27,;-13.86,-.94,;-15.4,-.94,;-13.09,.4,;-11.55,.4,;-6.57,-.94,;-5.24,-.17,)|
CCn1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(C[C@@H]3CC[C@H](N)CC3)nc12 |r,wD:25.25,28.29,(-4.33,-3.25,;-3.3,-2.11,;-3.77,-.64,;-2.87,.6,;-3.77,1.85,;-5.24,1.37,;-6.57,2.14,;-6.57,3.68,;-5.24,4.45,;-5.24,5.99,;-3.91,6.76,;-2.57,5.99,;-2.57,4.45,;-3.91,3.68,;-1.24,6.76,;-1.24,5.22,;-1.24,8.3,;.1,5.99,;1.43,6.76,;2.76,5.99,;1.43,5.22,;1.43,8.3,;-7.91,1.37,;-7.91,-.17,;-9.24,-.94,;-10.78,-.94,;-11.55,-2.27,;-13.09,-2.27,;-13.86,-.94,;-15.4,-.94,;-13.09,.4,;-11.55,.4,;-6.57,-.94,;-5.24,-.17,)|
CCn1cnc2c(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)nc(CCCCN)nc12
CCn1cnc2c(Nc3ccccc3)nc(nc12)[C@H]1CC[C@H](N)CC1 |r,wU:18.20,wD:21.24,(-4.33,-3.25,;-3.3,-2.11,;-3.77,-.64,;-2.87,.6,;-3.77,1.85,;-5.24,1.37,;-6.57,2.14,;-6.57,3.68,;-5.24,4.45,;-5.24,5.99,;-3.91,6.76,;-2.57,5.99,;-2.57,4.45,;-3.91,3.68,;-7.91,1.37,;-7.91,-.17,;-6.57,-.94,;-5.24,-.17,;-9.24,-.94,;-9.24,-2.48,;-10.57,-3.25,;-11.91,-2.48,;-13.24,-3.25,;-11.91,-.94,;-10.57,-.17,)|
Cc1nc(cc(n1)N1CCN(CCO)CC1)N=C1NCC(S1)C(=O)Nc1c(C)cccc1Cl |w:16.17|
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(\C=C\n3cnc4c(NC5CC5)ncnc34)c2)cc(c1)C(F)(F)F
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(\C=C\n3cnc4cncnc34)c2)cc(c1)C(F)(F)F
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
CN(C)CCOC(=O)c1cc2ccccc2n1Cc1ccccc1
CCN(CC)CCOC(=O)c1cc2ccccc2n1Cc1ccccc1
O=C(OCCN(n1cccc1)n1cccc1)c1cc2ccccc2n1Cc1ccccc1
O=C(OCCN(N1CCCCC1)N1CCCCC1)c1cc2ccccc2n1Cc1ccccc1
CC(CN(C)C)OC(=O)c1cc2ccccc2n1Cc1ccccc1
CN(C)CCOC(=O)c1cc2ccccc2n1-c1ccccc1
CCN(CC)CCOC(=O)c1cc2ccccc2n1-c1ccccc1
O=C(OCCN(n1cccc1)n1cccc1)c1cc2ccccc2n1-c1ccccc1
O=C(OCCN(N1CCCCC1)N1CCCCC1)c1cc2ccccc2n1-c1ccccc1
CC(CN(C)C)OC(=O)c1cc2ccccc2n1-c1ccccc1
CCN(CC)CCOC(=O)c1cc2ccccc2[nH]1
O=C(OCCN(n1cccc1)n1cccc1)c1cc2ccccc2[nH]1
O=C(OCCN(N1CCCCC1)N1CCCCC1)c1cc2ccccc2[nH]1
CC(CN(C)C)OC(=O)c1cc2ccccc2[nH]1
Ic1ccccc1C(=O)Nc1nnc(CCc2ccccc2)s1
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
Clc1cccc(CSc2nnc(NC(=O)c3ccccc3Cl)s2)c1
Clc1ccc(cc1)C(=O)Nc1nnc(SCc2cccc(Cl)c2)s1
Fc1ccc(cc1)C(=O)Nc1nnc(SCc2cccc(Cl)c2)s1
Fc1cccc(CSc2nnc(NC(=O)c3ccccc3Cl)s2)c1
Fc1cccc(CSc2nnc(NC(=O)c3ccc(Cl)cc3)s2)c1
Fc1ccc(cc1)C(=O)Nc1nnc(SCc2cccc(F)c2)s1
Clc1ccccc1C(=O)Nc1nnc(SCc2ccc(Br)cc2)s1
Clc1ccc(cc1)C(=O)Nc1nnc(SCc2ccc(Br)cc2)s1
Fc1ccc(cc1)C(=O)Nc1nnc(SCc2ccc(Br)cc2)s1
Fc1ccc(CSc2nnc(NC(=O)c3ccccc3Cl)s2)cc1
Fc1ccc(CSc2nnc(NC(=O)c3ccc(Cl)cc3)s2)cc1
Fc1ccc(CSc2nnc(NC(=O)c3ccc(F)cc3)s2)cc1
COc1ccc(CSc2nnc(NC(=O)c3ccccc3Cl)s2)cc1
COc1ccc(CSc2nnc(NC(=O)c3ccc(Cl)cc3)s2)cc1
COc1ccc(CSc2nnc(NC(=O)c3ccc(F)cc3)s2)cc1
[O-][N+](=O)c1ccc(CSc2nnc(NC(=O)c3ccccc3Cl)s2)cc1
[O-][N+](=O)c1ccc(CSc2nnc(NC(=O)c3ccc(Cl)cc3)s2)cc1
[O-][N+](=O)c1ccc(CSc2nnc(NC(=O)c3ccc(F)cc3)s2)cc1
Clc1ccccc1C(=O)Nc1nnc(SCc2ccccc2)s1
Clc1ccc(cc1)C(=O)Nc1nnc(SCc2ccccc2)s1
Fc1ccc(cc1)C(=O)Nc1nnc(SCc2ccccc2)s1
O=C(Nc1nnc(CCc2ccccc2)s1)c1ccccc1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1-c1ccc2nc(Nc3ccc(OCCN)cc3)ncc2c1
CC1CN(CC(C)O1)c1nc2ccccn2c(=O)c1N
Nc1nc2cnc(cn2n1)-c1ccccc1
Cc1cccc(C)c1-c1ccc2nc(Nc3ccccc3)nnc2c1
CN1CCN(CCNc2nnc3cc(ccc3n2)-c2c(C)cccc2C)CC1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccccc3)nnc2c1
Cc1cc(C)c(c(C)c1)-c1cc(C)c2nc(Nc3ccccc3)nnc2c1
COc1cccc(F)c1-c1cc(C)c2nc(Nc3ccccc3)nnc2c1
COc1cccc(OC)c1-c1cc(C)c2nc(Nc3ccccc3)nnc2c1
Cc1cccc(C)c1-c1cc2nnc(Nc3ccccc3)nc2c(C)c1C |(25.05,-20.16,;23.71,-20.93,;22.38,-20.16,;21.05,-20.93,;21.05,-22.48,;22.39,-23.24,;22.39,-24.78,;23.71,-22.48,;25.04,-23.25,;26.37,-22.48,;27.71,-23.24,;29.04,-22.46,;30.38,-23.23,;30.39,-24.79,;31.73,-25.55,;31.73,-27.09,;30.41,-27.86,;30.41,-29.4,;31.75,-30.16,;33.08,-29.38,;33.07,-27.84,;29.05,-25.56,;27.71,-24.79,;26.37,-25.56,;26.37,-27.1,;25.04,-24.79,;23.71,-25.56,)|
CN1CCN(CCCNc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)CC1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Cc1cccc(C)c1-c1ccc2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(cc3)C3(CC3)C#N)nnc2c1
Clc1cccc(Cl)c1-c1ccc2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(cc3)C3(CN)CC3)nnc2c1
CC(=O)Nc1nnc2cc(cc(C)c2n1)-c1c(C)cccc1C
Cc1cccc(C)c1-c1cc(C)c2nc(NC(=O)c3ccccc3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc4cccnc34)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccccn3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cnc4ccccc4c3)nnc2c1
Cc1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1
Cc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Cc1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1C
Cc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c(C)c1
Cc1ccc(C)c(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1
Cc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1C
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(F)c(Cl)c3)nnc2c1
Cc1cc(cc2nnc(Nc3ccccc3)nc12)-c1ccccc1Cl
COc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2ccccc2OC)cc1
CCCCc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
COc1ccccc1Nc1nnc2cc(cc(C)c2n1)-c1c(C)cccc1C
COc1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1
COc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
CCOc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(Cl)c3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(Cl)c(Cl)c3)nnc2c1
COc1cc(OC)cc(c1)-c1cc(C)c2nc(Nc3cccc(C)c3)nnc2c1
COc1cc(OC)cc(c1)-c1cc(C)c2nc(Nc3ccc(C)cc3)nnc2c1
COc1cc(OC)cc(c1)-c1cc(C)c2nc(Nc3ccc(C)cc3C)nnc2c1
COc1cc(OC)cc(c1)-c1cc(C)c2nc(Nc3cc(C)ccc3C)nnc2c1
COc1cc(OC)cc(c1)-c1cc(C)c2nc(Nc3ccc(C)c(C)c3)nnc2c1
CCCCc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(OC)cc(OC)c2)cc1
CCOc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(OC)cc(OC)c2)cc1
COc1cc(OC)cc(c1)-c1cc(C)c2nc(Nc3ccncc3)nnc2c1
COc1cc(OC)cc(c1)-c1cc(C)c2nc(Nc3cccc(C)c3C)nnc2c1
COc1cc(OC)cc(c1)-c1cc(C)c2nc(Nc3ccccc3OC)nnc2c1
COc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(OC)cc(OC)c2)cc1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccncc3)nnc2c1
COc1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(Cl)cccc2Cl)c1
COc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(Cl)cccc2Cl)cc1
Cc1cc(cc2nnc(Nc3ccncc3)nc12)-c1c(Cl)cccc1Cl
Cc1cc(cc2nnc(Nc3cccnc3)nc12)-c1c(Cl)cccc1Cl
CCN(CC)CCOc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCOCC4)cc3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCCN4CCCC4)cc3)nnc2c1
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(Cl)cccc1Cl
CN1CCN(CCOc2ccc(Nc3nnc4cc(cc(C)c4n3)-c3c(C)cccc3C)cc2)CC1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(OCCN4CCCC4)c3)nnc2c1
CCN(CC)CCOc1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1
COc1cccc(Cl)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(F)cccc1F
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1ccccn1
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1cncnc1
CN(C)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
COc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cn1
COc1ccc(Cl)cc1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Cc1cc(O)cc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
CN1CCN(CCOc2cccc(Nc3nnc4cc(cc(C)c4n3)-c3c(C)cccc3C)c2)CC1
CN1CCN(CCCOc2cccc(Nc3nnc4cc(cc(C)c4n3)-c3c(C)cccc3C)c2)CC1
CN1CCN(CCCOc2ccc(Nc3nnc4cc(cc(C)c4n3)-c3c(C)cccc3C)cc2)CC1
COc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)noc2C)cc1
CN1CCN(CC1)C(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
CN1CCN(CC1)C(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)noc2C)cc1
Cc1noc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
CN1CCN(CCOc2ccc(Nc3nnc4cc(cc(C)c4n3)-c3c(C)noc3C)cc2)CC1
CN1CC[N+](C)(CCOc2ccc(Nc3nnc4cc(cc(C)c4n3)-c3c(C)noc3C)cc2)CC1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccnc(OCCN4CCCC4)c3)nnc2c1
CN1CCN(CCOc2cccc(Nc3nnc4cc(cc(C)c4n3)-c3c(Cl)cccc3Cl)c2)CC1
CN1CCN(CCOc2ccc(Nc3nnc4cc(cc(C)c4n3)-c3c(Cl)cccc3Cl)cc2)CC1
CN1CCN(CCCOc2ccc(Nc3nnc4cc(cc(C)c4n3)-c3c(Cl)cccc3Cl)cc2)CC1
CN1CCN(CCCOc2cccc(Nc3nnc4cc(cc(C)c4n3)-c3c(Cl)cccc3Cl)c2)CC1
CN1CCN(CC1)C(=O)c1ccc(Nc2n[n+]([O-])c3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(cc3)C(=O)NCCN3CCCC3)nnc2c1
COC(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)o1
COc1ccc(Cl)c(c1)-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(c3)S(N)(=O)=O)nnc2c1
CN(C)CCNC(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(c3)C(=O)NCCN3CCCC3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(o3)C(O)=O)nnc2c1
Cc1cc(cc2nnc(Nc3ccc(C#N)c(OCCN4CCCC4)c3)nc12)-c1c(Cl)cccc1Cl
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(c3)S(=O)(=O)NCCN3CCCC3)nnc2c1
CN1CCN(CC1)C(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)o1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccnc(Cl)c3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(Cl)nc3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(o3)C(=O)NCCN3CCCC3)nnc2c1
CN1CCN(CC1)S(=O)(=O)c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1
CN(C)CCNS(=O)(=O)c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1
CN(C)CCNS(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3nc(cs3)C(=O)NCCN3CCCC3)nnc2c1
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)nc3)nc12)-c1c(Cl)cccc1Cl
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)c(c3)C#N)nc12)-c1c(Cl)cccc1Cl
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(c3)C(=O)NC3CCNC3)nnc2c1
CN1CCN(CC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
CN1CCN(CCCNC(=O)c2cccc(Nc3nnc4cc(cc(C)c4n3)-c3c(C)cccc3C)c2)CC1
CN(C)CCCNC(=O)c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(cc3)S(=O)(=O)NCCCN3CCCC3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(o3)C(=O)NCCCN3CCCC3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ncc(s3)C(=O)NCCN3CCCC3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(c3)S(=O)(=O)N3CCN(CC3)C(=O)OC(C)(C)C)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(c3)S(=O)(=O)N3CCNCC3)nnc2c1
CN(CCN1CCCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(cc3)C(=O)N3CCNCC3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(c3)S(=O)(=O)NCCN3CCNCC3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(cc3)S(=O)(=O)N3CCNCC3)nnc2c1
CN1CCN(CC1)C(=O)c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1
Cc1cccc(C)c1-c1cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc2cc1C |(15.87,-35.45,;14.54,-36.22,;13.2,-35.45,;11.87,-36.22,;11.87,-37.77,;13.21,-38.53,;13.21,-40.07,;14.53,-37.76,;15.86,-38.53,;17.19,-37.76,;18.53,-38.52,;19.86,-37.74,;21.22,-38.51,;21.22,-40.07,;22.56,-40.83,;23.89,-40.06,;25.22,-40.83,;26.55,-40.06,;26.54,-38.52,;27.88,-37.74,;29.21,-38.51,;30.54,-37.73,;31.88,-38.5,;32.04,-40.02,;33.55,-40.34,;34.32,-39,;33.28,-37.86,;25.2,-37.75,;23.87,-38.53,;19.88,-40.85,;18.53,-40.08,;17.2,-40.85,;15.86,-40.08,;14.53,-40.84,)|
Cc1cccc(C)c1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C |(-5.05,5.05,;-6.38,4.28,;-7.71,5.05,;-9.05,4.28,;-9.04,2.74,;-7.71,1.97,;-7.71,.43,;-6.38,2.75,;-5.05,1.97,;-3.72,2.74,;-2.39,1.98,;-1.05,2.77,;.3,1.99,;.31,.43,;1.65,-.33,;2.98,.44,;4.31,-.33,;5.64,.44,;5.63,1.99,;4.29,2.75,;2.96,1.97,;6.96,2.76,;6.19,4.09,;7.73,1.43,;8.3,3.53,;9.63,2.75,;10.97,3.52,;12.3,2.75,;12.46,1.23,;13.97,.91,;14.74,2.24,;13.71,3.39,;-1.03,-.34,;-2.38,.43,;-3.72,-.34,;-5.05,.43,;-6.38,-.34,)|
Cc1cc(cc2nnc(Nc3ccnc(OCCN4CCCC4)c3)nc12)-c1c(Cl)cccc1Cl
Cc1ccccc1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(c3)S(=O)(=O)CCCN3CCCC3)nnc2c1
Cc1cccc(C)c1-c1cc([N+]([O-])=O)c2nc(Nc3ccc(OCCN4CCCC4)cc3)n[n+]([O-])c2c1
Cc1cccc(C)c1-c1cc(N)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
CC(=O)Nc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(C)cccc1C
CC(=O)Nc1ccccc1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C
COc1ccc(Cl)c(c1)-c1cc2nnc(Nc3ccc(cc3)C(=O)N3CCN(C)CC3)nc2cc1C
Cc1cccc(C)c1-c1cc(NS(C)(=O)=O)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
CN1CCN(CC1)C(=O)c1ccc(Nc2nnc3cc(c(C)cc3n2)-c2cnccc2Cl)cc1
CN1CCN(CC1)C(=O)c1ccc(Nc2nnc3cc(c(C)cc3n2)-c2cnccc2C)cc1
Cc1ccncc1-c1cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc2cc1C
CN1CCN(CC1)C(=O)c1ccc(Nc2nnc3cc(c(C)cc3n2)-c2cc(Cl)ccc2C)cc1
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1NS(C)(=O)=O
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1N
Cc1ccsc1-c1cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc2cc1C
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1C(F)(F)F
CN1CCN(CC1)C(=O)c1ccc(Nc2nnc3cc(c(C)cc3n2)-c2cc(O)ccc2Cl)cc1
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1cc(O)ccc1Cl
COc1ccccc1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1CO
Cc1ccc(F)cc1-c1cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc2cc1C
Cc1cccc(C)c1-c1ccc2nc(Nc3ccc(=O)n(CCCN4CCCC4)c3)nnc2c1
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cccc2cc[nH]c12
Cc1cc(cc2nnc(Nc3cccnc3)nc12)N1CCCCC1
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1cccc(Cl)c1Cl
Cc1cc2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2cc1-c1cccc(O)c1
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1cccc(CO)c1
Cc1cc(cc2nnc(Nc3cccnc3)nc12)-c1cc(O)ccc1Cl
Cc1cc(F)ccc1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C
CC(=O)Nc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1c(C)cccc1C
CC(=O)Nc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)N(CCN3CCCC3)C(C)=O)nc12)-c1c(C)cccc1C
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
CC(=O)Nc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1C
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccc(Cl)s1
Cc1cc(cc2nnc(NCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(o3)C(=O)NCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(N)(=O)=O)nc12)-c1cc(O)ccc1Cl
Cc1ccccc1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1NC(=O)NC(C)(C)C
COc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1C
CN(C)CCNC(=O)c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)c1
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccc(CO)s1
Cc1ccccc1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1O
Cc1cc(cc2nnc(Nc3nc(cs3)C(=O)NCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
CC(=O)Nc1cc(cc2nnc(Nc3ccc(o3)C(=O)NCCN3CCCC3)nc12)-c1c(C)cccc1C
Cc1cc(cc2nnc(Nc3ccc(F)nc3)nc12)-c1cc(O)ccc1Cl
Cc1cc(F)ccc1-c1cc2nnc(Nc3ccc(o3)C(=O)NCCN3CCCC3)nc2cc1C
Cc1cc2nc(Nc3cccnc3)nnc2cc1-c1cc(O)ccc1F
CN(C)c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)c1
CC(=O)Nc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cn1
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1Br
COc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cn1
Cc1cc(cc2nnc(Nc3cccc(c3)S(=O)(=O)N3CCNCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2cc1-c1cc(O)ccc1F
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1cc(O)ccc1F
CCOc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1C
Cc1cc(F)ccc1-c1cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc2cc1C
Cc1ccc(cc1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C)C#N
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1cn[nH]c1
COc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1cccc(O)c1
Cc1cc(cc2nnc(NCCCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)C(=O)N3CCNCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1cc(O)ccc1Cl
Oc1ccc(Cl)c(c1)-c1cc(OCCN2CCCC2)c2nc(Nc3cccnc3)nnc2c1
Cc1ccccc1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1OCCO
Cc1cc(cc2nnc(Nc3ccc(nc3)N3CCOCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3cccc(OCCN4CCCC4)c3)nc12)-c1cc(O)ccc1Cl
CC(C)N(CCOCCO)c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C
CC(C)N(CCO)c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C
CN(C)CCNS(=O)(=O)c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)c1
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1N1CCCC(O)C1
Cc1cc(cc2nnc(Nc3ccc(nc3)N3CCNCC3)nc12)-c1cc(O)ccc1Cl
CNc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(C)cccc1C
CN1CCN(CC1)C(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc1
CN(CCN1CCCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc1
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1Nc1cc(O)ccc1Cl
Cc1cc2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2cc1-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(nc3)C(=O)NCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(nc3)C(=O)N3CCN(CCO)CC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(nc3)N3CCN(CCO)CC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)CCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCNCC3)nc12)-c1cc(O)ccc1Cl
CN1CCN(CC1)S(=O)(=O)c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)c1
Oc1ccc(Cl)c(c1)-c1cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc2cc1Cl
Cc1ccc(cc1-c1cc(C)c2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2c1)C#N
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cccc(NS(C)(=O)=O)c1
CC(=O)Nc1cccc(c1)-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
CNc1cccc(c1)-c1cc(C)c2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2c1
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cccc(N)c1
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cc(N)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCNCC3)nc12)-c1c(Cl)cccc1Cl
CC(C)N(CCN1CCCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(Cl)cccc2Cl)cc1
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1ccccc1Cl
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1ccccc1
Cc1cc(cc2nnc(Nc3ccc(cc3)C(=O)N3CCNCC3)nc12)-c1c(Cl)cccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1c(Cl)cccc1Cl
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1cccc(c1)C(N)=O
CN(CCN1CCCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(Cl)cccc2Cl)cc1
Cc1cc(cc2nnc(Nc3ccc(O)cc3)nc12)-c1c(Cl)cccc1Cl
Cc1nc(Nc2nnc3cc(cc(C)c3n2)-c2c(Cl)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Cc1nc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc(n1)N1CCN(CCO)CC1
Cc1nc(Nc2nnc3cc(cc(C)c3n2)-c2c(Cl)cccc2Cl)cc(OCCN2CCCC2)n1
CN1CCN(CC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc1
CC(C)N(CCN1CCCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc1
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)CCCN3CCCC3)nc12)-c1c(Cl)cccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)C3CCNCC3)nc12)-c1cc(O)ccc1Cl
Cc1nc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc(OCCN2CCCC2)n1
CCN(CCN1CCCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc1
CN(CCN1CCOCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc1
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cc(O)ccc1Br
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1c(Cl)ccc(O)c1Cl
Cc1cc(cc2nnc(Nc3cccc(SCCN4CCCC4)c3)nc12)-c1cc(O)ccc1Cl
CCN(CC)CCN(C)Cc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc1
Cc1cc(cc2nnc(Nc3ccc(SCCN4CCCC4)cc3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)C(=O)N3CCS(=O)(=O)CC3)nc12)-c1cc(O)ccc1Cl
CC(C)N(CCO)Cc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc1
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1c(Cl)ccc(O)c1F
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cccc(O)c1F
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1c(O)cccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1ccc(O)c(F)c1
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1c(O)cccc1F
CN(CCN1CCCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(c(C)cc3n2)-c2cc(O)ccc2Cl)cc1
CN(CCN1CCCC1)C(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc1
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(Cl)ccc(O)c1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)CCCN3CCCC3)nc12)-c1c(Cl)ccc(O)c1F
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1c(F)ccc(O)c1F
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)C3CCNCC3)nc12)-c1c(Cl)ccc(O)c1Cl
CC(=O)Oc1ccc(Cl)c(c1)-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Cc1ccc(O)cc1-c1cc(C)c2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2c1
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cc(OC(=O)c2ccccc2)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1cc(OC(=O)c2ccccc2)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)CCCN3CCCC3)nc12)-c1c(Cl)ccc(O)c1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)CCCN3CCCC3)nc12)-c1c(F)ccc(O)c1F
CN(CCN1CCCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(Cl)ccc(O)c2F)cc1
CN(CCN1CCCC1)C(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(Cl)ccc(O)c2F)cc1
Cc1cc(cc2[n+]([O-])nc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(Cl)cccc1Cl
CC(=O)Oc1ccc(Cl)c(c1)-c1cc(C)c2nc(Nc3cccc(OCCN4CCCC4)c3)nnc2c1
Cc1ccc(cc1)C(=O)Oc1ccc(Cl)c(c1)-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1cc(OC(=O)C(C)(C)C)ccc1Cl
CC(C)C(=O)Oc1ccc(Cl)c(c1)-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
CN(CCN1CCCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(Cl)ccc(O)c2Cl)cc1
Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(Sc2ccc(F)cc2)c1=O
CN[C@@H]1CC2OC([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
COCC(=O)Nc1cc(COc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)ccn1
COCC(=O)Nc1cc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)ccn1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)[nH]c23)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ccccc23)n(n1)-c1ccccc1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C)c23)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ncccc23)n(n1)-c1ccccc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(n1)-c1ccccc1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)cnc23)c2ccccc12)C(C)(C)C
Cc1nc2c(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccccc4)C(C)(C)C)c4ccccc34)ccnc2[nH]c1=O
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)c(C)nc23)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)[nH]c23)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C)c23)c2ccccc12)C(C)(C)C
CCn1c2c(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)cc4)C(C)(C)C)c4ccccc34)ccnc2[nH]c1=O
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C(C)C)c23)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C)c23)c(Cl)c1Cl)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)[nH]c23)c2ncccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ncnc3[nH]c(=O)[nH]c23)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(n1)-c1ccc(O)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(n1)-c1ccc(CO)cc1
COc1cc(ccc1CO)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)cnc23)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c(Cl)c2Cl)n(n1)-c1ccc(CO)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(n1)-c1ccc(CO)nc1
Cc1ccc(s1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)cnc23)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)cnc23)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCc2ccnc3[nH]c(=O)cnc23)c2ccccc12)C(C)(C)C
COc1ccc(cn1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C)c23)c2ccccc12)C(C)(C)C
CNS(=O)(=O)Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)cnc23)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(n1)-c1ccc(Cl)cc1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)cnc23)c2ccccc12)C1CC1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)cnc23)c2ccccc12)C1(C)CC1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(n1)-c1ccc(C)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(n1)-c1ccc(cc1)S(C)(=O)=O
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(n1)-c1ccc(Cl)c(Cl)c1
CSc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)cnc23)c2ccccc12)C(C)(C)C
c1cc(cc(c1)n2nccn2)Nc3c(cnc(n3)N[C@@H]4CCCC[C@@H]4N)C(=O)N
CNC(=O)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)cn1
CN1CCN(CC1)C(=O)Cc1ccc(Nc2ncc3C(=O)N(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)cc1
CN1CCN(CC1)c1ccc(Nc2ncc3C(=O)N(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(C)(C)C)ccc2C)cc1
CN1CCC(CC1)NC(=O)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)cc1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1N1CCc2nc(Nc3cncnc3)ncc2C1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1N1CCc2nc(Nc3ccc(cc3)C(=O)NCCO)ncc2C1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1N1CCc2nc(Nc3ccc(cc3)C(=O)N3CCCC3)ncc2C1
Cc1ccc(NC(=O)c2ccc(s2)C(F)(F)F)cc1N1CCc2nc(Nc3ccc(OCCN4CCCC4)cc3)ncc2C1
Cc1ccc(NC(=O)N2CCCCC2)cc1N1CCc2nc(Nc3ccc(OCCN4CCCC4)cc3)ncc2C1
Cc1ccc(NC(=O)CC2CCCC2)cc1N1CCc2nc(Nc3ccc(OCCN4CCCC4)cc3)ncc2C1
CN1CCN(CC1)C(=O)c1ccc(Nc2ncc3C(=O)N(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)cc1
CC(CC(=O)Nc1ccc(C)c(c1)N1CCc2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2C1)C(F)(F)F
CN1CCN(CC1)C(=O)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)cn1
CN1CCN(CC1)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)c3cc(ccn3)C(F)(F)F)ccc2C)cc1
CN1CCC(CC1)NC(=O)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)cn1
CC(CC(=O)Nc1ccc(C)c(c1)N1CCc2nc(Nc3ccc(OCCN4CCCC4)cc3)ncc2C1)C(F)(F)F
CN1CCN(CC1)c1ccc(Nc2ncc3C(=O)N(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2Cl)cc1
CN1CCN(CC1)C(=O)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)CCC(F)(F)F)ccc2C)cc1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1N1CCc2nc(Nc3ccc(cc3)S(=O)(=O)NC3CC3)ncc2C1
CN1CCN(CC1)c1ccc(Nc2ncc3C(=O)N(CCc3n2)c2cc(NC(=O)c3cc(ccn3)C(F)(F)F)ccc2C)cc1
CN1CCN(CC1)C(=O)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)c3cc(ccn3)C(F)(F)F)ccc2C)cc1
CN1CCN(CC1)c1ccc(Nc2ncc3C(=O)N(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2Cl)cc1C
CNC(=O)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2Cl)cc1
CNC(=O)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)ccc2Cl)cc1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1N1CCc2nc(Nc3ccc(cc3)N3CCNCC3)ncc2C1=O
CNC(=O)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)c3cc(ccn3)C(F)(F)F)ccc2Cl)cc1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1N1CCc2nc(Nc3ccc(OCCN4CCCC4)cc3)ncc2C1=O
CN1CCN(CC1)C(=O)c1ccc(Nc2ncc3CN(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)cc1
CN1CCN(CC1)c1ccc(Nc2ncc3C(=O)N(CCc3n2)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)cc1
CN1CCN(Cc2cccc(Nc3ncc4CN(CCc4n3)c3cc(NC(=O)c4cccc(c4)C(F)(F)F)ccc3C)c2)CC1
CN1CCN(CC1)c1ccc(Nc2ncc3C(=O)N(CCc3n2)c2cc(NC(=O)c3cccc(Br)c3)ccc2C)cc1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1N1CCc2nc(Nc3ccc(cc3)C(=O)NCCCN3CCCC3)ncc2C1=O
CC(CC(=O)Nc1ccc(C)c(c1)N1CCc2nc(Nc3ccc(OCCN4CCN(C)CC4)cc3)ncc2C1)C(F)(F)F
COc1cc(ccc1O)-c1ccc2ccc(-c3cccc(c3)C(=O)NCCN(C)C)n2n1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1Nc2cc(cnc2)C(=O)N)C(=O)Nc3cccc(c3)C(F)(F)F
CN1CCC(CC1)Oc1ccc(cc1C(F)(F)F)C(=O)Nc1ccc(C)c(Oc2ccc3NC(=O)Cc3c2)c1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(Nc3cncc(c3)C(N)=O)c2)cc(c1)C(F)(F)F
CCN1CCN(Cc2ccc(NC(=O)Cc3ccc(cc3)-c3ccc4ccncc4c3)cc2C(F)(F)F)CC1
CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(NC(=O)c4cncc(c4)-c4cnn(C)c4)c3)cc2C(F)(F)F)CC1
CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(NC(=O)c4cncc(c4)-c4cccs4)c3)cc2C(F)(F)F)CC1
Oc1cccc(Nc2ccnc3cc(sc23)-c2cccc(CN3CCOCC3)c2)c1
Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C
Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CC[C@@H](CC1)NC(=O)C=C |r,wU:23
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)ccnc2cc1OCCCC(=O)NO
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]ccc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4CC(=O)Nc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]nc(C(=O)NCCN5CCOCC5)c4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4n(C)cnc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4onc(N)c4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cnc4[nH]ncc4c3)n2)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1ccc(O)cc1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]ncc4c3)n2)c2ccccc12)C1CCOC1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)c4[nH]ncc4c3)n2)c2ccccc12)C(C)C
Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccc(CN5CCCC5=O)c4)C(C)(C)C)c4ccccc34)n2)cc2cn[nH]c12
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5OCCOc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
COc1ccc(cn1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]ncc4c3)n2)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3cc(Nc4ccc5[nH]ncc5c4)ncn3)c3ccccc23)n(n1)-c1ccc(=O)n(CCO)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)nc1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc4[nH]ccc34)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc4cc[nH]c34)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4n(C)ccc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4NC(=O)Cc4c3)n2)c2ccccc12)C(C)(C)C
CN1C(=O)Cc2cc(Nc3nccc(Oc4ccc(NC(=O)Nc5cc(nn5-c5ccc(C)cc5)C(C)(C)C)c5ccccc45)n3)ccc12
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc4[nH]ncc34)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]ncc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2cc(Nc3ccc4[nH]ncc4c3)ncn2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4cn[nH]c4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc4cn[nH]c34)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4n(C)ncc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)c4[nH]ncc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(Cl)c4[nH]ncc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4n(CCN5CCOCC5)ncc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]cnc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4ncn(C)c4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cnc4[nH]ccc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4OCOc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4scnc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4ncsc4c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]nnc4c3)n2)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ccc5c4)n3)c3ccccc23)n(n1)-c1ccc(O)cc1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]ccc4c3)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2cc(Nc3ccc4[nH]ncc4c3)ncn2)c2ccccc12)C(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]ncc4c3)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4n(C)ncc4c3)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)c4[nH]ncc4c3)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4n(CCN5CCOCC5)ncc4c3)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]nc(OCCN5CCOCC5)c4c3)n2)c2ccccc12)C(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]nc(OCCN5CCOCC5)c4c3)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]nc(C(=O)N(C)C)c4c3)n2)c2ccccc12)C(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]nc(C(=O)N(C)C)c4c3)n2)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ccc5c4)n3)c3ccccc23)n(n1)-c1cccc(CN2CCCC2=O)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1cccc(CN2CCCC2=O)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5CC(=O)Nc5c4)n3)c3ccccc23)n(n1)-c1cccc(OCCN2CCOCC2)c1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)c3)c3ccccc23)n(n1)-c1cccc(OCCN2CCOCC2)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)c3)c3ccccc23)n(n1)-c1cccc(OCCN2CCOCC2)c1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1cccc(OCCN2CCOCC2)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1cccc(OCCN2CCOCC2)c1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(C)c5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1cccc(OCCN2CCOCC2)c1
Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccc(OCCN5CCOCC5)c4)C(C)(C)C)c4ccccc34)n2)cc2cn[nH]c12
COCCOc1cccc(c1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)c4[nH]ncc4c3)c2)c2ccccc12)C(C)(C)C
CN(C)CCOc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)c4[nH]ncc4c3)c2)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5CCCc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5COCc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5CC(=O)Nc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5c(NC(=O)C5(C)C)c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5CNC(=O)c5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5CS(=O)(=O)Cc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5OCOc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
Cc1cc2cc(Nc3nccc(Oc4ccc(NC(=O)Nc5cc(nn5-c5ccc(OCCN6CCOCC6)cc5)C(C)(C)C)c5ccccc45)n3)ccc2[nH]1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)c3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
Cc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OCCN5CCOCC5)cc4)C(C)(C)C)c4ccccc34)ccn2)cc2cn[nH]c12
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3cc(Nc4ccc5[nH]ncc5c4)ncn3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
Cc1n[nH]c2cc(Nc3nccc(Oc4ccc(NC(=O)Nc5cc(nn5-c5ccc(OCCN6CCOCC6)cc5)C(C)(C)C)c5ccccc45)n3)ccc12
Cc1n[nH]c2ccc(Nc3nccc(Oc4ccc(NC(=O)Nc5cc(nn5-c5ccc(OCCN6CCOCC6)cc5)C(C)(C)C)c5ccccc45)n3)cc12
Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OCCN5CCOCC5)cc4)C(C)(C)C)c4ccccc34)n2)cc2cn[nH]c12
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5n(CCN6CCOCC6)ncc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
Cc1nc2cc(Nc3nccc(Oc4ccc(NC(=O)Nc5cc(nn5-c5ccc(OCCN6CCOCC6)cc5)C(C)(C)C)c5ccccc45)n3)ccc2[nH]1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5oc(=O)[nH]c5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]c(=O)oc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5sncc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5scnc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5ncsc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]nnc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
COc1ccc(cn1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]ccc4c3)n2)c2ccccc12)C(C)(C)C
COc1ccc(cn1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]nc(C(=O)N5CCOCC5)c4c3)n2)c2ccccc12)C(C)(C)C
CC(C)c1cc(NC(=O)Nc2ccc(Oc3cc(Nc4ccc5[nH]ncc5c4)ncn3)c3ccccc23)n(n1)-c1ccc(=O)n(CCO)c1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1ccc(=O)n(CCO)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1ccc(=O)n(CCO)c1
Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(=O)n(CCO)c4)C(C)(C)C)c4ccccc34)n2)cc2cn[nH]c12
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1ccc(=O)n(CCN2CCOCC2)c1
Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(=O)n(CCN5CCOCC5)c4)C(C)(C)C)c4ccccc34)n2)cc2cn[nH]c12
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5CC(=O)Nc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)nc1
Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OCCN5CCOCC5)nc4)C(C)(C)C)c4ccccc34)n2)cc2cn[nH]c12
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5n(CCN6CCOCC6)ncc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)nc1
CC(=O)Nc1cc(COc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)ccn1
CC(=O)Nc1cc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)ccn1
Nc1ccc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1NC(=O)c1cccc2c(N)nccc12
Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1 |(-1,-2.52,;-1.47,-1.05,;-2.94,-.58,;-2.94,.96,;-1.47,1.44,;-.56,.19,;.98,.19,;1.74,1.52,;.97,2.85,;3.28,1.52,;4.06,.18,;5.6,.18,;3.29,-1.15,;1.75,-1.15,;.97,-2.48,;-4.18,1.87,;-4.2,3.41,;-5.54,4.16,;-6.87,3.37,;-6.84,1.82,;-5.5,1.08,;-4.18,-1.48,;-5.52,-.72,;-6.85,-1.5,;-6.84,-3.04,;-8.17,-3.82,;-5.49,-3.8,;-4.17,-3.02,)|
Nc1c(c(nn1-c1ccccc1)-c1ccncc1)-c1ccc(F)cc1
Nc1c(c(nn1-c1ccc(Cl)cc1)-c1ccncc1)-c1ccc(F)cc1
COc1ccc(cc1)-n1nc(c(c1N)-c1ccc(F)cc1)-c1ccncc1
Nc1c(c(nn1-c1ccc(cc1)[N+]([O-])=O)-c1ccncc1)-c1ccc(F)cc1
Cc1ccc(cc1)-n1nc(c(c1N)-c1ccc(F)cc1)-c1ccncc1
Nc1c(c(nn1-c1ccc(cc1)C#N)-c1ccncc1)-c1ccc(F)cc1
Nc1c(c(nn1-c1ccc(cc1)C(F)(F)F)-c1ccncc1)-c1ccc(F)cc1
NC(=O)c1c(N)n(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl |(-5.26,-51.04,;-3.93,-51.81,;-3.93,-53.35,;-2.59,-51.04,;-1.13,-51.51,;-.66,-52.98,;-.22,-50.28,;-1.13,-49.02,;-2.59,-49.5,;-3.84,-48.59,;-3.86,-47.06,;-5.2,-46.3,;-6.52,-47.09,;-6.5,-48.64,;-5.16,-49.39,;1.32,-50.28,;2.08,-48.95,;1.31,-47.62,;3.62,-48.94,;4.4,-50.28,;5.94,-50.28,;3.63,-51.61,;2.09,-51.61,;1.32,-52.95,)|
CCOC(=O)c1c(N)n(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl |(15.66,-51.66,;16.99,-52.43,;18.32,-51.66,;19.66,-52.43,;19.66,-53.97,;20.99,-51.66,;22.46,-52.13,;22.93,-53.6,;23.37,-50.89,;22.46,-49.64,;20.99,-50.12,;19.75,-49.21,;19.73,-47.68,;18.38,-46.92,;17.06,-47.71,;17.08,-49.26,;18.43,-50,;24.91,-50.89,;25.67,-49.57,;24.89,-48.23,;27.2,-49.56,;27.98,-50.9,;29.52,-50.9,;27.21,-52.23,;25.67,-52.23,;24.9,-53.56,)|
NC(=O)c1c(N)n(nc1-c1ccncc1)-c1ccccc1
Nc1c(C(O)=O)c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1 |(13.17,-1.44,;12.69,.03,;11.23,.5,;9.89,-.27,;8.56,.5,;9.89,-1.81,;11.23,2.04,;12.69,2.52,;13.6,1.27,;15.14,1.27,;15.91,2.6,;15.13,3.93,;17.44,2.6,;18.22,1.26,;19.76,1.27,;17.45,-.07,;15.91,-.07,;15.14,-1.4,;9.98,2.95,;9.97,4.49,;8.62,5.24,;7.3,4.45,;7.32,2.9,;8.67,2.16,)|
Nc1cc(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1 |(26.44,-.46,;25.97,1,;24.5,1.48,;24.5,3.02,;25.97,3.49,;26.88,2.24,;28.42,2.24,;29.18,3.57,;28.41,4.9,;30.72,3.57,;31.5,2.24,;33.04,2.24,;30.72,.9,;29.18,.9,;28.41,-.43,;23.26,3.92,;23.24,5.46,;21.9,6.21,;20.57,5.42,;20.6,3.88,;21.94,3.13,)|
Clc1cc(Cl)c(N\N=C\c2ccncc2)c(Cl)c1
Fc1ccc(cc1)-c1cn(nc1-c1ccncc1)-c1ccc(cc1)C(F)(F)F
COc1ccc(CCCC(=O)NCc2c[nH]c3nc(N)[nH]c(=O)c23)cc1OC
Cc1ccc(s1)C(=O)NCc1c[nH]c2nc(N)[nH]c(=O)c12
COc1cccc(c1)-c1cn(-c2ccc(CCN3CCC(O)CC3)cc2)c2ncnc(N)c12
CN1CCN(CC1)c2ccc(cc2)Nc3ncc(c(n3)Nc4ccccc4NC(=O)C=C)Cl
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C1CC1
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1CC
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1Br
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1I
CN1CCN(CC1)c1ccc(Nc2ncc(-c3cccs3)c(Nc3ccccc3NC(=O)C=C)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(c(Nc3ccccc3NC(=O)C=C)n2)-c2ccc(Oc3ccccc3)cc2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(c(Nc3ccccc3NC(=O)C=C)n2)-c2ccc(cc2)C(C)=O)cc1
COc1ccc(cn1)-c1cnc(Nc2ccc(cc2)N2CCN(C)CC2)nc1Nc1ccccc1NC(=O)C=C
CN1CCN(CC1)c1ccc(Nc2ncc(-c3ccoc3)c(Nc3ccccc3NC(=O)C=C)n2)cc1
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)nc2ccsc12
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)nc2ccoc12
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)nc(N)c1Cl
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)nc2sccc12
CN1CCN(CC1)c1ccc(Nc2ncc(OCc3ccc(C)cc3)c(Nc3ccccc3NC(=O)C=C)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(OCc3ccc(Oc4ccccc4)cc3)c(Nc3ccccc3NC(=O)C=C)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(OCc3c(C)cccc3Cl)c(Nc3ccccc3NC(=O)C=C)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)c(Nc3ccccc3NC(=O)C=C)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3ccc(Oc4ccccc4)cc3)c(Nc3ccccc3NC(=O)C=C)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3c(C)cc(Cl)cc3Cl)c(Nc3ccccc3NC(=O)C=C)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3c(C)cc(C)cc3Cl)c(Nc3ccccc3NC(=O)C=C)n2)cc1
COc1cc(C)c(NC(=O)c2cnc(Nc3ccc(cc3)N3CCN(C)CC3)nc2Nc2ccccc2NC(=O)C=C)cc1OC
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3c(C)cc(cc3Cl)C#N)c(Nc3ccccc3NC(=O)C=C)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3cc(C)cc(Cl)c3)c(Nc3ccccc3NC(=O)C=C)n2)cc1
CCc1ccccc1NC(=O)c1cnc(Nc2ccc(cc2)N2CCN(C)CC2)nc1Nc1ccccc1NC(=O)C=C
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C(=O)Nc1c(Cl)cccc1Cl
C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C(=O)Nc1c(C)cccc1C
COc1cc(OC)c(Cl)c(NC(=O)c2cnc(Nc3ccc(cc3)N3CCN(C)CC3)nc2Nc2ccccc2NC(=O)C=C)c1Cl
C=CC(=O)Nc1cccc(C)c1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1Cl
C=CC(=O)Nc1ccc(C)cc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1Cl
C=CC(=O)Nc1cc(C)ccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1Cl
C=CC(=O)Nc1c(C)cccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1Cl
C=CC(=O)Nc1ccc(C)cc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C(=O)Nc1c(C)cccc1Cl
C=CC(=O)Nc1cccc(C)c1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C(=O)Nc1c(C)cccc1Cl
C=CC(=O)Nc1ccc(C(C)C)cc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C(=O)Nc1c(C)cccc1Cl
C=CC(=O)Nc1cccc(F)c1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1Cl
C=CC(=O)Nc1c(F)cccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1Cl
C=CC(=O)Nc1cc(F)ccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1Cl
C=CC(=O)Nc1ccc(F)cc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C(=O)Nc1c(C)cccc1Cl
C=CC(=O)Nc1cccc(F)c1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C(=O)Nc1c(C)cccc1Cl
CN1CCN(CC1)c1cccc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)c(Nc3ccccc3NC(=O)C=C)n2)c1
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)c(Nc3ccccc3NC(=O)C=C)n2)cc1C
C=CC(=O)Nc1ccc(C)cc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)nc2ccsc12
C=CC(=O)Nc1ccc(C)cc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)nc2ccoc12
CCC(=O)Nc1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3)N4CCN(CC4)C)C(=O)Nc5c(cccc5Cl)C
C=CC(=O)Nc1cccc(CNc2nc(Nc3ccc(N4CCN(C)CC4)cc3)ncc2C(=O)Nc2c(C)cccc2Cl)c1
C=CC(=O)Nc1ccccc1CNc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C(=O)Nc1c(C)cccc1Cl
C=CC(=O)Nc1ccc(CNc2nc(Nc3ccc(N4CCN(C)CC4)cc3)ncc2C(=O)Nc2c(C)cccc2Cl)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)c(Nc3ccccc3NS(=O)(=O)C=C)n2)cc1
CN(C)C\C=C\C(=O)Nc1ccccc1Nc1nc(Nc2ccc(cc2)N2CCN(C)CC2)ncc1C(=O)Nc1c(C)cccc1Cl
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)c(Nc3ccc(NC(=O)C=C)cc3)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)c(Nc3cccc(NC(=O)C=C)c3)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)c(Nc3ccccc3NC(=O)CCl)n2)cc1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(O)=O
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCN4CCOCC4)C#C)n3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C
Fc1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCN4CCOCC4)C#C)n3)c3ccccc23)cc(c1)N1CCOCC1
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(c1)S(=O)(=O)C1CC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
CNC(=O)c1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCN4CCOCC4)C#C)n3)c3ccccc23)c1OC)C(C)(C)C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c(Cl)c3Cl)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
CNC(=O)c1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(OCCOCCOCCOC)c4)n3)c3ccccc23)c1OC)C(C)(C)C
COCCOCCOCCOCCOCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OCCOCCOCCN(C)C)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC(F)F)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OCCOCCOCCN2CCOCC2)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(C(N)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
CNC(=O)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(OCCOCCOCCOC)c4)n3)c3ccccc23)cc(c1)C(C)(C)C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(NS(C)(=O)=O)cc(c4)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCOCC1
CNC(=O)c1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(OCCOCCOCCOC)c4)c3)c3ccccc23)c1OC)C(C)(C)C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NC5CC5)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCCO)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCC(=O)OC)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
CNC(=O)c1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCN4CCOCC4)C#C)c3)c3ccccc23)c1OC)C(C)(C)C
COCCOCCOCCOCCOCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCCN(C)C)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCOCC1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCN4CCOCC4)C#C)c3)c3ccccc23)cc(cc1C(N)=O)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCN4CCOCC4)C#C)c3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NC5COC5)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C#C
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C#C
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C#C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(N)(=O)=O)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)N[C@H](C)CN4CCOCC4)C#C)n3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C |r|
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)N[C@@H](C)CN4CCOCC4)C#C)n3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C |r|
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1Cl
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(-c5nnco5)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4)C(C)(C)C)C(N)=O)c4ccccc34)ccn2)cc(c1)C#C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCN4CCOCC4)C#C)c3)c3ccccc23)cc(NS(C)(=O)=O)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCCN1CCOCC1
COCCOCCOC[C@H](C)NC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C#C |r|
COCCOCCOC[C@@H](C)NC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C#C |r|
CCOc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(OCCOCCOCCOC)c4)n3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(-c5cnn[nH]5)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)c3)c3ccccc23)cc(cc1C(=O)NC1COC1)C(C)(C)C
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCCN(C)C)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NC5COC5)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCN(C)CC1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(NCc4ccccn4)c3)c3ccccc23)cc(cc1C(=O)NC1COC1)C(C)(C)C
COc1cccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NC5COC5)c4OC)C(C)(C)C)c4ccccc34)ccn2)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4-c4ccccc4)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(=O)(=O)N5CCOCC5)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OCCOCCOCCO)c1
COc1cc(CO)cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)c1
CNC(=O)c1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(CO)cc(OC)c4)c3)c3ccccc23)c1OC)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCC(=O)N1CCOCC1
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CO)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C#C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCCN4CCOCC4)C#C)c3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCC(C)(C)N1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCSCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCS(=O)(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCOC(C)(C)C1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1C[C@H](C)O[C@H](C)C1 |r|
COCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCS(=O)(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
NC(=O)C(=C\c1cccc(c1)-n1cc(-c2ccc(Cl)cc2)c2c(N)ncnc12)\C#N
CN(C)C(=O)C(=C\c1cccc(c1)-n1cc(-c2ccc(Cl)cc2)c2c(N)ncnc12)\C#N
Nc1ncnc2n(cc(-c3ccc(Cl)cc3)c12)-c1cccc(\C=C(/C#N)C(=O)N2CCC2)c1
Nc1ncnc2n(cc(-c3ccc(Cl)cc3)c12)-c1cccc(\C=C(/C#N)C(=O)N2CC(O)C2)c1
CN1CCN(CC1)C(=O)C(=C\c1cccc(c1)-n1cc(-c2ccc(Cl)cc2)c2c(N)ncnc12)\C#N
CC(C)(CO)NC(=O)C(=C\c1cccc(c1)-n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12)\C#N
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCOCC1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(c3)C(N)=O)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)(C)C
COc1cc(ccc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)n1)C(=O)NCCO
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)C(=O)NCCN(C)C)n2)c2ccccc12)C(C)C
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(F)(F)F)C(=O)NCCN4CCOCC4)n3)c3ccccc23)n(n1)-c1ccc(C)cc1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)nc4)C(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)cc4)C(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(c1)C(=O)N1CCOCC1
COc1ccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(CC(C)C)nn4-c4ccc(C)cc4)c4ccccc34)n2)cc1C(=O)NCCN1CCOCC1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2cc(Nc3cc(OC)cc(c3)C(=O)NCCN3CCOCC3)ncn2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)C(=O)NCCN3CCOCC3)c2)c2ccccc12)C(C)C
CNC(=O)c1cccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)c1
CCCNC(=O)c1cccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)cc4)C(C)(C)C)c4ccccc34)n2)c1
CN(C)CCNC(=O)c1cccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)c1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cccc(c4)C(=O)NCCN4CCOCC4)n3)c3ccccc23)n(n1)-c1ccc(C)cc1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C1(C)COC1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C1(C)COC1
Cc1csc(c1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)(C)C
CN1CCN(CCNC(=O)c2cccc(Nc3nccc(Oc4ccc(NC(=O)Nc5cc(nn5-c5ccc(C)cc5)C(C)(C)C)c5ccccc45)n3)c2)CC1
CN(C)C(=O)c1cccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(c3)C(=O)N3CCOCC3)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)C)c3ccccc23)n1)C(=O)NCCN(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(ccc3OC)C(=O)NCCN(C)C)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)C)c3ccccc23)n1)C(=O)NCCN1CCOCC1
COc1ccc(cc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)n1)C(=O)NCCN1CCOCC1
COc1ccc(cc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)C)c3ccccc23)n1)C(=O)NCCO
COc1ccc(cc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)n1)C(=O)NCCO
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(ccc3OC)C(=O)NCCO)n2)c2ccccc12)C(C)C
COc1cc(ccc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)C)c3ccccc23)n1)C(=O)NCCN(C)C
COc1cc(ccc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)C)c3ccccc23)n1)C(=O)NCCN1CCOCC1
COc1cc(ccc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)n1)C(=O)NCCN1CCOCC1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(cc3OC)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)C
COc1cc(ccc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)C)c3ccccc23)n1)C(=O)NCCO
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)cc(c3)C(N)=O)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)C(N)=O)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(Br)cc(c3)C(N)=O)n2)c2ccccc12)C(C)(C)C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN(C)C
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(C)cc(c4)C(=O)NCCN4CCOCC4)n3)c3ccccc23)n(n1)-c1ccc(C)cc1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(F)(F)F)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
CCc1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(c4)C(=O)NCCN4CCOCC4)n3)c3ccccc23)n(n1)-c1ccc(C)cc1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C4CC4)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C4(C)CC4)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)(C)C
COCCOc1cccc(c1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)(C)C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)c(C)c4)C(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)nc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C1CCCO1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C1CCOC1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(Cl)cc(c4)C(=O)NCCN4CCOCC4)n3)c3ccccc23)n(n1)-c1ccc(C)cc1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(Cl)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(Br)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)(C)C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCO
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCO
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)C(=O)NCCO)n2)c2ccccc12)C(C)C
COCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(OC)c1
COCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(c1)C(=O)N(C)CCN1CCOCC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(c1)C(=O)N1CCN(C)CC1
COc1ccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc1C(=O)NCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)ncn2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)ncn2)cc(c1)C(=O)NCCN1CCOCC1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)=C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2cc(Nc3cc(OC)cc(c3)C(=O)NCCN3CCOCC3)ncn2)c(C)c1C)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(=O)NCCN3CCOCC3)C#C)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(=O)NCCN3CCOCC3)C#C)n2)c2ccccc12)C(C)(C)C(F)(F)F
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(=O)NCCN3CCOCC3)C#C)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(=O)NCCN3CCOCC3)C#C)n2)c2ccccc12)C(C)(C)[N+]#[C-]
CN(C)c1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(=O)NCCN3CCOCC3)C#C)n2)c2ccccc12)C(C)(C)C
C[C@@H](CN1CCOCC1)NC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C |r|
C[C@H](CN1CCOCC1)NC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C |r|
COCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C
COC[C@H](C)NC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C |r|
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCN4CCOCC4)C#C)n3)c(Cl)c2Cl)n(n1)-c1ccc(C)cc1
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCn1c2cc(Nc3ncc(CCN(C)C)s3)ncc2cc(-c2ccccc2)c1=O
CCN(CC)CCOc1cnc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCn1c2cc(Nc3ccc(cn3)C(=O)N3CCOCC3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3cc(nc(C)n3)N3CCN(CCO)CC3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3cnccn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccccn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ncc(C)s3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ncc(C)o3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(-c2ccsc2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(-c2cccs2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C2CCCCC2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C(C)C)c1=O
CCN(CC)CCOc1ccc(Nc2cc3[nH]c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCN(C)CC4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCOC4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(-c4ccccc4)c(=O)c(cc3cn2)C(C)C)nc1
CCc1cc2cnc(Nc3ccc(C)cn3)cc2n(CC)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(CC(C)C)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C#CC)c1=O
CCN(CC)CCOc1ccc(Nc2cc3n(C(C)C)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCCC4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CCOC)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCC4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(-c2ccc(F)cc2)c1=O
CCN(CC)CCOc1ccc(Nc2cc3n(C4CC4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCn1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(-c2cccc(F)c2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C2CC2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C2CCCC2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C#CCOC)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C(C)=O)c1=O
CCN(CC)CCOc1ccc(Nc2cc3n(C(C)C)c(=O)c(cc3cn2)C(C)C)nc1
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(-c2ccccc2F)c1=O
CCN(CC)CCOc1ccc(Nc2cc3n(C4CC4)c(=O)c(cc3cn2)C(C)C)nc1
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C2CCC2)c1=O
CCOC(=O)\C=C\c1cc2cnc(Nc3ccc(C)cn3)cc2n(CC)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C#CC(C)(C)C)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(-c2ccc(C)cc2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(-c2cccc(C)c2)c1=O
CCn1c2cc(Nc3nccs3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(cn3)N3CCN(C)CC3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(cn3)N3CCOCC3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(-c2ccccc2C)c1=O
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCCC4)c(=O)c(cc3cn2)C(C)C)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCC4)c(=O)c(cc3cn2)C(C)C)nc1
CCn1c2cc(Nc3ccc(OCCN(C)C)cn3)ncc2cc(-c2ccccc2)c1=O
CCN(CC)CCOc1ccc(Nc2cc3[nH]c(=O)c(cc3cn2)C(C)C)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)C(C)C)nc1
CCn1c2cc(Nc3ccc(OC)cn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(O)cn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C#CCO)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(C#CC(C)(C)O)c1=O
CCN(CC)CCOc1ccc(Nc2cc3n(C(C)CCO)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(-c4ccccc4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CCOC)c(=O)c(cc3cn2)C(C)C)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCN(C)C4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)C(C)C)nc1
CCn1c2cc(Nc3ccncn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(OC)nn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccnc(OC)n3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccnc(O)n3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(cn3)N(C)C)ncc2cc(-c2ccccc2)c1=O
CCN(CC)CCOc1ccc(Nc2cc3n(CC4CCN(C)C4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCn1c2cc(Nc3ccc(NCCO)cn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(NCCN(C)C)cn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(-c2nccs2)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(c1=O)C(C)(C)O
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCOCC4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCn1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2ccccc2Cl)c1=O
CCn1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2ccccc2F)c1=O
CCN(CC)CCOc1ccc(Nc2cc3n(CCN(C)C)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCCCC4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CCn1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(2,-1.93,;.67,-1.16,;.67,.38,;-.67,1.15,;-2,.38,;-3.33,1.15,;-4.67,.38,;-4.67,-1.16,;-3.33,-1.93,;-3.33,-3.47,;-4.67,-4.24,;-4.67,-5.78,;-6,-3.47,;-6,-1.93,;-3.33,2.69,;-2,3.46,;-.67,2.69,;.67,3.46,;2,2.69,;3.33,3.46,;3.33,5,;2,5.78,;4.67,5.77,;6,5,;6,3.46,;4.67,2.69,;4.67,1.16,;2,1.15,;3.33,.38,)|
CCn1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(2,-1.93,;.67,-1.16,;.67,.38,;-.67,1.15,;-2,.38,;-3.33,1.15,;-4.67,.38,;-4.67,-1.16,;-3.33,-1.93,;-3.33,-3.47,;-4.67,-4.24,;-4.67,-5.78,;-6,-3.47,;-6,-1.93,;-3.33,2.69,;-2,3.46,;-.67,2.69,;.67,3.46,;2,2.69,;3.33,3.46,;3.33,5,;2,5.78,;4.67,5.77,;6,5,;6,3.46,;4.67,2.69,;4.67,1.16,;2,1.15,;3.33,.38,)|
Fc1ccc(Nc2cc3n(C4CCCC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-4.67,-5.78,;-4.67,-4.24,;-3.33,-3.47,;-3.33,-1.93,;-4.67,-1.16,;-4.67,.38,;-3.33,1.15,;-2,.38,;-.67,1.15,;.67,.38,;.67,-1.16,;-.58,-2.06,;-.1,-3.52,;1.44,-3.52,;1.91,-2.06,;2,1.15,;3.33,.38,;2,2.69,;.67,3.46,;-.67,2.69,;-2,3.46,;-3.33,2.69,;3.33,3.46,;3.33,5,;2,5.78,;4.67,5.77,;6,5,;6,3.46,;4.67,2.69,;4.67,1.16,;-6,-1.93,;-6,-3.47,)|
CC(C)n1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(2,-1.93,;.67,-1.15,;-.67,-1.93,;.67,.38,;-.67,1.15,;-2,.38,;-3.33,1.15,;-4.67,.38,;-4.67,-1.15,;-3.33,-1.93,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-6,-3.47,;-6,-1.93,;-3.33,2.69,;-2,3.47,;-.67,2.69,;.67,3.47,;2,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.7,;4.67,1.15,;2,1.15,;3.33,.38,)|
CN1CCC(CC1)n1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(.67,-5.78,;.67,-4.23,;2,-3.47,;2,-1.93,;.67,-1.15,;-.67,-1.93,;-.67,-3.47,;.67,.38,;-.67,1.15,;-2,.38,;-3.33,1.15,;-4.67,.38,;-4.67,-1.15,;-3.33,-1.93,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-6,-3.47,;-6,-1.93,;-3.33,2.69,;-2,3.47,;-.67,2.69,;.67,3.47,;2,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.7,;4.67,1.15,;2,1.15,;3.33,.38,)|
Fc1ccc(Nc2cc3n(C4CCOCC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-4.67,-5.78,;-4.67,-4.23,;-3.33,-3.47,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-3.33,1.15,;-2,.38,;-.67,1.15,;.67,.38,;.67,-1.15,;-.67,-1.93,;-.67,-3.47,;.67,-4.23,;2,-3.47,;2,-1.93,;2,1.15,;3.33,.38,;2,2.69,;.67,3.47,;-.67,2.69,;-2,3.47,;-3.33,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.7,;4.67,1.15,;-6,-1.93,;-6,-3.47,)|
Fc1ccc(Nc2cc3n(-c4ccccc4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-4.67,-5.78,;-4.67,-4.23,;-3.33,-3.47,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-3.33,1.15,;-2,.38,;-.67,1.15,;.67,.38,;.67,-1.15,;-.67,-1.93,;-.67,-3.47,;.67,-4.23,;2,-3.47,;2,-1.93,;2,1.15,;3.33,.38,;2,2.69,;.67,3.47,;-.67,2.69,;-2,3.47,;-3.33,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.7,;4.67,1.15,;-6,-1.93,;-6,-3.47,)|
CCN(CC)CCOc1ccc(Nc2cc3n(-c4ccncc4)c(=O)c(cc3cn2)-c2ccccc2)nc1
Fc1ccc(Nc2cc3n(C4CCOC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-4.67,-5.78,;-4.67,-4.23,;-3.33,-3.47,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-3.33,1.15,;-2,.38,;-.67,1.15,;.67,.38,;.67,-1.15,;-.58,-2.06,;-.1,-3.52,;1.44,-3.52,;1.91,-2.06,;2,1.15,;3.33,.38,;2,2.69,;.67,3.47,;-.67,2.69,;-2,3.47,;-3.33,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.7,;4.67,1.15,;-6,-1.93,;-6,-3.47,)|
CCN(CC)CCOc1ccc(Nc2cc3n(-c4cccnc4)c(=O)c(cc3cn2)-c2ccccc2)nc1
CN1CCC(C1)n1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(2.21,-4.86,;1.44,-3.52,;-.1,-3.52,;-.58,-2.06,;.67,-1.15,;1.91,-2.06,;.67,.38,;-.67,1.15,;-2,.38,;-3.33,1.15,;-4.67,.38,;-4.67,-1.15,;-3.33,-1.93,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-6,-3.47,;-6,-1.93,;-3.33,2.69,;-2,3.47,;-.67,2.69,;.67,3.47,;2,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.7,;4.67,1.15,;2,1.15,;3.33,.38,)|
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2ccccc2)cc1
CCn1c2cc(Nc3ccc(C)cn3)ncc2ccc1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(Br)c1=O
CCn1c2cc(Nc3ccc(C)cn3)ncc2cc(I)c1=O
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-10.67,-1.54,;-9.34,-.77,;-8,-1.54,;-8,-3.08,;-9.34,-3.85,;-6.67,-.77,;-6.67,.77,;-5.33,1.54,;-4,.77,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;1.33,-.77,;2.67,-1.54,;4,-.77,;5.33,-1.54,;5.33,-3.08,;4,-3.85,;6.67,-.77,;8,-1.54,;6.67,.77,;5.33,1.54,;4,.77,;2.67,1.54,;1.33,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,3.85,;10.67,3.08,;10.67,1.54,;9.34,.77,;9.34,-.77,;-2.67,-1.54,;-4,-.77,)|
CCn1c2cc(Nc3ccc(OCCN4CCN(C)CC4)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(4.67,-3.85,;6,-3.08,;6,-1.54,;4.67,-.77,;3.33,-1.54,;2,-.77,;.67,-1.54,;-.67,-.77,;-.67,.77,;-2,1.54,;-3.33,.77,;-4.67,1.54,;-6,.77,;-6,-.77,;-7.34,-1.54,;-8.67,-.77,;-10,-1.54,;-10,-3.08,;-11.34,-3.85,;-8.67,-3.85,;-7.34,-3.08,;-3.33,-.77,;-2,-1.54,;2,.77,;3.33,1.54,;4.67,.77,;6,1.54,;7.34,.77,;8.67,1.54,;8.67,3.08,;7.34,3.85,;10,3.85,;11.34,3.08,;11.34,1.54,;10,.77,;10,-.77,;7.34,-.77,;8.67,-1.54,)|
CCn1c2cc(Nc3ccc(OCCN4CCOCC4)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(4,-3.85,;5.33,-3.08,;5.33,-1.54,;4,-.77,;2.67,-1.54,;1.33,-.77,;,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-5.33,1.54,;-6.67,.77,;-6.67,-.77,;-8,-1.54,;-9.34,-.77,;-10.67,-1.54,;-10.67,-3.08,;-9.34,-3.85,;-8,-3.08,;-4,-.77,;-2.67,-1.54,;1.33,.77,;2.67,1.54,;4,.77,;5.33,1.54,;6.67,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,3.85,;10.67,3.08,;10.67,1.54,;9.34,.77,;9.34,-.77,;6.67,-.77,;8,-1.54,)|
CCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2c(F)cccc2F)c1=O |(4,-3.85,;5.33,-3.08,;5.33,-1.54,;4,-.77,;2.67,-1.54,;1.33,-.77,;,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-4,-.77,;-2.67,-1.54,;-5.33,1.54,;-5.33,3.08,;-6.67,.77,;-6.67,-.77,;-8,-1.54,;-9.34,-.77,;-10.67,-1.54,;-9.34,.77,;-8,1.54,;1.33,.77,;2.67,1.54,;4,.77,;5.33,1.54,;6.67,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,3.85,;10.67,3.08,;10.67,1.54,;9.34,.77,;9.34,-.77,;6.67,-.77,;8,-1.54,)|
CCn1c2cc(Nc3ccc(CN4CCN(C)CC4)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(4,-3.85,;5.33,-3.08,;5.33,-1.54,;4,-.77,;2.67,-1.54,;1.33,-.77,;,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-5.33,1.54,;-6.67,.77,;-8,1.54,;-9.34,.77,;-9.34,-.77,;-10.67,-1.54,;-8,-1.54,;-6.67,-.77,;-4,-.77,;-2.67,-1.54,;1.33,.77,;2.67,1.54,;4,.77,;5.33,1.54,;6.67,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,3.85,;10.67,3.08,;10.67,1.54,;9.34,.77,;9.34,-.77,;6.67,-.77,;8,-1.54,)|
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2c(F)ccc(Cl)c2F)nc1 |(-11.34,-1.54,;-10,-.77,;-8.67,-1.54,;-8.67,-3.08,;-10,-3.85,;-7.34,-.77,;-7.34,.77,;-6,1.54,;-4.67,.77,;-3.33,1.54,;-2,.77,;-2,-.77,;-.67,-1.54,;.67,-.77,;2,-1.54,;3.33,-.77,;4.67,-1.54,;4.67,-3.08,;3.33,-3.85,;6,-.77,;7.34,-1.54,;6,.77,;4.67,1.54,;3.33,.77,;2,1.54,;.67,.77,;7.34,1.54,;7.34,3.08,;6,3.85,;8.67,3.85,;10,3.08,;10,1.54,;11.34,.77,;8.67,.77,;8.67,-.77,;-3.33,-1.54,;-4.67,-.77,)|
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2c(F)cc(Cl)cc2F)nc1 |(-11.34,-1.54,;-10,-.77,;-8.67,-1.54,;-8.67,-3.08,;-10,-3.85,;-7.34,-.77,;-7.34,.77,;-6,1.54,;-4.67,.77,;-3.33,1.54,;-2,.77,;-2,-.77,;-.67,-1.54,;.67,-.77,;2,-1.54,;3.33,-.77,;4.67,-1.54,;4.67,-3.08,;6,-3.85,;6,-.77,;7.34,-1.54,;6,.77,;4.67,1.54,;3.33,.77,;2,1.54,;.67,.77,;7.34,1.54,;7.34,3.08,;6,3.85,;8.67,3.85,;10,3.08,;11.34,3.85,;10,1.54,;8.67,.77,;8.67,-.77,;-3.33,-1.54,;-4.67,-.77,)|
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2ccc(F)cc2C)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2ccc(F)cc2F)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)nc1 |(-10.67,-1.54,;-9.34,-.77,;-8,-1.54,;-8,-3.08,;-9.34,-3.85,;-6.67,-.77,;-6.67,.77,;-5.33,1.54,;-4,.77,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;1.33,-.77,;2.67,-1.54,;4,-.77,;5.33,-1.54,;5.33,-3.08,;6.67,-3.85,;6.67,-.77,;8,-1.54,;6.67,.77,;5.33,1.54,;4,.77,;2.67,1.54,;1.33,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,3.85,;10.67,3.08,;10.67,1.54,;9.34,.77,;9.34,-.77,;-2.67,-1.54,;-4,-.77,)|
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2ccccn2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2cccnc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2ccc(SC)cc2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2cccc(SC)c2)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2ccccc2Cl)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2ccccc2C(F)(F)F)nc1
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2c(Cl)cccc2OC)nc1 |(-9.34,-3.85,;-8,-3.08,;-8,-1.54,;-9.34,-.77,;-10.67,-1.54,;-6.67,-.77,;-6.67,.77,;-5.33,1.54,;-4,.77,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;1.33,-.77,;2.67,-1.54,;4,-.77,;5.33,-1.54,;5.33,-3.08,;6.67,-3.85,;6.67,-.77,;8,-1.54,;6.67,.77,;5.33,1.54,;4,.77,;2.67,1.54,;1.33,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,3.85,;10.67,3.08,;10.67,1.54,;9.34,.77,;9.34,-.77,;10.67,-1.54,;-2.67,-1.54,;-4,-.77,)|
CCN(CC)CCOc1ccc(Nc2cc3n(CC)c(=O)c(cc3cn2)-c2c(O)cccc2Cl)nc1 |(-9.34,-3.85,;-8,-3.08,;-8,-1.54,;-9.34,-.77,;-10.67,-1.54,;-6.67,-.77,;-6.67,.77,;-5.33,1.54,;-4,.77,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;1.33,-.77,;2.67,-1.54,;4,-.77,;5.33,-1.54,;5.33,-3.08,;6.67,-3.85,;6.67,-.77,;8,-1.54,;6.67,.77,;5.33,1.54,;4,.77,;2.67,1.54,;1.33,.77,;8,1.54,;9.34,.77,;9.34,-.77,;10.67,1.54,;10.67,3.08,;9.34,3.85,;8,3.08,;6.67,3.85,;-2.67,-1.54,;-4,-.77,)|
CCn1c2cc(Nc3ccc(CN4CCNCC4)cn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(CN4CCN(CC4)S(C)(=O)=O)cn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3cccnn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3cn(C)cn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3cn(CCOC)cn3)ncc2cc(-c2ccccc2)c1=O
CCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2c(F)cccc2Cl)c1=O |(6.67,-3.85,;5.33,-3.08,;5.33,-1.54,;4,-.77,;2.67,-1.54,;1.33,-.77,;,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-4,-.77,;-2.67,-1.54,;-5.33,1.54,;-5.33,3.08,;-6.67,.77,;-8,1.54,;-9.34,.77,;-9.34,-.77,;-10.67,-1.54,;-8,-1.54,;-6.67,-.77,;1.33,.77,;2.67,1.54,;4,.77,;5.33,1.54,;6.67,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,3.85,;10.67,3.08,;10.67,1.54,;9.34,.77,;9.34,-.77,;6.67,-.77,;8,-1.54,)|
CCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2cc(SC)ccc2F)c1=O
CCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2c(F)cccc2OC)c1=O |(6.67,-3.85,;5.33,-3.08,;5.33,-1.54,;4,-.77,;2.67,-1.54,;1.33,-.77,;,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-4,-.77,;-2.67,-1.54,;-5.33,1.54,;-5.33,3.08,;-6.67,.77,;-8,1.54,;-9.34,.77,;-9.34,-.77,;-10.67,-1.54,;-8,-1.54,;-6.67,-.77,;1.33,.77,;2.67,1.54,;4,.77,;5.33,1.54,;6.67,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,3.85,;10.67,3.08,;10.67,1.54,;9.34,.77,;9.34,-.77,;10.67,-1.54,;6.67,-.77,;8,-1.54,)|
CCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2cc(OC)ccc2F)c1=O
CCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2c(O)cccc2F)c1=O |(6.67,-3.85,;5.33,-3.08,;5.33,-1.54,;4,-.77,;2.67,-1.54,;1.33,-.77,;,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-4,-.77,;-2.67,-1.54,;-5.33,1.54,;-5.33,3.08,;-6.67,.77,;-8,1.54,;-9.34,.77,;-9.34,-.77,;-10.67,-1.54,;-8,-1.54,;-6.67,-.77,;1.33,.77,;2.67,1.54,;4,.77,;5.33,1.54,;6.67,.77,;8,1.54,;9.34,.77,;9.34,-.77,;10.67,1.54,;10.67,3.08,;9.34,3.85,;8,3.08,;6.67,3.85,;6.67,-.77,;8,-1.54,)|
CCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(6.67,-3.85,;5.33,-3.08,;5.33,-1.54,;4,-.77,;2.67,-1.54,;1.33,-.77,;,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-4,-.77,;-2.67,-1.54,;-5.33,1.54,;-5.33,3.08,;-6.67,.77,;-8,1.54,;-9.34,.77,;-9.34,-.77,;-10.67,-1.54,;-8,-1.54,;-6.67,-.77,;1.33,.77,;2.67,1.54,;4,.77,;5.33,1.54,;6.67,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,3.85,;10.67,3.08,;10.67,1.54,;9.34,.77,;9.34,-.77,;6.67,-.77,;8,-1.54,)|
CCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2c(O)cccc2Cl)c1=O |(6.67,-3.85,;5.33,-3.08,;5.33,-1.54,;4,-.77,;2.67,-1.54,;1.33,-.77,;,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-4,-.77,;-2.67,-1.54,;-5.33,1.54,;-5.33,3.08,;-6.67,.77,;-8,1.54,;-9.34,.77,;-9.34,-.77,;-10.67,-1.54,;-8,-1.54,;-6.67,-.77,;1.33,.77,;2.67,1.54,;4,.77,;5.33,1.54,;6.67,.77,;8,1.54,;9.34,.77,;9.34,-.77,;10.67,1.54,;10.67,3.08,;9.34,3.85,;8,3.08,;6.67,3.85,;6.67,-.77,;8,-1.54,)|
CCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2c(F)ccc(F)c2O)c1=O |(6,-3.85,;4.67,-3.08,;4.67,-1.54,;3.33,-.77,;2,-1.54,;.67,-.77,;-.67,-1.54,;-2,-.77,;-2,.77,;-3.33,1.54,;-4.67,.77,;-4.67,-.77,;-3.33,-1.54,;-6,1.54,;-6,3.08,;-7.34,.77,;-7.34,-.77,;-8.67,-1.54,;-10,-.77,;-11.34,-1.54,;-10,.77,;-8.67,1.54,;.67,.77,;2,1.54,;3.33,.77,;4.67,1.54,;6,.77,;7.34,1.54,;7.34,3.08,;6,3.85,;8.67,3.85,;10,3.08,;10,1.54,;11.34,.77,;8.67,.77,;8.67,-.77,;6,-.77,;7.34,-1.54,)|
CCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2c(C)cc(F)cc2C)c1=O |(6,-3.85,;4.67,-3.08,;4.67,-1.54,;3.33,-.77,;2,-1.54,;.67,-.77,;-.67,-1.54,;-2,-.77,;-2,.77,;-3.33,1.54,;-4.67,.77,;-4.67,-.77,;-3.33,-1.54,;-6,1.54,;-6,3.08,;-7.34,.77,;-7.34,-.77,;-8.67,-1.54,;-10,-.77,;-11.34,-1.54,;-10,.77,;-8.67,1.54,;.67,.77,;2,1.54,;3.33,.77,;4.67,1.54,;6,.77,;7.34,1.54,;8.67,.77,;8.67,-.77,;10,1.54,;10,3.08,;11.34,3.85,;8.67,3.85,;7.34,3.08,;6,3.85,;6,-.77,;7.34,-1.54,)|
OCCn1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(4,-4.62,;4,-3.08,;2.67,-2.31,;2.67,-.77,;1.33,,;,-.77,;-1.33,,;-2.67,-.77,;-4,,;-4,1.54,;-5.33,2.31,;-6.67,1.54,;-8,2.31,;-6.67,,;-5.33,-.77,;-1.33,1.54,;,2.31,;1.33,1.54,;2.67,2.31,;4,1.54,;5.33,2.31,;6.67,1.54,;6.67,,;8,2.31,;8,3.85,;6.67,4.62,;5.33,3.85,;4,4.62,;4,,;5.33,-.77,)|
COCCn1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(5.33,-5,;4,-4.23,;4,-2.69,;2.67,-1.93,;2.67,-.38,;1.33,.38,;,-.38,;-1.33,.38,;-2.67,-.38,;-4,.38,;-4,1.93,;-5.33,2.69,;-6.67,1.93,;-8,2.69,;-6.67,.38,;-5.33,-.38,;-1.33,1.93,;,2.69,;1.33,1.93,;2.67,2.69,;4,1.93,;5.33,2.69,;6.67,1.93,;6.67,.38,;8,2.69,;8,4.23,;6.67,5,;5.33,4.23,;4,5,;4,.38,;5.33,-.38,)|
NCCn1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(4,-4.62,;4,-3.08,;2.67,-2.31,;2.67,-.77,;1.33,,;,-.77,;-1.33,,;-2.67,-.77,;-4,,;-4,1.54,;-5.33,2.31,;-6.67,1.54,;-8,2.31,;-6.67,,;-5.33,-.77,;-1.33,1.54,;,2.31,;1.33,1.54,;2.67,2.31,;4,1.54,;5.33,2.31,;6.67,1.54,;6.67,,;8,2.31,;8,3.85,;6.67,4.62,;5.33,3.85,;4,4.62,;4,,;5.33,-.77,)|
COCCn1c2cc(Nc3ccc(F)cn3)ncc2cc(C(C)C)c1=O
COCCn1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2c(F)cccc2F)c1=O |(2.67,-5,;4,-4.23,;4,-2.69,;5.33,-1.93,;5.33,-.39,;4,.38,;2.67,-.39,;1.33,.38,;,-.39,;-1.33,.38,;-1.33,1.92,;-2.67,2.69,;-4,1.92,;-4,.38,;-2.67,-.39,;-5.33,2.69,;-5.33,4.23,;-6.67,1.92,;-6.67,.38,;-8,-.39,;-9.34,.38,;-10.67,-.39,;-9.34,1.92,;-8,2.69,;1.33,1.92,;2.67,2.69,;4,1.92,;5.33,2.69,;6.67,1.92,;8,2.69,;9.34,1.92,;9.34,.38,;10.67,2.69,;10.67,4.23,;9.34,5,;8,4.23,;6.67,5,;6.67,.38,;8,-.39,)|
CN(C)CCCn1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |(6.67,-3.47,;5.33,-4.23,;5.33,-5.78,;4,-3.47,;4,-1.93,;2.67,-1.15,;2.67,.38,;1.33,1.15,;,.38,;-1.33,1.15,;-2.67,.38,;-4,1.15,;-5.33,.38,;-6.67,1.15,;-6.67,2.69,;-8,3.47,;-5.33,3.47,;-4,2.69,;-1.33,2.69,;,3.47,;1.33,2.69,;2.67,3.47,;4,2.69,;5.33,3.47,;6.67,2.69,;6.67,1.15,;8,3.47,;8,5,;6.67,5.78,;5.33,5,;4,5.78,;4,1.15,;5.33,.38,)|
Fc1ccc(Nc2cc3n(CCCN4CCOCC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-8,3.85,;-6.67,3.08,;-5.33,3.85,;-4,3.08,;-4,1.54,;-2.67,.77,;-1.33,1.54,;,.77,;1.33,1.54,;2.67,.77,;2.67,-.77,;4,-1.54,;4,-3.08,;2.67,-3.85,;1.33,-3.08,;,-3.85,;,-5.39,;1.33,-6.16,;2.67,-5.39,;4,1.54,;5.33,.77,;4,3.08,;2.67,3.85,;1.33,3.08,;,3.85,;-1.33,3.08,;5.33,3.85,;6.67,3.08,;6.67,1.54,;8,3.85,;8,5.39,;6.67,6.16,;5.33,5.39,;4,6.16,;-5.33,.77,;-6.67,1.54,)|
CN1CCN(CCCn2c3cc(Nc4ccc(F)cn4)ncc3cc(-c3c(F)cccc3F)c2=O)CC1 |(-1.33,-6.16,;,-5.39,;,-3.85,;1.33,-3.08,;2.67,-3.85,;4,-3.08,;4,-1.54,;2.67,-.77,;2.67,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-2.67,.77,;-4,1.54,;-4,3.08,;-5.33,3.85,;-6.67,3.08,;-8,3.85,;-6.67,1.54,;-5.33,.77,;-1.33,3.08,;,3.85,;1.33,3.08,;2.67,3.85,;4,3.08,;5.33,3.85,;6.67,3.08,;6.67,1.54,;8,3.85,;8,5.39,;6.67,6.16,;5.33,5.39,;4,6.16,;4,1.54,;5.33,.77,;2.67,-5.39,;1.33,-6.16,)|
Fc1ccc(Nc2cc3n(CCN4CCOCC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-8,3.85,;-6.67,3.08,;-5.33,3.85,;-4,3.08,;-4,1.54,;-2.67,.77,;-1.33,1.54,;,.77,;1.33,1.54,;2.67,.77,;2.67,-.77,;4,-1.54,;4,-3.08,;2.67,-3.85,;2.67,-5.39,;4,-6.16,;5.33,-5.39,;5.33,-3.85,;4,1.54,;5.33,.77,;4,3.08,;2.67,3.85,;1.33,3.08,;,3.85,;-1.33,3.08,;5.33,3.85,;6.67,3.08,;6.67,1.54,;8,3.85,;8,5.39,;6.67,6.16,;5.33,5.39,;4,6.16,;-5.33,.77,;-6.67,1.54,)|
CN1CCN(CCn2c3cc(Nc4ccc(F)cn4)ncc3cc(-c3c(F)cccc3F)c2=O)CC1 |(4,-6.93,;4,-5.39,;2.67,-4.62,;2.67,-3.08,;4,-2.31,;4,-.77,;2.67,,;2.67,1.54,;1.33,2.31,;,1.54,;-1.33,2.31,;-2.67,1.54,;-4,2.31,;-4,3.85,;-5.33,4.62,;-6.67,3.85,;-8,4.62,;-6.67,2.31,;-5.33,1.54,;-1.33,3.85,;,4.62,;1.33,3.85,;2.67,4.62,;4,3.85,;5.33,4.62,;6.67,3.85,;6.67,2.31,;8,4.62,;8,6.16,;6.67,6.93,;5.33,6.16,;4,6.93,;4,2.31,;5.33,1.54,;5.33,-3.08,;5.33,-4.62,)|
CN(C1CCN(C)CC1)c1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-5.33,2.69,;-5.33,1.15,;-6.67,.38,;-6.67,-1.15,;-8,-1.93,;-9.34,-1.15,;-10.67,-1.93,;-9.34,.38,;-8,1.15,;-4,.38,;-2.67,1.15,;-1.33,.38,;-1.33,-1.15,;,-1.93,;1.33,-1.15,;2.67,-1.93,;4,-1.15,;5.33,-1.93,;5.33,-3.47,;6.67,-1.15,;8,-1.93,;6.67,.38,;5.33,1.15,;4,.38,;2.67,1.15,;1.33,.38,;8,1.15,;9.34,.38,;9.34,-1.15,;10.67,1.15,;10.67,2.69,;9.34,3.47,;8,2.69,;6.67,3.47,;-2.67,-1.93,;-4,-1.15,)|
CN(C1CCN(C)CC1)c1ccc(Nc2cc3n(C4CC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-5.33,3.36,;-5.33,1.82,;-6.67,1.05,;-6.67,-.49,;-8,-1.26,;-9.34,-.49,;-10.67,-1.26,;-9.34,1.05,;-8,1.82,;-4,1.05,;-2.67,1.82,;-1.33,1.05,;-1.33,-.49,;,-1.26,;1.33,-.49,;2.67,-1.26,;4,-.49,;5.33,-1.26,;5.33,-2.8,;4.56,-4.13,;6.1,-4.13,;6.67,-.49,;8,-1.26,;6.67,1.05,;5.33,1.82,;4,1.05,;2.67,1.82,;1.33,1.05,;8,1.82,;9.34,1.05,;9.34,-.49,;10.67,1.82,;10.67,3.36,;9.34,4.13,;8,3.36,;6.67,4.13,;-2.67,-1.26,;-4,-.49,)|
CC(C)n1c2cc(Nc3ccc(cn3)N(C)C3CCN(C)CC3)ncc2cc(-c2c(F)cccc2F)c1=O |(6.67,-3.85,;5.33,-3.08,;4,-3.85,;5.33,-1.54,;4,-.77,;2.67,-1.54,;1.33,-.77,;,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-4,-.77,;-2.67,-1.54,;-5.33,1.54,;-5.33,3.08,;-6.67,.77,;-6.67,-.77,;-8,-1.54,;-9.34,-.77,;-10.67,-1.54,;-9.34,.77,;-8,1.54,;1.33,.77,;2.67,1.54,;4,.77,;5.33,1.54,;6.67,.77,;8,1.54,;9.34,.77,;9.34,-.77,;10.67,1.54,;10.67,3.08,;9.34,3.85,;8,3.08,;6.67,3.85,;6.67,-.77,;8,-1.54,)|
CN(C1CCN(C)CC1)c1ccc(Nc2cc3n(C4CCC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-5.33,3.78,;-5.33,2.24,;-6.67,1.47,;-6.67,-.07,;-8,-.84,;-9.34,-.07,;-10.67,-.84,;-9.34,1.47,;-8,2.24,;-4,1.47,;-2.67,2.24,;-1.33,1.47,;-1.33,-.07,;,-.84,;1.33,-.07,;2.67,-.84,;4,-.07,;5.33,-.84,;5.33,-2.38,;4.25,-3.47,;5.33,-4.55,;6.42,-3.47,;6.67,-.07,;8,-.84,;6.67,1.47,;5.33,2.24,;4,1.47,;2.67,2.24,;1.33,1.47,;8,2.24,;9.34,1.47,;9.34,-.07,;10.67,2.24,;10.67,3.78,;9.34,4.55,;8,3.78,;6.67,4.55,;-2.67,-.84,;-4,-.07,)|
CN(C1CCN(C)CC1)c1ccc(Nc2cc3n(C4CCCC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-5.33,3.88,;-5.33,2.34,;-6.67,1.57,;-6.67,.03,;-8,-.74,;-9.34,.03,;-10.67,-.74,;-9.34,1.57,;-8,2.34,;-4,1.57,;-2.67,2.34,;-1.33,1.57,;-1.33,.03,;,-.74,;1.33,.03,;2.67,-.74,;4,.03,;5.33,-.74,;5.33,-2.28,;4.09,-3.19,;4.56,-4.65,;6.1,-4.65,;6.58,-3.19,;6.67,.03,;8,-.74,;6.67,1.57,;5.33,2.34,;4,1.57,;2.67,2.34,;1.33,1.57,;8,2.34,;9.34,1.57,;9.34,.03,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;6.67,4.65,;-2.67,-.74,;-4,.03,)|
CN(C1CCN(C)CC1)c1ccc(Nc2cc3[nH]c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-5.33,1.93,;-5.33,.38,;-6.67,-.38,;-6.67,-1.93,;-8,-2.69,;-9.34,-1.93,;-10.67,-2.69,;-9.34,-.38,;-8,.38,;-4,-.38,;-2.67,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;6.67,-.38,;5.33,.38,;4,-.38,;2.67,.38,;1.33,-.38,;8,.38,;9.34,-.38,;9.34,-1.93,;10.67,.38,;10.67,1.93,;9.34,2.69,;8,1.93,;6.67,2.69,;-2.67,-2.69,;-4,-1.93,)|
Fc1ccc(Nc2cc3n(C4CCOC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-4.67,-5.78,;-4.67,-4.23,;-3.33,-3.47,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-3.33,1.15,;-2,.38,;-.67,1.15,;.67,.38,;.67,-1.15,;-.58,-2.06,;-.1,-3.52,;1.44,-3.52,;1.91,-2.06,;2,1.15,;3.33,.38,;2,2.69,;.67,3.47,;-.67,2.69,;-2,3.47,;-3.33,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.69,;4.67,1.15,;-6,-1.93,;-6,-3.47,)|
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCOC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |(-8,-6.16,;-6.67,-5.39,;-5.33,-6.16,;-5.33,-7.7,;-6.67,-8.47,;-4,-5.39,;-4,-3.85,;-2.67,-3.08,;-2.67,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-2.67,3.08,;-1.33,3.85,;,3.08,;1.33,3.85,;2.67,3.08,;2.67,1.54,;1.42,.63,;1.9,-.83,;3.44,-.83,;3.91,.63,;4,3.85,;5.33,3.08,;4,5.39,;2.67,6.16,;1.33,5.39,;,6.16,;-1.33,5.39,;5.33,6.16,;5.33,7.7,;4,8.47,;6.67,8.47,;8,7.7,;8,6.16,;6.67,5.39,;6.67,3.85,;-4,.77,;-4,-.77,)|
CCN(CC)CCOc1ccc(Nc2cc3n(C4CCOC4)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)nc1 |(-11.34,1.57,;-10,2.34,;-8.67,1.57,;-8.67,.03,;-10,-.74,;-7.34,2.34,;-6,1.57,;-4.67,2.34,;-3.33,1.57,;-3.33,.03,;-2,-.74,;-.67,.03,;.67,-.74,;2,.03,;3.33,-.74,;4.67,.03,;6,-.74,;6,-2.28,;4.76,-3.19,;5.23,-4.65,;6.77,-4.65,;7.25,-3.19,;7.34,.03,;8.67,-.74,;7.34,1.57,;6,2.34,;4.67,1.57,;3.33,2.34,;2,1.57,;8.67,2.34,;10,1.57,;10,.03,;11.34,2.34,;11.34,3.88,;10,4.65,;8.67,3.88,;7.34,4.65,;-.67,1.57,;-2,2.34,)|
Fc1ccc(Nc2cc3n(C4CCOC4)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)nc1 |(-4.67,-5.78,;-4.67,-4.23,;-3.33,-3.47,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-3.33,1.15,;-2,.38,;-.67,1.15,;.67,.38,;.67,-1.15,;-.58,-2.06,;-.1,-3.52,;1.44,-3.52,;1.91,-2.06,;2,1.15,;3.33,.38,;2,2.69,;.67,3.47,;-.67,2.69,;-2,3.47,;-3.33,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.69,;4.67,1.15,;-6,-1.93,;-6,-3.47,)|
Fc1ccc(Nc2cc3n([C@H]4CCNC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |r,wD:10.9,(-4.67,-5.78,;-4.67,-4.23,;-3.33,-3.47,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-3.33,1.15,;-2,.38,;-.67,1.15,;.67,.38,;.67,-1.15,;-.58,-2.06,;-.1,-3.52,;1.44,-3.52,;1.91,-2.06,;2,1.15,;3.33,.38,;2,2.69,;.67,3.47,;-.67,2.69,;-2,3.47,;-3.33,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.69,;4.67,1.15,;-6,-1.93,;-6,-3.47,)|
CN1CC[C@@H](C1)n1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |r,wD:4.6,(2.21,-4.86,;1.44,-3.52,;-.1,-3.52,;-.58,-2.06,;.67,-1.15,;1.91,-2.06,;.67,.38,;-.67,1.15,;-2,.38,;-3.33,1.15,;-4.67,.38,;-4.67,-1.15,;-3.33,-1.93,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-6,-3.47,;-6,-1.93,;-3.33,2.69,;-2,3.47,;-.67,2.69,;.67,3.47,;2,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.69,;4.67,1.15,;2,1.15,;3.33,.38,)|
Fc1ccc(Nc2cc3n([C@@H]4CCNC4)c(=O)c(cc3cn2)-c2c(F)cccc2F)nc1 |r,wU:10.9,(-4.67,-5.78,;-4.67,-4.23,;-3.33,-3.47,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-3.33,1.15,;-2,.38,;-.67,1.15,;.67,.38,;.67,-1.15,;-.58,-2.06,;-.1,-3.52,;1.44,-3.52,;1.91,-2.06,;2,1.15,;3.33,.38,;2,2.69,;.67,3.47,;-.67,2.69,;-2,3.47,;-3.33,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.69,;4.67,1.15,;-6,-1.93,;-6,-3.47,)|
CN1CC[C@H](C1)n1c2cc(Nc3ccc(F)cn3)ncc2cc(-c2c(F)cccc2F)c1=O |r,wU:4.6,(2.21,-4.86,;1.44,-3.52,;-.1,-3.52,;-.58,-2.06,;.67,-1.15,;1.91,-2.06,;.67,.38,;-.67,1.15,;-2,.38,;-3.33,1.15,;-4.67,.38,;-4.67,-1.15,;-3.33,-1.93,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-6,-3.47,;-6,-1.93,;-3.33,2.69,;-2,3.47,;-.67,2.69,;.67,3.47,;2,2.69,;3.33,3.47,;3.33,5,;2,5.78,;4.67,5.78,;6,5,;6,3.47,;4.67,2.69,;4.67,1.15,;2,1.15,;3.33,.38,)|
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OCCOCCOCC(O)=O)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OCCOCCOCC(O)=O)c1
CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(CN4CCN(C)CC4)c(c3)C(F)(F)F)cc2)ccn1
CN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4ccncc4)cc3)cc2C(F)(F)F)CC1
CN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4ccc5ncncc5c4)cc3)cc2C(F)(F)F)CC1
CN1CCN(Cc2ccc(NC(=O)Nc3ccc(Nc4ccc5ncccc5c4)cc3)cc2C(F)(F)F)CC1
CN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4ccc5ncccc5c4)cc3)cc2C(F)(F)F)CC1
CN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4ccc5cccnc5c4)cc3)cc2C(F)(F)F)CC1
CN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4ccc5ccccc5c4)cc3)cc2C(F)(F)F)CC1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccc4ncncc4c3)cc2)n(n1)-c1ccc2ncccc2c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccc4cccnc4c3)cc2)n(n1)-c1ccc2ncccc2c1
COc1ccc(cn1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(c3)C#N)n2)c2ccccc12)C(C)(C)C
COc1ccc(cn1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(c3)N=S(C)(C)=O)n2)c2ccccc12)C(C)(C)C
COc1ccc(cn1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(OS(C)(=O)=O)c3)n2)c2ccccc12)C(C)(C)C
COCCOCCOCCOc1cccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)c1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cccc(c4)C#C)n3)c3ccccc23)n(n1)-c1ccc(C)cc1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cccc(OS(C)(=O)=O)c4)n3)c3ccccc23)n(n1)-c1ccc(C)cc1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(OS(C)(=O)=O)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(c1)C#C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(OCCN2CCOCC2)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(c1)S(=O)(=O)C1CC1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cccc(OCCOCCOCCO)c4)n3)c3ccccc23)n(n1)-c1ccc(C)cc1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(OCCOCCOCCO)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c(Cl)c3Cl)n2)cc(OCCN2CCOCC2)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(SCCO)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c(Cl)c3Cl)n2)cc(c1)S(=O)(=O)C1CC1
COCCOCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOCCOCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c(Cl)c3Cl)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)nc4)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(SCCCN2CCOCC2)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)cc4)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OCCN2CCOCC2)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)S(=O)(=O)C1CC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(SCCCO)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OCCCN2CCOCC2)c1
COCCOCCOCCOCCOCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c(Cl)c3Cl)n2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(SCCO)c1
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OCCOCCOCCN(C)C)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OCCOCCOCCN2CCOCC2)c1
COCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)nc4)C(C)(C)C)c4ccccc34)n2)cc(c1)S(=O)(=O)C1CC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OCCOCCOCCO)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(cc4)N(C)C)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OC)n1
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC)cc(c3)S(=O)(=O)C3CC3)n2)c2ccccc12)C(C)(C)C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c(Cl)c3Cl)n2)cc(OCCOCCOCCO)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(OC)c1Cl
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCN(C)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCCN1CCS(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCCN1CCS(=O)(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCOCCCOCOP(O)(O)=O
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)[C@@H]1CCCN1C(=O)C=C |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)[C@@H]1CCCN1C(=O)\C=C\CC1CCCC1 |r|
CN(C)C\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)[C@@H]1CCCN1C(=O)c1ccnc(Cl)n1 |r|
C/C=C/C(=O)N1CCC[C@H]1c2nc(c3n2ccnc3N)c4ccc(cc4)C(=O)Nc5ccccn5
CN(C)C\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(F)ccn2)c2c(N)nccn12 |r|
CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(C)ccn2)c2c(N)nccn12 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)\C=C\COC)n3ccnc(N)c23)c1 |r|
CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
CCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)\C=C\COC)n3ccnc(N)c23)c1 |r|
CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2nc3CCCCc3s2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(C(=O)Nc4ccccn4)c(F)c3)c12)[C@@H]1CCCN1C(=O)C=C |r|
COc1cc(ccc1C(=O)Nc1ccccn1)-c1nc([C@@H]2CCCN2C(=O)C=C)n2ccnc(N)c12 |r|
CN(C)C\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2nccs2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(F)ccn3)c12)[C@@H]1CCCCN1C(=O)C=C |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(ccn3)C#N)c12)[C@@H]1CCCCN1C(=O)C=C |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(ccn3)C(F)(F)F)c12)[C@@H]1CCCCN1S(=O)(=O)C=C |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ncccn3)c12)[C@@H]1CCCCN1C(=O)C=C |r|
Cc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCCN3C(=O)C=C)n3ccnc(N)c23)n1 |r|
CC#CC(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccncn2)c2c(N)nccn12 |r|
CC#CC(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cccnn2)c2c(N)nccn12 |r|
CC#CC(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccon2)c2c(N)nccn12 |r|
CCc1cnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCCN3C(=O)\C=C\COC)n3ccnc(N)c23)s1 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2F)-c2nc([C@@H]3CCCCN3C(=O)C=C)n3ccnc(N)c23)c1 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2OC)-c2nc([C@@H]3CCCCN3C(=O)\C=C\CN(C)C)n3ccnc(N)c23)c1 |r|
CC#CC(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2C)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Nc1nccn2c(CNC(=O)C=C)nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12
CC#CC(=O)N[C@@H](C)c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
CC(=O)SCC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
CC(C)(O)C#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)[C@@H]1CCCN1C(=O)c1cc(Cl)ncn1 |r|
CCC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)[C@@H]1CCCN1C(=O)C#CC1CC1 |r|
CCCC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)C1CCCCCN1C(=O)C=C
CC#CC(=O)N1CCOC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
CC#CC(=O)N(C)[C@@H](C)c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
CN(C)CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
COCC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(F)ccn3)c12)[C@@H]1CCCN1C(=O)C=C |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(ccn3)N3CCCC3)c12)[C@@H]1CCCN1C(=O)C=C |r|
CC#CC(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(F)ccn2)c2c(N)nccn12 |r|
CC#CC(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)[C@@H]1CCCCN1C(=O)C=C |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)C#CC)n3ccnc(N)c23)c1 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@H](C)N(C)C(=O)\C=C\COC)n3ccnc(N)c23)c1 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCCN3S(=O)(=O)C=C)n3ccnc(N)c23)c1 |r|
CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(C(=O)Nc3ccccn3)c(F)c2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(OC)ccn2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(C(=O)Nc3ccccn3)c(F)c2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(F)ccn2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccon2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ncccn2)c2c(N)nccn12 |r|
Cc1cc(ccc1-c1nc([C@@H]2CCCCN2C(=O)c2ccnc(Cl)n2)n2ccnc(N)c12)C(=O)Nc1ccccn1 |r|
COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(C)ccn2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(C)C)c2c(N)nccn12 |r|
CN(C)C\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(C)ccn2)c2c(N)nccn12 |r|
CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2nccs2)c2c(N)nccn12 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCCN3C(=O)C=C)n3ccnc(N)c23)c1 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(ccn3)C(F)(F)F)c12)[C@@H]1CCCN1C(=O)C=C |r|
CC#CC(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCCN3C(=O)C#CC)n3ccnc(N)c23)c1 |r|
CC(C)c1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)\C=C\CN(C)C)n3ccnc(N)c23)c1 |r|
Cc1cc(ccc1-c1nc([C@@H]2CCCCN2S(=O)(=O)C=C)n2ccnc(N)c12)C(=O)Nc1ccccn1 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2F)-c2nc([C@@H]3CCCCN3C(=O)C#CC)n3ccnc(N)c23)c1 |r|
Cc1cc(ccc1-c1nc([C@@H]2CCCCN2C(=O)C=C)n2ccnc(N)c12)C(=O)Nc1ccccn1 |r|
CN(C)C\C=C\C(=O)NCc1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12
CC(C)c1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)c3ccnc(Cl)n3)n3ccnc(N)c23)c1 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3nc4CCCCc4s3)c12)[C@@H]1CCCN1C(=O)c1ccnc(Cl)n1 |r|
COC\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cccnn2)c2c(N)nccn12 |r|
CN(C)C\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cccnn2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cccnn3)c12)[C@@H]1CCCCN1C(=O)c1ccnc(Cl)n1 |r|
COC\C=C\C(=O)N(C)[C@@H](C)c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@H](C)N(C)C(=O)\C=C\CN(C)C)n3ccnc(N)c23)c1 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)\C=C\CN3CCCC3)n3ccnc(N)c23)c1 |r|
CN(C)C\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)c3ccnc(Cl)n3)n3ccnc(N)c23)c1 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(F)ccn3)c12)[C@@H]1CCCCN1C(=O)c1ccnc(Cl)n1 |r|
COC\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(F)ccn2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2nc3CCCCc3s2)c2c(N)nccn12 |r|
COc1cc(ccc1C(=O)Nc1ccccn1)-c1nc([C@@H]2CCCN2C(=O)c2ccnc(Cl)n2)n2ccnc(N)c12 |r|
Nc1nccn2c(nc(-c3ccc(C(=O)Nc4ccccn4)c(F)c3)c12)[C@@H]1CCCN1C(=O)c1ccnc(Cl)n1 |r|
COC\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2C)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccncn2)c2c(N)nccn12 |r|
CCCc1ccnc(NC(=O)c2ccc(-c3nc([C@@H]4CCCN4C(=O)\C=C\COC)n4ccnc(N)c34)c(C)c2)c1 |r|
COC\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2nccc(C)n2)c2c(N)nccn12 |r|
CC#CC(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2nccc(C)n2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ncccn3)c12)[C@@H]1CCCCN1C(=O)c1ccnc(Cl)n1 |r|
CC(=C)C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)[C@@H]1CCCN1C(=O)C(=C)C(F)(F)F |r|
C\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)[C@@H]1CCCN1CC#N |r|
COC\C=C\C(=O)NCc1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12
CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)N2CCCC2)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCCCCC1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12
COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C#N)c2c(N)nccn12 |r|
COc1cc(ccc1C(=O)Nc1ccccn1)-c1nc([C@@H]2CCCN2C(=O)C#CC)n2ccnc(N)c12 |r|
CC(NC(=O)C=C)c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3nccs3)c12)[C@@H]1CCCN1C(=O)C=C |r|
CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(C)C)c2c(N)nccn12 |r|
COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(C(=O)Nc3ccccn3)c(OC)c2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)[C@@H]1CCCN1C(=O)\C=C\c1ccccc1 |r|
CC(NC(=O)c1ccnc(Cl)n1)c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12
CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(F)ccn2)c2c(N)nccn12 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCCN3C(=O)c3ccnc(Cl)n3)n3ccnc(N)c23)c1 |r|
COC\C=C\C(=O)N1CCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(ccn3)C(F)(F)F)c12)[C@@H]1CCCCN1C(=O)C=C |r|
CCCc1ccnc(NC(=O)c2ccc(cc2OC)-c2nc([C@@H]3CCCCN3C(=O)C#CC)n3ccnc(N)c23)c1 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2OC)-c2nc([C@@H]3CCCCN3C(=O)\C=C\COC)n3ccnc(N)c23)c1 |r|
CC#CC(=O)NCc1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@H](C)N(C)C(=O)C#CC)n3ccnc(N)c23)c1 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2F)-c2nc([C@@H]3CCCCN3C(=O)\C=C\COC)n3ccnc(N)c23)c1 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(ccn3)C(F)(F)F)c12)[C@@H]1CCCCN1C(=O)c1ccnc(Cl)n1 |r|
CCc1cnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCCN3C(=O)C#CC)n3ccnc(N)c23)s1 |r|
CCc1cnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCCN3C(=O)C=C)n3ccnc(N)c23)s1 |r|
CCc1cnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCCN3C(=O)c3ccnc(Cl)n3)n3ccnc(N)c23)s1 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(ccn3)C(F)(F)F)c12)[C@@H]1CCCN1C(=O)c1ccnc(Cl)n1 |r|
COC\C=C\C(=O)N1CCOC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCCN3C(=O)\C=C\COC)n3ccnc(N)c23)c1 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(ccn3)C#N)c12)[C@@H]1CCCN1C(=O)C=C |r|
COc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)C#CC)n3ccnc(N)c23)c1 |r|
Cc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)C=C)n3ccnc(N)c23)c1 |r|
CCCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)C=C)n3ccnc(N)c23)c1 |r|
CCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)C=C)n3ccnc(N)c23)c1 |r|
COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
Cc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)c3ccnc(Cl)n3)n3ccnc(N)c23)c1 |r|
CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C#N)c2c(N)nccn12 |r|
CCc1ccnc(NC(=O)c2ccc(cc2)-c2nc([C@@H]3CCCN3C(=O)C#CC)n3ccnc(N)c23)c1 |r|
CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)-c2ccccc2)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(ccn3)-c3ccccc3)c12)[C@@H]1CCCN1C(=O)C=C |r|
CC(C)(C)n1nc(-c2cccc3ccccc23)c2c(N)ncnc12
CC(C)(C)n1nc(-c2ccc3ccccc3c2)c2c(N)ncnc12
CC(C)n1c2c(c(n1)Cc3cccc4c3cccc4)c(ncn2)N
CC(C)(C)n1c2c(c(n1)Cc3cccc4c3cccc4)c(ncn2)N
c1ccc2c(c1)cccc2Cc3c4c(ncnc4n(n3)CC5CCNCC5)N
CCN1CCC(CC1)n1nc(Cc2cccc3ccccc23)c2c(N)ncnc12
CCN1CCC(Cn2nc(Cc3cccc4ccccc34)c3c(N)ncnc23)CC1
CCN1CCC(CCn2nc(Cc3cccc4ccccc34)c3c(N)ncnc23)CC1
CS(=O)(=O)N1CCC(CC1)n1nc(Cc2cccc3ccccc23)c2c(N)ncnc12
CC(C)n1nc(-c2ccc(Cl)c(Cl)c2)c2c(N)ncnc12
CC(C)c1cccc(c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2ccc3ccccc3c2)c2c(N)ncnc12
COc1ccc2cc(ccc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cnc3ccccc3c2)c2c(N)ncnc12
CC(C)Oc1ccc2cc(ccc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CCCOc1ccc2cc(ccc2c1)-c1nn(C(C)C)c2ncnc(N)c12
COc1ccc2cc(ccc2c1)c3c4c(ncnc4n(n3)CC5CCNCC5)N
CCOc1ccc2cc(ccc2c1)c3c4c(ncnc4n(n3)CC5CCNCC5)N
Nc1ncnc2n(CC3CCNCC3)nc(-c3cnc4ccccc4c3)c12
CC(C)Oc1ccc2cc(ccc2c1)-c1nn(CC2CCNCC2)c2ncnc(N)c12
CCCOc1ccc2cc(ccc2c1)-c1nn(CC2CCNCC2)c2ncnc(N)c12
Nc1ncnc2n(CC3CCNCC3)nc(-c3ccc4cc(OCc5ccccc5)ccc4c3)c12
CCCCOc1ccc2cc(ccc2c1)-c1nn(CC2CCNCC2)c2ncnc(N)c12
Nc1ncnc2n(CC3CCNCC3)nc(-c3ccc4cc(OCC=C)ccc4c3)c12
Nc1ncnc2n(CC3CCNCC3)nc(-c3ccc4cc(OCc5ccccc5Cl)ccc4c3)c12
Nc1ncnc2n(CC3CCNCC3)nc(-c3ccc4cc(OCc5cccc(Cl)c5)ccc4c3)c12
Nc1ncnc2n(CC3CCNCC3)nc(-c3ccc4cc(OCc5ccc(Cl)cc5)ccc4c3)c12
CC(C)n1nc(-c2ccc3cc(OCc4ccccc4)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3cc(OCC=C)ccc3c2)c2c(N)ncnc12
CC(C)COc1ccc2cc(ccc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)COc1ccc2cc(ccc2c1)-c1nn(CC2CCNCC2)c2ncnc(N)c12
Nc1ncnc2n(CC3CCNCC3)nc(-c3ccc(Cl)cc3)c12
Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1
NCCC(=O)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1
c1c2c(ncnc2n(n1)CC3CCNCC3)N
Cc1cc(ccc1-c1ccccc1)-c1nn(CC2CCNCC2)c2ncnc(N)c12
Nc1ncnc2n(CC3CCNCC3)nc(-c3ccc4oc(nc4c3)-c3ccccc3)c12
CC(C)(C)n1ncc2c(N)ncnc12
CC(C)COc1ccc2cc(ccc2c1)-c1nn(CC2CCN(C)CC2)c2ncnc(N)c12
COc1ccc(cc1C)-c1nn(c2ncnc(N)c12)C(C)(C)C
Cc1cccc(c1)-c1nn(c2ncnc(N)c12)C(C)(C)C
COc1ccc2cc(ccc2c1)-c1nn(c2ncnc(N)c12)C(C)(C)C
CCOc1ccc2cc(ccc2c1)-c1nn(c2ncnc(N)c12)C(C)(C)C
CCOc1ccc2cc(ccc2c1)-c1nn(C2CCNCC2)c2ncnc(N)c12
Cn1ccc2cc(ccc12)-c1nn(c2ncnc(N)c12)C(C)(C)C
CC(C)(C)n1nc(-c2ccccc2)c2c(N)ncnc12
Cn1ncc2cc(ccc12)-c1nn(c2ncnc(N)c12)C(C)(C)C
CC(C)(C)n1nc(-c2ccc3ncccc3c2)c2c(N)ncnc12
Cc1cc(ccc1OC)c2c3c(ncnc3n(n2)CC4CCNCC4)N
Nc1ncnc2n(CC3CCNCC3)nc(-c3ccccc3)c12
CC(C)(C)n1nc(-c2ccc(Cl)cc2)c2c(N)ncnc12
CCOc1ccc2cc(ccc2c1)-c1nn(C2CCN(C)CC2)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(C2CCN(CC)CC2)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(CC2CCN(C)CC2)c2ncnc(N)c12
Cn1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(=O)NCCN3CCOCC3)C#C)n2)c2ccccc12)C(C)(C)C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4C)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4C)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4C)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C
CCn1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(=O)NCCOCCOCCOC)C#C)n2)c2ccccc12)C(C)(C)C
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4C)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C#C
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCN4CCOCC4)C#C)n3)c3ccccc23)n(C)n1
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4C)C(C)C)c4ccccc34)n2)cc(c1)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)n2)c2ccccc12)[Si](C)(C)C
COc1ccc(cn1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)n2)c2ccccc12)[Si](C)(C)C
C[Si](C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(OCCN4CCOCC4)c3)n2)c2ccccc12)[Si](C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]ncc4c3)n2)c2ccccc12)[Si](C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4onc(N)c4c3)n2)c2ccccc12)[Si](C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)c4[nH]ncc4c3)n2)c2ccccc12)[Si](C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4CC(=O)Nc4c3)n2)c2ccccc12)[Si](C)(C)C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)[Si](C)(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)[Si](C)(C)C)c4ccccc34)n2)cc(OCCN2CCOCC2)c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccn3)n2)c2ccccc12)[Si](C)(C)C
Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OCCN5CCOCC5)cc4)[Si](C)(C)C)c4ccccc34)n2)cc2cn[nH]c12
CC[Si](C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)n3)c3ccccc23)n(n1)-c1ccc(C)cc1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)[Si](C)(C)C)c(Cl)c3Cl)n2)cc(OCCN2CCOCC2)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)[Si](C)(C)C)c4ccccc34)n2)cc(OC)c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ncnc(Nc3cc(cc(c3)C(=O)NCCN3CCOCC3)C#C)n2)c2ccccc12)[Si](C)(C)C
CNc1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(c4)C(=O)NCCOCCOCCOC)c3)c3ccccc23)c1OC)C(C)(C)C
CNc1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(OCCOCCOCCOC)c4)n3)c3ccccc23)c1OC)C(C)(C)C
CNc1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(c4)S(=O)(=O)C4CC4)n3)c3ccccc23)c1OC)C(C)(C)C
CNc1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(c4)C(=O)NCCN4CCOCC4)n3)c3ccccc23)c1OC)C(C)(C)C
CNc1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(c4)C(=O)NCCOCCOCCOC)n3)c3ccccc23)c1OC)C(C)(C)C
CNc1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(OCCOCCOCCOC)c4)n3)c(Cl)c2Cl)c1OC)C(C)(C)C
CNc1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(OCCOCCOCCOC)c4)c3)c3ccccc23)c1OC)C(C)(C)C
CNc1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC)cc(c4)C(=O)NCCN4CCOCC4)c3)c3ccccc23)c1OC)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)n2)c2ccccc12)C(C)(C)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)c4[nH]ncc4c3)n2)c2ccccc12)C(C)(C)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4CC(=O)Nc4c3)n2)c2ccccc12)C(C)(C)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)c2)c2ccccc12)C(C)(C)C#C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C#C)c4ccccc34)n2)cc(OCCN2CCOCC2)c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(F)(F)F)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)(C)C#C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C#C)c4ccccc34)n2)cc(OC)c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC(F)(F)F)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)(C)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(=O)NCCN3CCOCC3)C#C)n2)c2ccccc12)C(C)(C)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(OCCN4CCOCC4)n3)n2)c2ccccc12)C(C)(C)C#C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)n3)c3ccccc23)n(n1)-c1ccc(cc1)P(C)(C)=O
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)n3)c3ccccc23)n(n1)-c1ccc(cc1)P(C)(C)=O
CN(c1ccccc1)c1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(cc3)P(C)(C)=O)C(C)(C)C)c3ccccc23)n1
Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(cc4)P(C)(C)=O)C(C)(C)C)c4ccccc34)n2)cc2cn[nH]c12
CCP(=O)(CC)c1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)n2)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)n3)c3ccccc23)n(n1)-c1cccc(CP(C)(C)=O)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc(cc4)S(F)(F)(F)(F)F)n3)c3ccccc23)n(n1)-c1ccc(cc1)P(C)(C)=O
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Sc4ccccc4)n3)c3ccccc23)n(n1)-c1ccc(cc1)P(C)(C)=O
CN(CCCO)c1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(cc3)P(C)(C)=O)C(C)(C)C)c3ccccc23)n1
Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccc(CP(C)(C)=O)c4)C(C)(C)C)c4ccccc34)n2)cc2cn[nH]c12
CCP(=O)(CC)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)c4[nH]ncc4c3)n2)c2ccccc12)C(C)(C)C
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(C)c5[nH]ncc5c4)n3)c3ccccc23)n(n1)-c1cccc(CP(C)(C)=O)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccc(CP(C)(C)=O)c4)C(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccc(CP(C)(C)=O)c4)C(C)C)c4ccccc34)n2)cc(OCCN2CCOCC2)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)c3)c3ccccc23)n(n1)-c1cccc(CP(C)(C)=O)c1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)c3)c3ccccc23)n(n1)-c1cccc(CP(C)(C)=O)c1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OCCN5CCOCC5)cc(OC(F)(F)F)c4)n3)c3ccccc23)n(n1)-c1cccc(CP(C)(C)=O)c1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OCCN5CCOCC5)cc(c4)C(F)(F)F)n3)c3ccccc23)n(n1)-c1cccc(CP(C)(C)=O)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccc(CP(C)(C)=O)c4)C(C)C)c4ccccc34)ccn2)cc(OCCN2CCOCC2)c1
COCCOCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccc(CP(C)(C)=O)c4)C(C)C)c4ccccc34)n2)cc(OC)c1
CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OCCN5CCOCC5)cc(c4)C#N)n3)c3ccccc23)n(n1)-c1cccc(CP(C)(C)=O)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(F)(F)F)C(=O)NCCN4CCOCC4)n3)c3ccccc23)n(n1)-c1cccc(CP(C)(C)=O)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OC(F)(F)F)cc(c4)C(=O)NCCN4CCOCC4)n3)c3ccccc23)n(n1)-c1cccc(CP(C)(C)=O)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccc(CP(C)(C)=O)c4)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OCCN5CCOCC5)cc(c4)C(F)(F)F)n3)c3ccccc23)n(n1)-c1cccc(CP(C)(C)=O)c1
Clc1nc(NCc2ccccn2)c2c(cccc2n1)-c1ccccc1
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3ccccn3)c12)[C@@H]1CCCN1C(=O)\C=C\CN1CCCC1 |r|
Nc1nccn2c(nc(-c3ccc(C(=O)Nc4ccccn4)c(F)c3)c12)C1CCCN1C(=O)C=C
CN(C)CC#CC(=O)N1CCCC1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12
C[C@H](NC(=O)C=C)c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
C[C@H](NC(=O)c1ccnc(Cl)n1)c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C#C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(OCP(C)(C)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCCN5CCOCC5)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)(=O)=O)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)c3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)c3)c3ccccc23)cc(cc1S(C)=O)C(C)(C)C
COc1c(CC(N)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)c2)c2ccccc12)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)c3)c3ccccc23)cc(cc1C(=O)NCCN1CCOCC1)C(C)(C)C
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)n3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)n3)c3ccccc23)cc(cc1OCP(C)(C)=O)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)c3)c3ccccc23)cc(cc1OCP(C)(C)=O)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(C)c5[nH]ncc5c4)n3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cnccn4)n3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cnn(C)n4)n3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cnccn4)c3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cccnc4)c3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COc1cccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)c1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(n3)N(C)C)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COc1cc(F)cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)c1
COc1c(CNS(C)(=O)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)c2)c2ccccc12)C(C)(C)C
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCCN5CCOCC5)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1c(CS(C)(=O)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)c2)c2ccccc12)C(C)(C)C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(OCP(C)(C)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1c(CP(C)(C)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)c2)c2ccccc12)C(C)(C)C
COc1c(CS(C)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)c2)c2ccccc12)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(C)cc(C)c4)c3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COCCOCCOCCOc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CP(C)(C)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(NCc4ccccn4)n3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COc1cccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)c1
COc1cncc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)c1
COc1c(CNC(C)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)c2)c2ccccc12)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccn(C)n4)c3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(N)=O
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)c3)c3ccccc23)cc(cc1C(=O)NCCN1CCC1)C(C)(C)C
COc1cc(CO)cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)c1
COc1c(CC(N)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(NCc3ccccn3)c2)c2ccccc12)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(NCc4ccccn4)c3)c3ccccc23)cc(cc1P(C)(C)=O)C(C)(C)C
COc1c(CC(N)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)cc(C)c3)c2)c2ccccc12)C(C)(C)C
CNC(=O)Cc1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cccc(OC)c4)c3)c3ccccc23)c1OC)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccn1
COc1cc(CO)cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)c1
COc1cncc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)c1
COc1c(CC(N)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccn(C)n3)c2)c2ccccc12)C(C)(C)C
COc1c(CNC(C)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(NCc3ccccn3)c2)c2ccccc12)C(C)(C)C
COc1c(CC(N)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(OS(C)(=O)=O)c3)c2)c2ccccc12)C(C)(C)C
COc1c(CC(N)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(OC(F)F)c3)c2)c2ccccc12)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CS(C)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCOCC1
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CNC(C)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)(=O)=O)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)S(=O)(=O)C1CC1
COc1cccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c(Cl)c3Cl)ccn2)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C#N
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)S(=O)(=O)N(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)(=O)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCS(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)=O)C(C)(C)C)c4ccccc34)ccn2)c1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(NCc4ccccn4)c3)c3ccccc23)cc(cc1S(C)=O)C(C)(C)C
COc1cccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CNC(C)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CNC(C)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(N)=O
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1c(CC(N)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OCCN4CCOCC4)cc(c3)C#N)c2)c2ccccc12)C(C)(C)C
COc1c(CNC(C)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OCCN4CCOCC4)cc(c3)C#N)c2)c2ccccc12)C(C)(C)C
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OCCN5CCOCC5)cc(c4)C#N)c3)c3ccccc23)cc(cc1S(C)=O)C(C)(C)C
COc1c(CNC(C)=O)cc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OCCN4CCOCC4)cc(c3)C(F)(F)F)c2)c2ccccc12)C(C)(C)C
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)(=O)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(N)=O
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)S(C)(=O)=O
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(OCCO)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(N)=O
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)S(=O)(=O)N(C)C
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCCN5CCOCC5)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCCN5CCOCC5)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCCN5CCOCC5)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCCN5CCOCC5)c4OC)C(C)(C)C)c4ccccc34)ccn2)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(=O)NCCN5CCS(=O)CC5)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCS(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(OC(CO)CO)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(N)=O
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCCN1CCS(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCS(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CNC(C)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCS(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)=O)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCC(CO)(CO)CO
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)S(=O)(=O)N(C)CCN1CCOCC1
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CNC(=O)CN(C)C)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)S(=O)(=O)N(C)CCCN1CCOCC1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(OCCCN5CCOCC5)cc(c4)C#N)c3)c3ccccc23)cc(cc1S(C)=O)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)S(C)=O)C(C)(C)C)c4ccccc34)ccn2)ccc1C(O)=O
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(c4OC)P(C)(C)=O)C(C)(C)C)c4ccccc34)ccn2)cc(c1)S(=O)(=O)N(C)CCN1CCN(C)CC1
CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1
CN(C)CCN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1
CN(C)CC1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1
CN(C)CCC1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1
CN(C)CC1CCN(CCn2nc(-c3cnc4[nH]ccc4c3)c3c(N)ncnc23)CC1
CN(C)C1CCN(CCn2nc(-c3cnc4[nH]ccc4c3)c3c(N)ncnc23)CC1
COc1cc(ccc1NC(=O)OC(C)(C)C)-c1nn(CCN2CCC(CN(C)C)CC2)c2ncnc(N)c12
COc1cc(ccc1NC(=O)OC(C)(C)C)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
COc1cc(ccc1NC(=O)OC(C)(C)C)-c1nn(CCN2CCC(CC2)N2CCCC2)c2ncnc(N)c12
COc1cc(ccc1NC(=O)OC(C)(C)C)-c1nn(CCN2CCC(CC2)N2CCCCC2)c2ncnc(N)c12
COc1cc(ccc1NC(=O)CC(C)(C)C)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
COc1cc(ccc1NCc1ccccc1)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
COc1cc(ccc1NC(=O)NC(C)(C)C)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)cc3)c3c(N)ncnc23)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(CC(=O)OC(C)(C)C)cc3)c3c(N)ncnc23)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(CC(O)=O)cc3)c3c(N)ncnc23)CC1
COc1cc(ccc1CC(=O)OC(C)(C)C)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
COc1cc(ccc1Cc1ncc(C)o1)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
COC1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c(OC)c3)c3c(N)ncnc23)CC1
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)n2)cc(c1)C#C
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)cc4)C(C)C)c4ccccc34)n2)cc(c1)C#C
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)cc4)C(C)C)c4ccccc34)n2)cc(c1)C#C
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C
COCCOCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C
COCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(cc4)N(C)C)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(cc4)N(C)C)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(cc4)N(C)C)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C#C
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OC)cc4OC)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccc(CP(C)(C)=O)c4)C(C)(C)C)c4ccccc34)n2)cc(c1)C#C
COCCOCCOCCNC(=O)c1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccc(CP(C)(C)=O)c4)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1
COCCOCCOCCNC(=O)c1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(cc4)N(C)C)C(C)(C)C)c4ccccc34)n2)cc(OC)c1
COc1cc(ccc1Nc1ncc(Cl)c(NCCc2c(F)cccc2Cl)n1)N1CCN(C)CC1
COc1ccccc1CCNc1nc(Nc2ccc(cc2OC)N2CCN(C)CC2)ncc1Cl
COc1cc(ccc1Nc1ncc(Cl)c(NC[C@H]2CCCO2)n1)N1CCN(C)CC1 |r|
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCOCC1
COCCOCCOCCNC(=O)c1ccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc1OC
COCCOCCOCCNC(=O)c1ccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(C(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc1OC
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCS(=O)CC1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc(OCCN5CCOCC5)c(c4)C#N)c3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C
COCCOCCOCCS(=O)c1ccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc1OC
COCCOCCOCCS(=O)(=O)c1ccc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc1OC
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1S(=O)(=O)N(C)CCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCC1CCN(C)CC1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc(C(=O)NCCN5CCOCC5)c(c4)C#C)c3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCOCCOCCO
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCN(C)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NC1CCN(C)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCOCC1(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCSCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCC(O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1S(=O)(=O)N(C)CCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCCCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCS(=O)(=O)CC1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc(cc4)C(=O)NCCN4CCOCC4)c3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)N[C@@H](C)CN1CCOCC1 |r|
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCCN1CCN(C)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1C(=O)NCCN1CCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)N(C)CCCN1CCS(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)N(C)CCCN1CCS(=O)(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCCN1CCCOCC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCC1CCN(C)CC1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc(C(O)=O)c(c4)N(C)C)c3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NC(CO)(CO)CO
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NC(=O)COP(O)(O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCS(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCOCCOCCOP(O)(O)=O
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1S(=O)(=O)CCCN1CCOCC1
COc1c(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc(C(=O)NCCN5CCOCC5)c(c4)N(C)C)c3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1C(=O)NCCN1CCN(C)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1C(=O)NCCOCCOCCO
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1C(=O)NCCN(C)C
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1S(=O)(=O)CCOCCOCCO
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NC(=O)CO)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCS(=O)CC1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NC[C@H](O)[C@H](O)[C@H](O)CO |r|
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1P(C)(O)=O
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1S(=O)(=O)CC(CO)(CO)CO
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OC)c1C(=O)NCCOCCOCCOP(O)(O)=O
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(N(CCO)S(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)ccc1C(=O)NCCN1CCS(=O)CC1
CNc1cc(cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4cc(cc(c4)C(=O)NCCN4CCOCC4)C#C)n3)c3ccccc23)c1OC)C(C)(C)C
CC(C)c1nc(-c2cnc3ccccc3c2)c2c(N)nccn12
CC(C)n1nc(-c2ccc3n(C)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3ccccc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3c(C)cccc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3c(Cl)cccc3[nH]2)c2c(N)ncnc12
CCCCOc1ccc2cc(ccc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2ccc3cc(OCc4cc(C)ccc4C)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3cc(OCc4ccccc4C)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3cc(OCc4cc(ccc4C)C(F)(F)F)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3cc(OCc4ccc(CC(F)(F)F)c(Cl)c4)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3cc(OCc4cc(F)cc(Cl)c4)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3cc(OC(C)c4ccccc4)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3cc(OCc4ccc(cc4)C(C)(C)C)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3cc(OCc4ccncc4)ccc3c2)c2c(N)ncnc12
Cn1ccc2cc(ccc12)-c1nn(CC2CCNCC2)c2ncnc(N)c12
CN(C)c1ccc2cc(ccc2c1)-c1nn(CC2CCNCC2)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nc(n2ccnc(N)c12)C(C)(C)C
Cn1ccc2cc(ccc12)-c1nc(n2ccnc(N)c12)C(C)(C)C
COc1ccc2cc(ccc2c1)-c1nc(n2ccnc(N)c12)C(C)(C)C
CC(C)(C)c1nc(-c2cnc3ccccc3c2)c2c(N)nccn12
Cc1cccc2[nH]c(cc12)-c1nc(n2ccnc(N)c12)C(C)(C)C
CC(C)(C)c1nc(-c2ccc3ccccc3c2)c2c(N)nccn12
CC(C)n1nc(-c2ccc3cc(OC(=O)c4cccc(Cl)c4)ccc3c2)c2c(N)ncnc12
Nc1ncnc2n(C[C@H]3SSC[C@@H]3O)nc(-c3ccc(Oc4ccccc4)cc3)c12 |r|
Nc1ncnc2n(C[C@@H]3SSC[C@H]3O)nc(-c3ccc(Oc4ccccc4)cc3)c12 |r|
Nc1ncnc2n(C[C@@H]3SSC[C@@H]3O)nc(-c3ccc(Oc4ccccc4)cc3)c12 |r|
Nc1ncnc2n(C[C@H]3SSC[C@H]3O)nc(-c3ccc(Oc4ccccc4)cc3)c12 |r|
CN(C)C[C@@H](NC(=O)N1Cc2c(Nc3cccc(NC(=O)c4ccc(NC(=O)C=C)cc4)c3)n[nH]c2C1(C)C)c1ccccc1 |r|
COC\C=C\C(=O)N1CCCCC[C@H]1c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
CC(C)(C)n1c2c(c(n1)Cc3cccc(c3)Cl)c(ncn2)N
Nc1ncnc2n(CC3CCNCC3)nc(Cc3cccc(Cl)c3)c12
CC(C)(C)n1nc(Cc2cc(F)cc(F)c2)c2c(N)ncnc12
Nc1ncnc2n(CC3CCNCC3)nc(Cc3cc(F)cc(F)c3)c12
CC(C)(C)n1c2c(c(ncn2)N)c(n1)Nc3cccc(c3)Cl
Nc1ncnc2n(CC3CCNCC3)nc(Nc3cccc(Cl)c3)c12
CC(C)(C)n1c2c(c(ncn2)N)c(n1)Sc3cccc(c3)Cl
Cc1cccc(Sc2nn(c3ncnc(N)c23)C(C)(C)C)c1
CC(C)(C)n1c2c(c(ncn2)N)c(n1)Oc3cccc(c3)Cl
CC(C)(C)n1nc(Oc2cccc(c2)C(F)(F)F)c2c(N)ncnc12
Cc1cccc(Oc2nn(c3ncnc(N)c23)C(C)(C)C)c1
CC(C)(C)n1nc(Oc2cccc(Br)c2)c2c(N)ncnc12
COc1cccc(Oc2nn(c3ncnc(N)c23)C(C)(C)C)c1
CC(C)(C)n1nc(Oc2cc(F)cc(F)c2)c2c(N)ncnc12
c1cc(cc(c1)Cl)Oc2c3c(ncnc3n(n2)CC4CCNCC4)N
Nc1ncnc2n(CC3CCNCC3)nc(Oc3ccc(F)c(Cl)c3)c12
Nc1ncnc2n(Cc3ccncc3)nc(Oc3cccc(Cl)c3)c12
Nc1ncnc2n(CC3CCCNC3)nc(Oc3cccc(Cl)c3)c12
Nc1ncnc2n(CC3CCNC3)nc(Oc3cccc(Cl)c3)c12
Nc1ncnc2n(CC3CNC3)nc(Oc3cccc(Cl)c3)c12
Nc1ncnc2n(CC3CCNCC3(F)F)nc(Oc3cccc(Cl)c3)c12
CN1CCC(Cn2nc(Oc3cccc(Cl)c3)c3c(N)ncnc23)CC1
Nc1ncnc2n(CC3CCNC(=O)C3)nc(Oc3cccc(Cl)c3)c12
Nc1ncnc2n(CC3CCOCC3)nc(Oc3cccc(Cl)c3)c12
Cc1cccc(Sc2nn(CC3CCNCC3)c3ncnc(N)c23)c1
Nc1ncnc2n(CC3(CC3)C(F)(F)F)nc(Oc3cccc(Cl)c3)c12
CC(C)(C)n1nc(Cc2csc3ccccc23)c2c(N)ncnc12
CC(C)(C)n1nc(Cc2coc3ccccc23)c2c(N)ncnc12
CC(C)(C)n1c2c(c(n1)Cc3c[nH]c4c3cccc4)c(ncn2)N
Nc1ncnc2n(CC3(CC3)C(F)(F)F)nc(Cc3c[nH]c4ccccc34)c12
Nc1ncnc2n(CC3CCNCC3)nc(Cc3c[nH]c4ccccc34)c12
CC(C)(C)n1nc(Sc2c[nH]c3ccccc23)c2c(N)ncnc12
Cc1cc(NC(=O)c2nn(CC3CCC3)c3ncnc(N)c23)n[nH]1
Nc1ncnc2n(CC3CCCC3)nc(C(=O)Nc3cc(Br)[nH]n3)c12
Cc1cc(NC(=O)c2nn(C3CC4CCC3C4)c3ncnc(N)c23)n[nH]1 |TLB:9:10:13.14:16|
Cc1cc(NC(=O)c2nn(C(=C)CF)c3ncnc(N)c23)n[nH]1
CC(C)n1nc(C(=O)Nc2cc(C)n[nH]2)c2c(N)ncnc12
CC(C)(C)n1nc(C(=O)Nc2cc([nH]n2)C(F)(F)F)c2c(N)ncnc12
CC(C)(C)n1nc(C(=O)Nc2cc([nH]n2)C#N)c2c(N)ncnc12
CCc1cc(NC(=O)c2nn(c3ncnc(N)c23)C(C)(C)C)[nH]n1
CC(C)n1cc(C(=O)Nc2cc(C)[nH]n2)c2c(N)ncnc12
Cc1cc(NC(=O)c2cn(C3CCC(C)(C)CC3)c3ncnc(N)c23)n[nH]1
Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C(C)(C)C)n[nH]1
Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C(C)(C)CF)n[nH]1
Cc1cc(n[nH]1)NC(=O)c2cn(c3c2c(ncn3)N)C4(CC4)C
Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C(C)(C)C2CC2)n[nH]1
COCC(C)(C)n1cc(C(=O)Nc2cc(C)[nH]n2)c2c(N)ncnc12
Cc1cc(CC(=O)c2cn(c3ncnc(N)c23)C(C)(C)c2cccs2)n[nH]1
Cc1cc(NC(=O)c2cn(C3CCC(F)(F)C3)c3ncnc(N)c23)n[nH]1
Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C23CC(C2)C3)n[nH]1
CC(C)(C)n1cc(C(=O)Nc2cc(Br)[nH]n2)c2c(N)ncnc12
CC(C)n1cc(C(=O)Nc2cc(Br)[nH]n2)c2c(N)ncnc12
CC1(CC1)n1cc(C(=O)Nc2cc(Br)n[nH]2)c2c(N)ncnc12
Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C2(C)CCC2)n[nH]1
Cc1cc(NC(=O)c2cn(C3CC4CCC3C4)c3ncnc(N)c23)n[nH]1
Cc1cc(NC(=O)c2cn(C3CCCC3)c3ncnc(N)c23)n[nH]1
Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C2(CC2)C2CC2)n[nH]1
Cc1cc(NC(=O)c2c(C#CC(C)(C)O)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Cc1cc(NC(=O)c2c(C#Cc3cccnc3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Cc1cc(NC(=O)c2c(C#CC3(O)CCCC3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Cc1cc(NC(=O)c2c(C#Cc3cnn(C)c3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Cc1cc(NC(=O)c2c(C#Cc3cncn3C)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Cc1cc(NC(=O)c2c(C#CCN3CCOCC3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Cc1cc(NC(=O)c2c(C#CCC3(O)CCC3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Cc1cc(NC(=O)c2c(C#CC3CCOCC3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
C[C@H]1CNC(=O)c2cnn3c2nc(cc3)N[C@@H](c4cc(ccc4O1)F)C
CCC(NC(=O)c1ccc(C2CC2)c(c1)-c1ccc2nc(Nc3cnn(c3)C3CC3)ncc2c1)c1cccc(c1)C(F)(F)F
CC(NC(=O)c1ccc(C2CC2)c(c1)-c1ccc2nc(Nc3cnn(c3)C3CC3)ncc2c1)c1cccc(c1)C(F)(F)F
CC(NC(=O)c1cccc(c1)C(F)(F)F)c1ccc(C2CC2)c(c1)-c1ccc2nc(Nc3cnn(c3)C3CC3)ncc2c1
CCc1ccc(cc1-c1ccc2nc(Nc3cnn(C)c3)ncc2c1)C(C)NC(=O)c1cccc(c1)C(F)(F)F
FC(F)(F)c1cccc(NC(=O)c2ccc(C3CC3)c(c2)-c2ccc3nc(Nc4cnn(c4)C4CC4)ncc3c2)c1
Cc1ccnc(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
Cc1cccnc1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)nccc2Br)cc(n1)N1CCN(CCO)CC1
Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cncc2Cl)cc(n1)N1CCN(CCO)CC1
Cc1cncc(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
Cc1nc(Nc2ncc(s2)C(=O)Nc2cccnc2C)cc(n1)N1CCN(CCO)CC1
Cc1csc(Cl)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
Cc1nn(C)c(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
Cc1noc(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
CN1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(Cl)ccnc2C)nc(C)n1
Cc1nc(NCCO)cc(Nc2ncc(s2)C(=O)Nc2c(Cl)ccnc2C)n1
Cc5nc(Nc3ncc(C(=O)NC1CN2CCC1CC2)s3)cc(N4CCN(CCO)CC4)n5
Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)nccc2Cl)cc(n1)N1CCN(CCO)CC1
CCN1Cc2c(ccc(c2C#N)F)O[C@H](CNC(=O)c3c(nn4c3nc1cc4)N)C
CCN1Cc2c(O[C@@H](C)COC(=O)c3cnn4ccc1nc34)ccc(F)c2C#N |r|
CCN1Cc2c(O[C@@H](C)COC(=O)c3c(N)nn4ccc1nc34)ccc(F)c2C#N |r|
C[C@H]1COC(=O)c2cnn3ccc(N[C@H](C)c4cc(F)ccc4O1)nc23 |r|
Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCCN1C(=O)C=C |r|
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC4CC4)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC4(C)CC4)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC4CCC4)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC4(C)CCC4)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC4C5CC4C5)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC45CC(C4)C5)c4c3OCO4)c3c(N)ncnc32)CC1
CC(C)OC(=O)Nc1ccc(-c2nn(CCN3CCC(N(C)C)CC3)c3ncnc(N)c23)c2c1OCO2
CCOC(=O)Nc1ccc(-c2nn(CCN3CCC(N(C)C)CC3)c3ncnc(N)c23)c2c1OCO2
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC4CC(F)(F)C4)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC4CCCC4)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC4COC4)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3cc(F)c(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3c(F)cc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3cnc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCn2nc(-c3ncc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C1CC1)C1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
CC(C)(C)OC(=O)Nc1ccc(-c2nn(CCN3CCC(N4CCCC4)CC3)c3ncnc(N)c23)c2c1OCO2
CN(C)[C@H]1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)C1
CN(C)[C@@H]1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)C1
CC(C)(C)OC(=O)Nc1ccc(-c2nn(CCN3CCN(CCO)CC3)c3ncnc(N)c23)c2c1OCO2
CN(C)CCN1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)CC1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
CN(C)CCC1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
COCCN1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
CC(C)(C)OC(=O)Nc1ccc(-c2nn(CCN3CCC(C#N)CC3)c3ncnc(N)c23)c2c1OCO2
CN1CCN(C2CCN(CCn3nc(-c4ccc(NC(=O)OC(C)(C)C)c5c4OCO5)c4c(N)ncnc43)CC2)CC1
CN1CC(OC(=O)Nc2ccc(-c3nn(CCN4CCC(N5CCC5)CC4)c4ncnc(N)c34)c3c2OCO3)C1
CN1CCC2(CC1)CCN(CCn1nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc31)CC2
CN(C)CCN(C)CCn1nc(-c2ccc(NC(=O)OC(C)(C)C)c3c2OCO3)c2c(N)ncnc21
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OC(F)(F)O4)c3c(N)ncnc32)CC1
CN(C)C1CCN(CCCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
CC(C)(C)OC(=O)Nc1ccc(-c2nn(CCN3CCC(N4CCOCC4)CC3)c3ncnc(N)c23)c2c1OCO2
COC1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1
COc1cc(-c2nn(CCN3CCC(N(C)C)CC3)c3ncnc(N)c23)ccc1NC(=O)OC1(C)CC1
COc1cc(-c2nn(CCN3CCC(N(C)C)CC3)c3ncnc(N)c23)ccc1NC(=O)OC1CCC1
COc1cc(-c2nn(CCN3CCC(N(C)C)CC3)c3ncnc(N)c23)ccc1NC(=O)OC1(C)CCC1
COc1cc(-c2nn(CCN3CCC(N(C)C4CC4)CC3)c3ncnc(N)c23)ccc1NC(=O)OC(C)(C)C
COc1cc(-c2nn(CCN3CCC(N(C)C)CC3)c3ncnc(N)c23)ccc1NC(=O)OC1CC1
COc1cc(-c2nn(CCN3CCC(N(C)C)CC3)c3ncnc(N)c23)ccc1NC(=O)OC1C2CC1C2
COc1cc(-c2nn(CCN3CCC(N(C)C)CC3)c3ncnc(N)c23)ccc1NC(=O)OC12CC(C1)C2
COc1cc(-c2nn(CCN3CCC(N(C)C4CC4)CC3)c3ncnc(N)c23)ccc1NC(=O)OC1(C)CCC1
COc1cc(-c2nn(CCN3CCC(N(C)C4CC4)CC3)c3ncnc(N)c23)ccc1NC(=O)OC1(C)CC1
COc1cc(-c2nn(CCN3CCC(N(C)C)CC3)c3ncnc(N)c23)ccc1NC(=O)OC1CC(F)(F)C1
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)c1ccc2ccccc2c1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)c1cccc2ccccc12)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)C(CCC(O)=O)NC(=O)C(CCC(O)=O)NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)c1cccc(O)c1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](NC(=O)[C@H](Cc1ccc(cc1)P(O)(O)=O)NC(C)=O)C(=O)N(C)CCCC1CCCCC1
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCC(O)=O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCC(O)=O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(O)=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC1CCCCC1)C(N)=O
CN(CCCC1CCCCC1)C(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(C)=O
CC(=O)N[C@@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC1CCCCC1)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)Cc1ccc(OP(O)(O)=O)cc1)C(O)=O
COC(=O)C(O)(O)C(=O)c1ccccc1
COC(=O)C(=O)C(=O)c1ccc(CC(NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(N)=O)cc1
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(Cc1ccc(cc1)C(=O)C(=O)C(=O)OC)NC(C)=O)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cccc(c1)C(=O)C(O)(O)C(=O)OC)C(N)=O
COc1ccc(cc1)C1Sc2ccccc2N(CCCC2CCCCC2)C(=O)C1NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)OC(C)(C)C
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NC1CSc2ccccc2N(CCCC2CCCCC2)C1=O
COc1ccc(cc1)C1Sc2ccccc2N(CCCC2CCCCC2)C(=O)C1NC(=O)[C@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)NC(=O)OC(C)(C)C
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)C(=O)NC1CSc2ccccc2N(CCCC2CCCCC2)C1=O
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)Nc2cccc3ccccc23)C(=O)C1NC(=O)[C@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)NC(=O)OC(C)(C)C
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NC1CSCCN(CCCC2CCCCC2)C1=O
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)NCc2cccc3ccccc23)C(=O)C1NC(=O)[C@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)NC(=O)OC(C)(C)C
COc1ccc(CC(CO)n2cc(-c3cccc(O)c3)c3c(N)ncnc23)cc1
COc1cccc(c1)-c1cn(C2CCCC2)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3ccccc3)c12)C1CC(O)C1 |(8.66,-6.66,;8.68,-8.19,;7.34,-8.98,;7.34,-10.53,;8.68,-11.3,;10.02,-10.52,;11.49,-10.99,;12.4,-9.74,;11.48,-8.49,;11.95,-7.02,;10.91,-5.89,;11.37,-4.43,;12.89,-4.08,;13.92,-5.22,;13.45,-6.7,;10.02,-8.98,;11.98,-12.45,;11.29,-13.82,;12.67,-14.51,;13.17,-15.96,;13.35,-13.13,)|
COc1ccc(CC(CO)n2cc(-c3ccccc3)c3c(N)ncnc23)cc1
COc1cccc(c1)-c1cn(C2CC(CNCCO)C2)c2ncnc(N)c12 |(14.75,.72,;13.65,1.79,;12.17,1.37,;11.09,2.44,;9.6,2.05,;9.2,.58,;10.29,-.51,;11.76,-.12,;9.88,-1.99,;10.79,-3.23,;9.88,-4.49,;10.3,-5.98,;9.39,-7.22,;10.64,-8.14,;10.88,-9.67,;12.31,-10.23,;13.51,-9.27,;13.28,-7.75,;14.48,-6.79,;11.55,-6.89,;8.42,-4.01,;7.09,-4.78,;5.75,-4.01,;5.75,-2.47,;7.09,-1.7,;7.09,-.16,;8.42,-2.47,)|
COc1cccc(c1)-c1cn(C2CC(CO)C2)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)C1CCCC1
Nc1ncnc2n(cc(-c3ccc(O)cc3)c12)C1CCCC1
Nc1ncnc2n(cc(-c3ccccc3)c12)C1CCCC1
Nc1ncnc2n(cc(-c3ccccc3)c12)[C@@H](CO)c1ccccc1 |r|
Nc1ncnc2n(cc(-c3ccccc3)c12)C1CCC1
Nc1ncnc2n(cc(-c3ccc(O)cc3)c12)C1CCC1
COc1cccc(c1)-c1cn(C2CCC2)c2ncnc(N)c12
COCCOc1cc2Nc3ncnc(Nc4cc(OC)c(Cl)cc4Cl)c3Cc2cc1OC
COc1cc(Nc2ncnc3nc4cc(OC)c(OC)cc4cc23)c(Cl)cc1Cl
COCCOc1cc2Cc3c(Nc4cc(OC)c(Cl)cc4Cl)ncnc3Nc2cc1OC
COCCOc1cc2Nc3ncnc(Nc4ccc(Cl)cc4Cl)c3Cc2cc1OC
COc1cc(Nc2ncnc3Nc4cc(OC)c(OC)cc4Cc23)c(Cl)cc1Cl
N[C@H]1CC[C@@H](CC1)Nc1nc(Nc2ccccc2)c2ncn(C3CCCC3)c2n1 |wU:4.7,wD:1.0,(14.91,1.09,;14.91,-.45,;13.57,-1.22,;13.57,-2.76,;14.91,-3.53,;16.24,-2.76,;16.24,-1.22,;14.91,-5.07,;13.57,-5.84,;13.57,-7.38,;12.24,-8.15,;12.24,-9.69,;10.9,-10.46,;10.9,-12,;9.57,-12.77,;8.24,-12,;8.24,-10.46,;9.57,-9.69,;10.9,-7.38,;9.44,-7.85,;8.54,-6.61,;9.44,-5.36,;8.96,-3.9,;7.5,-3.42,;7.5,-1.88,;8.96,-1.41,;9.87,-2.65,;10.9,-5.84,;12.24,-5.07,)|
OP(O)(=O)CP(O)(=O)CCCNc1nc(Nc2ccccc2)c2ncn(C3CCCC3)c2n1
CN(C)CCNc1nc(Nc2ccccc2)c2ncn(C3CCCC3)c2n1
N[C@H]1CC[C@@H](CC1)Nc1nc(Nc2ccc(c(c2)P(O)(O)=O)P(O)(O)=O)c2ncn(C3CCCC3)c2n1 |wU:4.7,wD:1.0,(14.8,-4.02,;14.8,-5.56,;13.47,-6.33,;13.47,-7.87,;14.8,-8.64,;16.13,-7.87,;16.13,-6.33,;14.8,-10.18,;13.47,-10.95,;13.47,-12.49,;12.13,-13.26,;12.13,-14.8,;13.47,-15.57,;14.8,-14.8,;16.13,-15.57,;16.13,-17.11,;14.8,-17.88,;13.47,-17.11,;14.8,-19.42,;14.8,-20.96,;16.26,-19.9,;13.26,-19.42,;17.47,-17.88,;18.8,-18.65,;18.24,-16.55,;16.7,-19.22,;10.8,-12.49,;9.33,-12.97,;8.43,-11.72,;9.33,-10.48,;8.86,-9.01,;7.39,-8.54,;7.39,-7,;8.86,-6.52,;9.76,-7.77,;10.8,-10.95,;12.13,-10.18,)|
OC(CCCNc1nc(Nc2ccccc2)c2ncn(C3CCCC3)c2n1)(P(O)(O)=O)P(O)(O)=O
N[C@H]1CC[C@@H](CC1)Nc1nc(Nc2ccc(cc2)P(O)(=O)CP(O)(O)=O)c2ncn(C3CCCC3)c2n1 |wU:1.0,wD:4.7,(20.04,-12.53,;18.7,-11.76,;17.37,-12.53,;16.03,-11.76,;16.03,-10.22,;17.37,-9.45,;18.7,-10.22,;14.7,-9.45,;13.37,-10.22,;13.37,-11.76,;12.03,-12.53,;12.03,-14.07,;10.7,-14.84,;10.7,-16.38,;9.37,-17.15,;8.03,-16.38,;8.03,-14.84,;9.37,-14.07,;6.7,-17.15,;5.93,-15.82,;7.47,-18.48,;5.37,-17.92,;4.03,-17.15,;3.26,-18.48,;4.8,-15.82,;2.7,-16.38,;10.7,-11.76,;9.24,-12.24,;8.33,-10.99,;9.24,-9.74,;8.76,-8.28,;7.3,-7.8,;7.3,-6.26,;8.76,-5.79,;9.66,-7.03,;10.7,-10.22,;12.03,-9.45,)|
N[C@H]1CC[C@@H](CC1)Nc1nc(Nc2ccc(cc2)C(P(O)(O)=O)P(O)(O)=O)c2ncn(C3CCCC3)c2n1 |wU:1.0,wD:4.7,(20.92,-8.7,;19.58,-7.93,;18.25,-8.7,;16.92,-7.93,;16.92,-6.39,;18.25,-5.62,;19.58,-6.39,;15.58,-5.62,;14.25,-6.39,;14.25,-7.93,;12.91,-8.7,;12.91,-10.24,;11.58,-11.01,;11.58,-12.55,;10.25,-13.32,;8.91,-12.55,;8.91,-11.01,;10.25,-10.24,;7.58,-13.32,;6.25,-12.55,;5.48,-13.88,;7.02,-11.22,;4.91,-11.78,;7.58,-14.86,;6.04,-14.86,;9.12,-14.86,;7.58,-16.4,;11.58,-7.93,;10.12,-8.41,;9.21,-7.16,;10.12,-5.91,;9.64,-4.45,;8.18,-3.97,;8.18,-2.43,;9.64,-1.96,;10.55,-3.2,;11.58,-6.39,;12.91,-5.62,)|
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(C)CC3)c2c1
CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CC(O)=O)CC3)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCC(N)=O)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CN3CCOCC3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CCO)CC3)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCC(O)CC3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCC(N)=O)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(C)CC3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CC(O)=O)CC3)c2c1
C[C@H](Nc1cc(ccn1)-c1sc(nc1-c1ccc(F)cc1)C1CCN(C)CC1)c1ccccc1
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)[C@H](CCC(N)=O)NC(C)=O)C(=O)N1CCC[C@H]1C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](CCC(N)=O)NC(C)=O)C(=O)N1CCC[C@H]1C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](CCC(N)=O)NC(C)=O)C(=O)N1CCC[C@H]1C(N)=O
CC1(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
OCC(O)CO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2ccccc12
Cn1c(SSc2c(C(=O)c3ccc(cc3)C(O)=O)c3ccccc3n2C)c(C(=O)c2ccc(cc2)C(O)=O)c2ccccc12
Cn1c(SSc2c(C(=O)Nc3cccs3)c3ccccc3n2C)c(C(=O)Nc2cccs2)c2ccccc12
OC(=O)CCc1c(SSc2[nH]c3ccccc3c2CCC(O)=O)[nH]c2ccccc12
NC(Cc1c(SSc2[nH]c3ccccc3c2CC(N)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1
Cn1c(SSc2c(C(=O)NCC(O)=O)c3ccccc3n2C)c(C(=O)NCC(O)=O)c2ccccc12
Cn1c(SSc2c(C(=O)NCC(O)CO)c3ccccc3n2C)c(C(=O)NCC(O)CO)c2ccccc12
Cn1c(SSc2c(C(=O)Nc3ccncc3)c3ccccc3n2C)c(C(=O)Nc2ccncc2)c2ccccc12
S(Sc1[nH]c2ccccc2c1-c1ccccc1)c1[nH]c2ccccc2c1-c1ccccc1
CN(C(=O)c1c(SSc2c(C(=O)N(C)c3ccccc3)c3ccccc3n2C)n(C)c2ccccc12)c1ccccc1
CN(C)CCNC(=O)c1c(SSc2c(C(=O)NCCN(C)C)c3ccccc3n2C)n(C)c2ccccc12
CNC(=O)c1c(SSc2c(C(=O)NC)c3ccccc3n2C)n(C)c2ccccc12
Cn1c(SSc2c(C(=O)NCc3ccc(cc3)C(O)=O)c3ccccc3n2C)c(C(=O)NCc2ccc(cc2)C(O)=O)c2ccccc12
COC(=O)c1ccc(NC(=O)c2c(SSc3c(C(=O)Nc4ccc(cc4)C(=O)OC)c4ccccc4n3C)n(C)c3ccccc23)cc1
Cc1ccc(cc1)S(=O)(=O)c1c(SSc2[nH]c3ccccc3c2S(=O)(=O)c2ccc(C)cc2)[nH]c2ccccc12
Cn1c(SSc2c(C(=O)c3ccccc3)c3ccccc3n2C)c(C(=O)c2ccccc2)c2ccccc12
COC(=O)c1ccc(CNC(=O)c2c(SSc3c(C(=O)NCc4ccc(cc4)C(=O)OC)c4ccccc4n3C)n(C)c3ccccc23)cc1
CCn1c(SSc2c(C(=O)Nc3ccccc3)c3ccccc3n2CC)c(C(=O)Nc2ccccc2)c2ccccc12
Cn1c(SSc2c(C(=O)Nc3cccnc3)c3ccccc3n2C)c(C(=O)Nc2cccnc2)c2ccccc12
Cn1c(SSc2c(C(=O)NCc3ccccc3)c3ccccc3n2C)c(C(=O)NCc2ccccc2)c2ccccc12
Cn1c(SSc2c(C(=O)Nc3ccccc3)c3cc(ccc3n2C)C(F)(F)F)c(C(=O)Nc2ccccc2)c2cc(ccc12)C(F)(F)F
Cn1c(SSc2c(C(=O)Nc3ccc(cc3)C(O)=O)c3ccccc3n2C)c(C(=O)Nc2ccc(cc2)C(O)=O)c2ccccc12
Cn1c(SSc2c(C(=O)Nc3ccccc3)c3cc(Cl)ccc3n2C)c(C(=O)Nc2ccccc2)c2cc(Cl)ccc12
CNC(=O)c1c(SSc2[nH]c3ccccc3c2C(=O)NC)[nH]c2ccccc12
CC(=O)c1c(SSc2c(C(C)=O)c3ccccc3n2C)n(C)c2ccccc12
COC(=O)c1ccc(cc1)C(=O)c1c(SSc2c(C(=O)c3ccc(cc3)C(=O)OC)c3ccccc3n2C)n(C)c2ccccc12
Cn1c(SSc2c(C#N)c3ccccc3n2C)c(C#N)c2ccccc12
O=C(NCc1ccccc1)c1c(SSc2[nH]c3ccccc3c2C(=O)NCc2ccccc2)[nH]c2ccccc12
Cn1c(SSc2c(C(N)=O)c3ccccc3n2C)c(C(N)=O)c2ccccc12
COC(=O)c1cccc(NC(=O)c2c(SSc3c(C(=O)Nc4cccc(c4)C(=O)OC)c4ccccc4n3C)n(C)c3ccccc23)c1
Cn1c(SSc2c(C(=O)Nc3cccc(c3)C(O)=O)c3ccccc3n2C)c(C(=O)Nc2cccc(c2)C(O)=O)c2ccccc12
COC(=O)c1ccccc1NC(=O)c1c(SSc2c(C(=O)Nc3ccccc3C(=O)OC)c3ccccc3n2C)n(C)c2ccccc12
O=C(Nc1ccccc1)c1c(SSc2[nH]c3ccccc3c2C(=O)Nc2ccccc2)[nH]c2ccccc12
Cn1c(SSc2c(C(=O)Nc3ccccc3)c3ccccc3n2C)c(C(=O)Nc2ccccc2)c2ccccc12
Cc1c(SSc2c(C)c3ccccc3n2C)n(C)c2ccccc12
CN(C)C(=O)c1c(SSc2c(C(=O)N(C)C)c3ccccc3n2C)n(C)c2ccccc12
Cn1c(SSc2c(C(=O)Nc3ccccn3)c3ccccc3n2C)c(C(=O)Nc2ccccn2)c2ccccc12
Cn1c(SSc2c(C(=O)Nc3ccccc3C(O)=O)c3ccccc3n2C)c(C(=O)Nc2ccccc2C(O)=O)c2ccccc12
Cn1c(SSc2c(C(=O)c3ccco3)c3ccccc3n2C)c(C(=O)c2ccco2)c2ccccc12
Nc1ccc(cc1)-c1cc(=O)c2cc(N)cc(N)c2o1
Nc1cccc(c1)-c1cc(=O)c2cc(N)c(O)cc2o1
Nc1cccc(c1)-c1cc(=O)c2cc(N)ccc2o1
Nc1ccc(cc1)-c1cc(=O)c2c(N)c(O)c(N)cc2o1
COc1cc(N)c2oc(cc(=O)c2c1)-c1cccc(N)c1
Nc1cccc(c1)-c1cc(=O)c2c(N)c(O)c(N)cc2o1
Nc1ccc(cc1)-c1cc(=O)c2c(O)ccc(N)c2o1
COc1cc(N)c2oc(cc(=O)c2c1)-c1ccc(N)cc1
Nc1ccc(cc1)-c1cc(=O)c2ccc(O)c(N)c2o1
COc1ccc(N)c2oc(cc(=O)c12)-c1ccc(N)cc1
Nc1ccc(cc1)-c1cc(=O)c2cccc(N)c2o1
Nc1ccc(cc1)-c1cc(O)c2c(ccc(N)c2=O)o1
Nc1ccc(cc1)-c1cc(=O)c2cc(N)ccc2o1
Nc1ccc(cc1)-c1cc(=O)c2cc(N)c(O)cc2o1
Nc1ccc(cc1)-c1cc(=O)c2cc(N)c(O)c(N)c2o1
Nc1ccc(cc1)-c1cc(=O)c2cc(O)cc(N)c2o1
COc1cccc(c1OP(=O)(O)O)C=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccccc2)C1=O |r|
c1ccc(c(c1)C=O)OP(=O)(O)O
c1ccc(cc1)C(C(=O)O)C(=O)O
c1ccc(cc1)OP(=O)(O)O
c1ccc(cc1)[C@H](C(=O)O)S(=O)(=O)O
OC(=O)C(c1ccc(O)cc1)S(O)(=O)=O
Cc1cc(c(c(c1)C=O)OP(=O)(O)O)C=O
OP(O)(=O)Oc1cccc(C=O)c1
O=C1NC(=O)c2cc3N(CCN(c4ccccc4)c3cc12)c1ccccc1
O=C1NC(=O)c2cc(NC3CCCCC3)c(NC3CCCCC3)cc12
Oc1ccc(Nc2cc3C(=O)NC(=O)c3cc2Nc2ccc(O)cc2)cc1
Fc1ccc(Nc2cc3C(=O)NC(=O)c3cc2Nc2ccc(F)cc2)cc1
O=C1NC(=O)c2cc(Nc3ccccc3)c(Nc3ccccc3)cc12
COc1ccc(Nc2cc3C(=O)NC(=O)c3cc2Nc2ccccc2)cc1
CN(c1ccccc1)c1cc2C(=O)NC(=O)c2cc1Nc1ccccc1
CCN(CC)c1ccc(Nc2cc3C(=O)NC(=O)c3cc2Nc2ccc(cc2)N(CC)CC)cc1
CN(c1ccccc1)c1cc2C(=O)NC(=O)c2cc1N(C)c1ccccc1
Cc1ccc(Nc2cc3C(=O)NC(=O)c3cc2Nc2ccc(C)cc2)cc1
CN(C)S(=O)(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1
[O-][N+](=O)c1ccc2[nH]c-3c(CC(=O)Nc4ccc(CCC#N)cc-34)c2c1
CC(C)N1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCN(CC1)C1CCNCC1
Nc1ncnc2n(nc(-c3ccc(Cl)cc3)c12)-c1cccc(c1)-c1cnnn1Cc1cccc(\C=C\C(=O)NO)c1
Nc1ncnc2n(nc(-c3ccc(Cl)cc3)c12)-c1cccc(c1)-c1cnnn1Cc1ccc(\C=C\C(=O)NO)cc1
Nc1ncnc2n(nc(-c3ccc(Cl)cc3)c12)-c1cccc(c1)-c1cnnn1CCCCCC(=O)NO
Nc1ncnc2n(nc(-c3ccc(Cl)cc3)c12)-c1cccc(c1)-c1cnnn1CCCCCCCC(=O)NO
Nc1ncnc2n(nc(-c3ccc(Cl)cc3)c12)-c1cccc(c1)-c1cnnn1CCCCCCC(=O)NO
ONC(=O)CCCCCn1nncc1-c1ccccc1
Nc1ncnc2n(nc(-c3ccc(Cl)cc3)c12)-c1ccccc1
Nc1ncnc2n(nc(-c3ccc(Cl)cc3)c12)-c1cccc(c1)-c1cn(CCCCCC(=O)NO)nn1
Oc1cccc(Nc2ccnc3[nH]c4ccccc4c23)c1
Clc1cccc(Nc2ncnc3[nH]c4ccccc4c23)c1
Cc1[nH]c2ncnc(Nc3cccc(Cl)c3)c2c1-c1ccccc1
Brc1cccc(Nc2ncnc3[nH]c4CCCCc4c23)c1
Cc1[nH]c2ncnc(Nc3cccc(C)c3)c2c1C
Cc1[nH]c2ncnc(Nc3ccccc3)c2c1C
Clc1cccc(Nc2ncnc3[nH]c4CCCCc4c23)c1
Cc1[nH]c2ncnc(Nc3cccc(Cl)c3)c2c1C
Cc1[nH]c2ncnc(Nc3cccc(Br)c3)c2c1C
Cc1[nH]c2ncnc(Nc3cccc(F)c3)c2c1C
Clc1cccc(Nc2ncnc3[nH]c(c(-c4ccccc4)c23)-c2ccccc2)c1
Cc1c([nH]c2ncnc(Nc3cccc(Cl)c3)c12)-c1ccccc1
Cc1cccc(Nc2ncnc3[nH]c4CCCCc4c23)c1
C1CCc2c(C1)[nH]c1ncnc(Nc3ccccc3)c21
NC[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |t:8|
OC[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |t:8|
O=C1NC(=O)C2=C1c1cn(CCO[C@H](CNS(=O)(=O)c3ccccc3)CCn3cc2c2ccccc32)c2ccccc12 |c:5|
O=C1NC(=O)C2=C1c1cn(CCO[C@H](CN3CCCC3)CCn3cc2c2ccccc32)c2ccccc12 |c:5|
CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|
O=C1NC(=O)C2=C1c1cn(CCO[C@H](CNCc3ccccc3)CCn3cc2c2ccccc32)c2ccccc12 |c:5|
Cc1c(NC(=O)c2ccc(cc2)C(C)(C)C)cccc1-c1nc(Nc2ccc(cc2)C(=O)N2CCOCC2)c2nc[nH]c2n1
CCNC(=O)Nc1nc2nc(N)ncc2cc1-c1c(Cl)cccc1Cl |(11.21,-14.15,;9.87,-13.38,;8.54,-14.16,;7.19,-13.39,;5.86,-14.17,;7.19,-11.85,;5.86,-11.09,;4.53,-11.86,;3.18,-11.09,;1.85,-11.88,;.52,-11.11,;-.82,-11.88,;.52,-9.57,;1.85,-8.78,;3.18,-9.55,;4.51,-8.78,;5.84,-9.54,;7.17,-8.76,;7.16,-7.23,;5.82,-6.47,;8.48,-6.45,;9.83,-7.22,;9.83,-8.76,;8.5,-9.53,;8.52,-11.07,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NC(C)(C)C)nc3n2)-c2c(C)c(C)cc(C)c2C)CC1 |(.21,-11.63,;1.55,-10.86,;1.55,-9.32,;2.88,-8.56,;4.21,-9.33,;5.54,-8.56,;5.55,-7.02,;6.88,-6.25,;6.88,-4.71,;8.22,-3.94,;8.22,-2.4,;9.55,-1.62,;10.88,-2.39,;12.21,-1.62,;13.54,-2.38,;13.56,-3.93,;14.89,-4.69,;14.89,-6.23,;13.56,-7.01,;16.24,-7,;17.57,-6.21,;18.91,-6.98,;17.55,-4.67,;17.97,-7.71,;12.23,-4.7,;10.88,-3.93,;9.55,-4.71,;14.87,-1.59,;14.86,-.05,;13.52,.69,;16.18,.72,;16.17,2.26,;17.53,-.05,;17.53,-1.59,;18.88,-2.36,;16.2,-2.36,;16.22,-3.9,;4.21,-10.87,;2.88,-11.64,)|
CN(CCCC1CCCCC1)C(=O)[C@H](CCC(O)=O)NC(=O)Nc1cccc2cc(OP(O)(O)=O)ccc12
CN(CCCC1CCCCC1)C(=O)[C@H](CCC(O)=O)NC(=O)NCc1ccc(OP(O)(O)=O)cc1
CC(=O)N[C@@H](Cc1ccc(cc1)OP(=O)(O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](CCC2CCCCC2)C(=O)N
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCCCC1CCCCC1
CN(CCCC1CCCCC1)C(=O)[C@H](CCC(=O)O)NC(=O)N(Cc2ccc(cc2)OP(=O)(O)O)CC(=O)O
CCC(C)C(NC(=O)C(CCC(O)=O)NC(=O)C(CCC(O)=O)NC(=O)[C@@H](CC(O)=O)Cc1ccc(OP(O)(O)=O)cc1)C(=O)NC(CCC(O)=O)C(O)=O
Nc1ncnc2scc(-c3ccc4c(cccc4c3)C(=O)Nc3ccccc3)c12
CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](c5ccccc5)NC(=O)c6ccccc6)O)O)OC(=O)c7ccccc7)(CO4)OC(=O)C)O)C)OC(=O)C
C1Oc2cc3ncnc(Nc4cccc(c4)-c4ccccc4)c3cc2O1
C1COc2cc3c(Nc4cccc(c4)-c4ccccc4)ncnc3cc2O1
C1COc2cc3ncnc(Nc4cccc(c4)-c4ccccc4)c3cc2OC1
C1COc2cc3c(Nc4cccc(c4)-c4ccco4)ncnc3cc2O1
C1COc2cc3c(Nc4cccc(c4)-c4cccs4)ncnc3cc2O1
C1COc2cc3c(Nc4cccc(c4)-c4ccccn4)ncnc3cc2O1
C1COc2cc3c(Nc4nccc(n4)-c4ccccc4)ncnc3cc2O1
C1COc2cc3c(Nc4nc(cs4)-c4ccccc4)ncnc3cc2O1
C1COc2cc3c(Nc4cccc(c4)-c4ccc[nH]4)ncnc3cc2O1
COc1cc2ncnc(Nc3cccc(c3)-c3ccccc3)c2cc1OC
COc1ccc(cc1O)/C=C\c2cc(c(c(c2)OC)OC)OC
Cn1c2ncncc2cc(-c2c(Cl)cccc2Cl)c1=O |(4.31,-8.43,;4.32,-6.89,;2.98,-6.1,;1.65,-6.89,;.32,-6.12,;.32,-4.57,;1.65,-3.79,;2.99,-4.57,;4.32,-3.79,;5.66,-4.57,;6.99,-3.81,;6.99,-2.28,;5.66,-1.5,;8.32,-1.5,;9.67,-2.28,;9.65,-3.82,;8.32,-4.59,;8.32,-6.12,;5.66,-6.12,;6.99,-6.89,)|
COc1cc(OC)cc(c1)-c1cc2cnc(N)nc2n(C)c1=O
CCN(CC)CCOc1ccc(Nc2ncc3cc(c(NC(=O)NC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)cc1 |(2.14,-2.63,;2.14,-4.18,;.81,-4.94,;-.53,-4.18,;-.53,-2.63,;.81,-6.47,;2.14,-7.25,;2.15,-8.79,;3.48,-9.56,;3.48,-11.11,;4.81,-11.87,;6.14,-11.1,;7.47,-11.87,;8.8,-11.1,;8.8,-9.56,;10.13,-8.78,;11.47,-9.55,;12.8,-8.78,;14.14,-9.55,;14.14,-11.1,;15.47,-11.87,;15.47,-13.41,;14.13,-14.18,;16.8,-14.19,;16.79,-15.73,;18.13,-16.5,;15.45,-16.49,;17.89,-14.64,;12.8,-11.87,;11.46,-11.09,;10.13,-11.87,;15.47,-8.79,;15.47,-7.26,;14.14,-6.49,;16.8,-6.49,;18.15,-7.26,;18.13,-8.8,;16.8,-9.57,;16.8,-11.11,;6.14,-9.56,;4.81,-8.79,)|
CC(=O)N[C@@H]1C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](CSSC1(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
CC1(C)SSC[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
CC1(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H]1N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC(=O)N[C@H]1C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](CSSC1(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC[C@H](C)[C@H]1NC(=O)[C@H](N)CSSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(O)=O
CC1(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2cc(I)c(O)c(I)c2)NC(=O)[C@@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC1(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC1(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
CC1(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H]1N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
CC1(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC(=O)N[C@H]1C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](CSSC1(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC1(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(N)=O
CC1(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](CSSC1(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
C[C@@H]([C@H]1NC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O)c1ccc2ccccc2c1
CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O)C(C)(C)S
CC1(C)SSC[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
C[C@H]1NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
C[C@@H]([C@@H]1NC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O)c1ccc2ccccc2c1
CC(C)(S)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)(C)S)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O
C[C@H]([C@@H]1NC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O)c1ccc2ccccc2c1
CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](CSSC1(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC1(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccc(O)c(I)c2)NC(=O)[C@@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC(=O)N[C@@H]1C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](CSSC1(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
C[C@H]([C@H]1NC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)CNC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O)c1ccc2ccccc2c1
Cc1cc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)nc(C)n1
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N[C@H](C)C(=O)NCCC1CCCCC1
CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O
CCCCN(CCCC)C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(C)C
CCCCCCN(CCCCCC)C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(C)C
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N[C@H](C)C(=O)NCCc1ccccc1
CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(OP(O)(O)=O)cc1)C(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O
CCCCCCCCN(CCCCCCCC)C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(C)C
CCCCN(CCCC)C(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(C)C
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N[C@@H](C)C(=O)NCCC1CCCCC1
CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(OP(O)(O)=O)cc1)C(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O
CCCCCCN(CCCCCC)C(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(C)C
CCCCCN(CCCCC)C(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(C)C
CCCCCN(CCCCC)C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(C)C
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N[C@@H](C)C(=O)NCCc1ccccc1
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)Nc1ccccc1 |c:7,t:9|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)NC1CCCCC1 |c:7,t:9|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)N1CCOCC1 |c:7,t:9|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)Nc1cccnc1 |c:7,t:9|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)N1CCCCCC1 |c:7,t:9|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)N1CCCCC1 |c:7,t:9|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)NCC1CCCCC1 |c:7,t:9|
CCOCCNC(=O)CO\N=C1\Cc2c(Cl)c(O)cc(O)c2C(=O)O[C@H](C)C[C@H]2O[C@@H]2/C=C\C=C\1 |c:33,t:35|
CCN(CC)CCNC(=O)CO\N=C1\Cc2c(Cl)c(O)cc(O)c2C(=O)O[C@H](C)C[C@H]2O[C@@H]2/C=C\C=C\1 |c:35,t:37|
C[C@@H]1C[C@H]2O[C@@H]2C=CCC=C(Cc2c(Cl)c(O)cc(O)c2C(=O)O1)N=O |w:7.8,9.9|
C[C@H]1C[C@H]2O[C@H]2C=CC=CC(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1 |w:7.8,9.10|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)N1CCN(C)CC1 |c:7,t:9|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)N(CCO)CCO |c:7,t:9|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)NCCc1cccn1C |c:7,t:9|
COc1ccc(NC(=O)CO\N=C2\Cc3c(Cl)c(O)cc(O)c3C(=O)O[C@H](C)C[C@H]3O[C@@H]3/C=C\C=C\2)cc1 |c:34,t:36|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)N1CCCC1 |c:7,t:9|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)NCCO |c:7,t:9|
[H][C@@]12C[C@@H](C)OC(=O)c3c(O)cc(O)c(Cl)c3C\C(\C=C\C=C/[C@@]1([H])O2)=N\OCC(=O)Nc1ccc(cc1)N(CC)CC |c:22,t:20|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)NC1CCCC1 |c:7,t:9|
C[C@@H]1C[C@H]2O[C@@H]2\C=C/C=C/C(/Cc2c(Cl)c(O)cc(O)c2C(=O)O1)=N\OCC(=O)NCc1cccnc1 |c:7,t:9|
COC(=O)CNC(=O)CO\N=C1\Cc2c(Cl)c(O)cc(O)c2C(=O)O[C@H](C)C[C@H]2O[C@@H]2/C=C\C=C\1 |c:33,t:35|
Nc1ccc2C(=O)\C(=C/c3cc(Cl)c(O)c(Cl)c3)C(=O)c2c1
Nc1ccc2C(=O)\C(=C/c3cc(Br)c(O)c(Br)c3)C(=O)c2c1
COc1ccc2C(=O)\C(=C/c3cc(Br)c(O)c(Br)c3)C(=O)c2c1
CC(C)[C@H]1NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(C)C
CC(C)[C@H]1NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)OCCCCCNC(=O)[C@@H]2CCCN2C(=O)[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(C)C
CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)[C@@H](CCCCNC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](CC(N)=O)NC1=O)C(C)C)NC(C)=O
CC(C)[C@H]1NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)CNC(=O)[C@H]2CCCN2C(=O)[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(C)C
CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)[C@H](CCCCNC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](CC(N)=O)NC1=O)C(C)C)NC(C)=O
CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)[C@@H](CCCCNC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](CC(N)=O)NC1=O)C(C)C)NC(C)=S
CC(C)[C@H]1NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)CCCCCCNC(=O)[C@@H]2CCCN2C(=O)[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(C)C
CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)[C@H](CCCCNC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](CC(N)=O)NC1=O)C(C)C)NC(C)=S
CCCCNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)CC)C(C)C)C(C)C
CC(C)C[C@@H]1NC(=O)[C@@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)[C@H](CCCCNC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](CC(N)=O)NC1=O)C(C)C)NC(C)=O
CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](CC(N)=O)NC1=O)C(C)C)C(O)=O)NC(C)=O
CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)[C@H](CCCCNC(=O)[C@H]2CCCN2C(=O)[C@H](CC2CCCCC2)NC(=O)[C@@H](CC(N)=O)NC1=O)NC(C)=O
CC(C)[C@@H]1NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](CC2CCCCC2)NC(=O)[C@@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)[C@H](CCCCNC(=O)[C@H]2CCCN2C1=O)NC(C)=O
COC(=O)Cn1cc(-c2cccc(Cl)c2)c(=O)c2c(O)cc(OC)cc12
COc1cc(O)c2c(c1)occ(-c1cccc(Cl)c1)c2=O
Oc1cc(O)c2c(O)c(cnc2c1)-c1cccc(Cl)c1
Oc1cc(O)c2c(c1)occ(-c1cccc(Cl)c1)c2=O
COc1cc2c(cc1OC)ncnc2Nc3cccc(c3)Cl
COc1cc(O)c2c(c1)n(C)cc(-c1cccc(Cl)c1)c2=O
c1cc(ccc1C2=COc3cc(cc(c3C2=O)O)O)O
COc1cc(O)c2c(O)c(cnc2c1)-c1cccc(Cl)c1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)c1nc(CC2CCCCC2)no1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)c1nc(CC2CCCCC2)no1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)c1nc(Cc2cccc3ccccc23)no1
CC(C)Cc1noc(n1)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CCCCCCc1noc(n1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CCCCCCc1cnc(s1)[C@H](CC)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CCCCCCCc1noc(n1)[C@H](CC)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(N)=O)c1nc(CC2CCCCC2)no1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)c1nc(CC2CCCCC2)cs1
CCCCCc1noc(n1)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CCCCCc1noc(n1)[C@H](CC)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC(C)Cc1csc(n1)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)c1ncc(CC2CCCCC2)s1
CCCCCCc1cnc(s1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC(C)CCc1noc(n1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(CCC(C)C)no1
CCCCCCc1noc(n1)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)c1nc(Cc2ccccc2)no1
CCCCc1noc(n1)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC(C)CCc1noc(n1)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CCCCCCc1noc(n1)[C@H](CC)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)c1nc(Cc2ccccc2)no1
CC(C)CCc1noc(n1)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCc1nc(CC2CCCCC2)cs1
CCCCCCc1noc(n1)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CCCCCCCc1noc(n1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CCCCCCCc1noc(n1)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCc1nc(CC2CCCCC2)no1
CC(C)CCCc1noc(n1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CCCCCc1noc(n1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC(C)CCc1csc(n1)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
OC[C@H](NC(=O)[C@@H](CC(O)=O)Cc1ccc(OP(O)(O)=O)cc1)c1nc(Cc2ccc(Cl)c(Cl)c2)no1
C[C@H](NC(=O)CCc1ccc(OP(O)(O)=O)cc1)c1nc(Cc2ccc(Cl)c(Cl)c2)no1
C[C@H](NC(=O)c1cc2cc(OP(O)(O)=O)ccc2[nH]1)c1nc(Cc2ccc(Cl)c(Cl)c2)no1
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)CS(=O)(=O)C(C)(C)C)c1nc(Cc2ccc(cc2)C(F)(F)F)no1
C[C@H](NC(=O)[C@@H](CC(O)=O)Cc1ccc(OP(O)(O)=O)cc1)c1nc(Cc2ccc(cc2)C(F)(F)F)no1
C[C@H](NC(=O)[C@@H](CC(O)=O)Cc1ccc(OP(O)(O)=O)cc1)c1nc(Cc2ccc(Cl)c(Cl)c2)no1
C[C@H](NC(=O)Nc1cccc2cc(OP(O)(O)=O)ccc12)c1nc(Cc2ccc(Cl)c(Cl)c2)no1
COc1nc(Nc2ccc(cc2)P(C)(C)=O)c2ncn(\C=C\c3c(C)cccc3C)c2n1
Cc1cccc(C)c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)nc(nc12)-n1ccnc1
Cc1ccc2[nH]ncc2c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)ncnc12
Cc1cccc(C)c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)nc(CCC#N)nc12
COCCOc1nc(Nc2ccc(cc2)P(C)(C)=O)c2ncn(\C=C\c3c(C)cccc3C)c2n1
CC(C)Oc1nc(Nc2ccc(cc2)P(C)(C)=O)c2ncn(\C=C\c3c(C)cccc3C)c2n1
CN1CCN(CC1)c1nc(Nc2ccc(cc2)P(C)(C)=O)c2ncn(\C=C\c3c(C)cccc3C)c2n1
Cc1cccc(C)c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)nc(Oc3cccnc3)nc12
Cc1cccc(C)c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)nc(nc12)N1CCOCC1
CN1CCC(CC1)c1nc(Nc2ccc(cc2)P(C)(C)=O)c2ncn(\C=C\c3c(C)cccc3C)c2n1
Oc1cccc(NC(=O)c2cc3cccc(O)c3cc2O)c1
Oc1cccc(NC(=O)c2cc3ccc(O)cc3cc2O)c1
Oc1cccc(CNC(=O)c2cc3cc(O)ccc3[nH]2)c1
COCCOc1cc2ncnc(Nc3ccc(F)c(Cl)c3F)c2cc1NC(=O)[C@@H]1CCCN1C(=O)C=C |r|
COc1cccc(c1)-c1cn(-c2ccc(CC(=O)NCCO)cc2)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2ccc(CCN(C)CCO)cc2)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3ccccc3)c12)-c1cccc(CO)c1
Nc1ncnc2n(cc(-c3ccccc3)c12)-c1cccc(CNCCO)c1
COc1cccc(c1)-c1cn(-c2ccc(CNCCO)cc2)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3ccccc3)c12)-c1ccccc1CNCCO
Nc1ncnc2n(cc(-c3ccccc3)c12)-c1ccc(CNCCO)cc1
COc1cccc(c1)-c1cn(-c2ccccc2)c2ncnc(N)c12
CCOC(=O)c1ccc(cc1)-c1cn(-c2ccccc2)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3ccccc3)c12)-c1ccc(CO)cc1
CNc1ncnc2n(cc(-c3ccccc3)c12)-c1ccccc1
COc1ccc(cc1)-c1cn(-c2ccccc2)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2cccc(CO)c2)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3cccc(Cl)c3)c12)-c1ccccc1
Nc1ncnc2n(cc(-c3ccccc3)c12)-c1ccccc1
O=c1[nH]cnc2n(cc(-c3ccccc3)c12)-c1ccccc1
Nc1ncnc2n(cc(-c3ccccc3)c12)-c1ccccc1CO
Clc1ncnc2n(cc(-c3ccccc3)c12)-c1ccccc1
Cc1ccccc1-c1cn(-c2ccccc2)c2ncnc(N)c12
C[C@H](Oc1ccc2ncccc2c1)c1c(Cl)ccc(F)c1Cl |r|
CN1CCC(O)(CC1)c1nc(c(o1)-c1ccncc1)-c1ccc(F)cc1
COCCNc1cc(ncn1)-n1c(Nc2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)nc2ccccc12
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(NCCO)ncn1
CN1CCN(CCNc2cc(ncn2)-n2c(Nc3cc(NC(=O)c4cccc(c4)C(F)(F)F)ccc3C)nc3ccccc23)CC1
CN1CCN(CCCNc2cc(ncn2)-n2c(Nc3cc(NC(=O)c4cccc(c4)C(F)(F)F)ccc3C)nc3ccccc23)CC1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(NCCc2ccccn2)ncn1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(ncn1)N1CCOCC1
CN1CCC(CC1)Nc1cc(ncn1)-n1c(Nc2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)nc2ccccc12
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(NCCC2CCCN2)ncn1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(N[C@H]2CC[C@H](N)CC2)ncn1 |r,wU:34.37,wD:37.41,(1.36,6.17,;2.68,5.37,;4.02,6.11,;5.35,5.31,;5.31,3.77,;6.62,2.97,;7.98,3.7,;8.01,5.24,;9.29,2.9,;10.64,3.64,;11.95,2.84,;11.92,1.29,;10.56,.55,;9.25,1.36,;10.52,-.99,;9.17,-1.72,;11.83,-1.79,;10.51,-2.52,;3.96,3.03,;2.65,3.84,;1.3,3.1,;1.26,1.56,;2.49,.63,;1.98,-.83,;2.71,-2.16,;1.92,-3.47,;.38,-3.44,;-.36,-2.1,;.44,-.79,;-.01,.69,;-1.35,1.45,;-2.68,.67,;-4.02,1.44,;-5.35,.66,;-6.69,1.42,;-8.01,.65,;-9.35,1.42,;-9.36,2.96,;-10.69,3.73,;-8.02,3.73,;-6.69,2.97,;-4.03,2.99,;-2.7,3.77,;-1.35,3,)|
CCN(CC)CCCCNc1cc(ncn1)-n1c(Nc2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)nc2ccccc12
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(NCCCC2COCCN2)ncn1
CCN(CC)CCNc1cc(ncn1)-n1c(Nc2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)nc2ccccc12
CN(C)CCCCNc1cc(ncn1)-n1c(Nc2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)nc2ccccc12
COc1cc(ncn1)-n1c(Nc2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)nc2ccccc12
Cc1ccc(NC(=O)c2cc(nn2C)C(C)(C)C)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1
CCN1CCN(Cc2ccc(cc2Cl)C(=O)Nc2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)CC1
Cc1ccc(NC(=O)c2ccc(s2)C(C)(C)C)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1
Cc1ccc(NC(=O)c2cc(n[nH]2)C2CC2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1
CN1CCC(CC1)Oc1cc(cc(c1)C(F)(F)F)C(=O)Nc1ccc(C)c(Nc2nc3ccccc3n2-c2cc(N)ncn2)c1
Cc1cccc(c1)C(=O)Nc1ccc(C)c(Nc2nc3ccccc3n2-c2cc(N)ncn2)c1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1
Cc1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1
Cc1ccc(NC(=O)c2cccc(Cl)c2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1
CCN(CC)CCCCNc1cc(ncn1)-n1c(Nc2cc(ccc2C)C(=O)Nc2cccc(c2)C(F)(F)F)nc2ccccc12
CN1CCN(CCNc2cc(ncn2)-n2c(Nc3cc(ccc3C)C(=O)Nc3cccc(c3)C(F)(F)F)nc3ccccc23)CC1
Cc1ccc(cc1Nc1nc2ccccc2n1-c1ncnc(N)c1C)C(=O)Nc1cccc(c1)C(F)(F)F |(22.57,6.55,;23.89,5.76,;25.23,6.5,;26.56,5.69,;26.52,4.15,;25.17,3.42,;23.86,4.22,;22.51,3.48,;22.47,1.95,;23.69,1.01,;23.19,-.44,;23.92,-1.78,;23.13,-3.09,;21.59,-3.06,;20.85,-1.71,;21.65,-.4,;21.2,1.07,;19.86,1.84,;19.86,3.38,;18.51,4.16,;17.18,3.37,;17.19,1.82,;15.86,1.05,;18.53,1.06,;18.53,-.48,;27.83,3.35,;27.8,1.81,;29.19,4.09,;30.5,3.29,;31.84,4.02,;33.16,3.23,;33.12,1.68,;31.77,.94,;30.46,1.74,;31.73,-.6,;30.38,-1.34,;33.05,-1.4,;31.72,-2.13,)|
CN1CCN(CCCNc2cc(ncn2)-n2c(Nc3cc(ccc3C)C(=O)Nc3cccc(c3)C(F)(F)F)nc3ccccc23)CC1
CN(C)CCCCNc1cc(ncn1)-n1c(Nc2cc(ccc2C)C(=O)Nc2cccc(c2)C(F)(F)F)nc2ccccc12
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(Cl)ncn1
CN1CCN(Cc2cc(nn2C(C)(C)C)C(=O)Nc2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)CC1
CCN1CCN(CC1)c1cc(cc(c1)C(F)(F)F)C(=O)Nc1ccc(C)c(Nc2nc3ccccc3n2-c2cc(N)ncn2)c1
CN1CCN(CC1)c1cc(cc(c1)C(F)(F)F)C(=O)Nc1ccc(C)c(Nc2nc3ccccc3n2-c2cc(N)ncn2)c1
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCCC1
CC(C)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12
CC(C)(C)n1cc(-c2ccc(Cl)cc2)c2c(N)ncnc12
CC(C)(C)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CC(O)C(O)C1
Nc1ncnc2n(cc(-c3cccc(Oc4ccccc4)c3)c12)C1CCCC1
Cc1ccc(cc1)-c1nn(c2ncnc(N)c12)C(C)(C)C
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCCC1O
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCC(O)C1
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC
C[C@@]12[C@](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)(CO)O
c1cc(c(cc1[N+](=O)[O-])Cl)NC(=O)c2cc(ccc2O)Cl
CNc1cncc(n1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCC[C@H]2CN2CCCC2)c1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
C[C@H](NC(=O)[C@H](Cc1ccc(CP(O)(O)=O)cc1)NC(C)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(P(O)(O)=O)P(O)(O)=O)NC(C)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
CC(C)CC(NC(=O)C(CCC(O)=O)NC(=O)C(CCC(O)=O)NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(N)=O
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)C1CCC1
COc1ccc(cc1)-c1cn(C2CCC2)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3ccccc3)c12)C(CO)CCc1ccccc1
COc1cccc(c1)-c1cn(C2CC(C2)C(=O)NCCO)c2ncnc(N)c12 |(14.27,-.7,;13.8,-2.17,;12.3,-2.49,;11.27,-1.34,;9.75,-1.69,;9.28,-3.16,;10.32,-4.29,;11.83,-3.96,;9.85,-5.75,;10.78,-7,;9.87,-8.25,;10.36,-9.71,;9.66,-11.08,;11.04,-11.77,;11.72,-10.39,;11.29,-13.29,;12.72,-13.85,;10.08,-14.26,;10.32,-15.79,;9.13,-16.75,;9.36,-18.27,;8.39,-7.79,;7.05,-8.57,;5.71,-7.79,;5.71,-6.24,;7.05,-5.47,;7.04,-3.93,;8.39,-6.24,)|
Nc1ncnc2n(cc(-c3ccccc3)c12)C(CO)Cc1ccc(O)cc1
Nc1ncnc2n(cc(-c3ccccc3)c12)C1CCC(O)C1
COc1ccc(cc1)-c1cn(C2CCCC2)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3ccccc3)c12)C(CO)Cc1ccccc1
COc1ccc(CC(CO)n2cc(-c3cccc(OC)c3)c3c(N)ncnc23)cc1
COc1cccc(c1)-c1cn(C2CCN(CC(=O)N(C)C)CC2)c2ncnc(N)c12
NC(=O)CN1CCC(C1)n1cc(-c2cccc(O)c2)c2c(N)ncnc12
CC(C)(C)OC(=O)N1C[C@H](C[C@@H]1CO)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12
COc1cccc(c1)-c1cn(C2CCN(CC(N)=O)C2)c2ncnc(N)c12
CC(C)(C)OC(=O)N1CCC(C1)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12
CC(C)(C)OC(=O)N1CCC(C1)n1cc(-c2cccc(O)c2)c2c(N)ncnc12
COC(=O)CN1CCC(CC1)n1cc(-c2cccc(O)c2)c2c(N)ncnc12
CC(C)(C)OC(=O)N1CCC(C1)n1cc(-c2ccccc2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)C1CCNC1
CN(C)C(=O)CN1CCC(CC1)n1cc(-c2cccc(O)c2)c2c(N)ncnc12
COc1cccc(c1)-c1cn(C2CCN(CCN(C)CCO)CC2)c2ncnc(N)c12
CC(C)(C)OC(=O)N1C[C@@H](C[C@@H]1CO)n1cc(-c2ccccc2)c2c(N)ncnc12
CCOC(=O)C[C@H]1C[C@H](CN1)n1cc(-c2ccccc2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3ccccc3)c12)[C@@H]1CN[C@@H](CO)C1
COc1cccc(c1)-c1cn(C2CCN(CCO)CC2)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3ccc(O)cc3)c12)[C@H]1CN[C@@H](CO)C1
CC(C)(C)OC(=O)N1C[C@H](C[C@@H]1CO)n1cc(-c2ccccc2)c2c(N)ncnc12
CCOC(=O)C[C@H]1C[C@H](CN1C(=O)OC(C)(C)C)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12
COC(=O)CN1CCC(CC1)n1cc(-c2cccc(OC)c2)c2c(N)ncnc12
COc1cccc(c1)-c1cn(C2CCN(CC(N)=O)CC2)c2ncnc(N)c12
COc1ccc(cc1)-c1cn(C2CCNC2)c2ncnc(N)c12
CCOC(=O)C[C@H]1C[C@H](CN1)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12
COc1cccc(c1)-c1cn(C2CCNC2)c2ncnc(N)c12
CCOC(=O)C[C@H]1C[C@@H](CN1C(=O)OC(C)(C)C)n1cc(-c2ccccc2)c2c(N)ncnc12
NC(=O)CN1CCC(CC1)n1cc(-c2cccc(O)c2)c2c(N)ncnc12
CCOC(=O)C[C@H]1C[C@@H](CN1C(=O)OC(C)(C)C)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12
COCCN(C)CCN1CCC(CC1)n1cc(-c2cccc(OC)c2)c2c(N)ncnc12
COC(=O)CN1CCC(C1)n1cc(-c2cccc(OC)c2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3ccc(O)cc3)c12)C1CCNC1
COCCNCCN1CCC(CC1)n1cc(-c2cccc(OC)c2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)C1CCN(CCO)CC1
COC(=O)CN1CCC(C1)n1cc(-c2cccc(O)c2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3ccc(O)cc3)c12)[C@@H]1CN[C@@H](CO)C1
CC(C)(C)OC(=O)N1C[C@@H](C[C@@H]1CO)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12
CCOC(=O)C[C@H]1C[C@@H](CN1)n1cc(-c2ccccc2)c2c(N)ncnc12
CCOC(=O)C[C@H]1C[C@H](CN1C(=O)OC(C)(C)C)n1cc(-c2ccccc2)c2c(N)ncnc12
COc1cccc(c1)-c1cn(C2CCN(C2)C(=O)OC(C)(C)C)c2ncnc(N)c12
COc1ccc(cc1)-c1cn(C2CCN(C2)C(=O)OC(C)(C)C)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3ccccc3)c12)[C@H]1CN[C@@H](CO)C1
CCOC(=O)C[C@H]1C[C@@H](CN1)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3ccccc3)c12)C1CCNC1
CCN1CCN(CC1)c2ccc(cc2)Nc3cc(ncn3)N(C)C(=O)Nc4c(c(cc(c4Cl)OC)OC)Cl
CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5
CN(C)c1cc2c(Nc3ccc4n(Cc5ccccc5)ncc4c3)ncnc2cn1
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)C(=O)C(O)(O)C(=O)OC)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cccc(c1)C(O)=O)C(N)=O
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)NCc2cccc3ccccc23)C(=O)C1NC(=O)c1cc2cc(OP(O)(=O)OCc3ccccc3)ccc2[nH]1
COc1ccc(cc1)C1Sc2ccccc2N(Cc2ccccc2)C(=O)C1NC(=O)[C@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)NC(=O)OC(C)(C)C
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CSCCN(Cc2cccc(c2)C(F)(F)F)C1=O
COC(=O)c1cccc(CN2CCSC[C@H](NC(=O)[C@H](Cc3ccc(OP(O)(O)=O)cc3)NC(C)=O)C2=O)c1
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)NCc2cccc3ccccc23)C(=O)C1NC(=O)c1ccc(OP(O)(=O)OCc2ccccc2)cc1
CN(C)c1ccc(cc1)C(=O)CN1CCSC[C@H](NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC(C)=O)C1=O
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)NCc2cccc3ccccc23)C(=O)C1NC(=O)Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CSCCN(Cc2ccc3OCOc3c2Cl)C1=O
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)Nc2ccc(Oc3ccccc3)cc2)C(=O)C1NC(=O)[C@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)NC(=O)OC(C)(C)C
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)Nc2cccc(Oc3ccccc3)c2)C(=O)C1NC(=O)[C@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)NC(=O)OC(C)(C)C
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)NCc2cccc3ccccc23)C(=O)C1NC(=O)c1ccc2cc(OP(O)(=O)OCc3ccccc3)ccc2c1
COc1ccc(cc1)C1Sc2ccccc2N(C(C(=O)Nc2cccc3ccccc23)c2ccccc2)C(=O)C1NC(=O)[C@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)NC(=O)OC(C)(C)C
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)Nc2ccccc2OC)C(=O)C1NC(=O)[C@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)NC(=O)OC(C)(C)C
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)NCc2cccc3ccccc23)C(=O)C1NC(=O)CCc1ccc(OP(O)(=O)OCc2ccccc2)cc1
COc1ccc(cc1)C1Sc2ccccc2NC(=O)C1NC(=O)[C@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)NC(=O)OC(C)(C)C
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CSCCN(Cc2cccc(c2)-c2ccccc2C#N)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CSCCN(Cc2cccc(c2)C(=O)c2ccccc2)C1=O
COc1ccc(cc1)C1Sc2ccccc2N(Cc2ccc(cc2)-c2ccccc2C(=O)OC(C)(C)C)C(=O)C1NC(=O)[C@H](Cc1ccc(OP(O)(=O)OCc2ccccc2)cc1)NC(=O)OC(C)(C)C
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CSCCN(Cc2ccc(cc2)-c2ccccc2)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CSCCN(Cc2cccc(OC(F)(F)F)c2)C1=O
CC(C)(C)OC(=O)N[C@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NC1CSc2ccccc2N(CCCC2CCCCC2)C1=O
COc1ccc(cc1)C1Sc2ccccc2N(CC(=O)NCc2cccc3ccccc23)C(=O)C1NC(=O)c1ccc2c(Cl)c(OP(O)(=O)OCc3ccccc3)ccc2c1
CCOP(O)(=O)c1cc(CC(NC(C)=O)C(=O)N[C@@H](C)c2ccc(OCC3CCCCC3)c(c2)C(N)=O)ccc1OCC(O)=O
CC(C)(NC(=O)CCc1ccc(OS(=O)(=O)C(F)(F)F)c(c1)P(O)(O)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
C[C@H](NC(=O)C(Cc1ccc(OCC(O)=O)c(c1)P(O)(O)=O)NC(C)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
CC(=O)NC(Cc1ccc(OCC(O)=O)c(c1)P(O)(O)=O)C(=O)Nc1ccc(OCC2CCCCC2)c(c1)C(N)=O
C[C@H](NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
CC(=O)NC(Cc1ccc(OCC(O)=O)c(c1)P(O)(O)=O)C(=O)NCc1ccc(OCC2CCCCC2)c(c1)C(N)=O
CC(C)(NC(=O)CCc1ccc(O)c(c1)P(O)(O)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
CC(C)(NC(=O)CCc1ccc(OCn2cnnn2)c(c1)P(O)(O)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
CC(C)(NC(=O)CCc1ccc(OCC(O)=O)c(c1)P(O)(O)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
C[C@H](NC(=O)C(Cc1ccc(OCC(O)=O)cc1)NC(C)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
CC(=O)NC(Cc1ccc(OCC(O)=O)c(c1)P(O)(O)=O)C(=O)NC(C)(C)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
COc1cc2cc3ncc(C#N)c(Nc4ccc(Cl)cc4Cl)c3cc2cc1OC
CC(C)(C)c1nc2c([nH]1)c1ccc(F)cc1c1c2cc[nH]c1=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(O)=O
CCOC(=O)c1c(SCC2CCCCC2)nc(C(C)NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC(C)=O)n1C
CC(NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(C)=O)c1nc(SCC2CCCCC2)c(C(N)=O)n1C
CC(NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1nc(SCC2CCCCC2)c(C(N)=O)n1C
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2cccc3ccccc23)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccc(F)cc2F)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccc(Cl)cc2)C1=O
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CCCCN(CCCc2ccccc2)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)C2CCCCC2)C1=O
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CSCCN(Cc2ccc(cc2)-c2ccccc2C#N)C1=O
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccccc2C#N)C1=O
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)C(=O)c2ccccc2)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccccc2C#N)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(CCCc2ccccc2)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(C\C=C\c2ccccc2)C1=O
CCCc1ccc(CN2CCCC[C@H](NC(=O)[C@H](Cc3ccc(OP(O)(O)=O)cc3)NC(C)=O)C2=O)cc1
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CCCCN(C\C=C\c2ccccc2)C1=O
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CCCCN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)C(C)(C)C)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2cccs2)C1=O
Cc1ccc(cc1)-c1ccc(CN2CCCC[C@H](NC(=O)c3ccc(OP(O)(O)=O)cc3)C2=O)cc1
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CSCCN(Cc2ccc(cc2)C(=O)c2ccccc2)C1=O
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CSCCN(Cc2ccc(cc2)-c2ccccc2)C1=O
CCCCc1ccc(CN2CCCC[C@H](NC(=O)[C@H](Cc3ccc(OP(O)(O)=O)cc3)NC(C)=O)C2=O)cc1
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CSCCN(C\C=C\c2ccccc2)C1=O
COc1cccc(CN2CCCC[C@H](NC(=O)[C@H](Cc3ccc(OP(O)(O)=O)cc3)NC(C)=O)C2=O)c1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccc(C)cc2)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C1=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CSCCN(Cc2ccc(cc2)-c2ccccc2C#N)C1=O
COC(=O)c1ccc(CN2CCCC[C@H](NC(=O)[C@H](Cc3ccc(OP(O)(O)=O)cc3)NC(C)=O)C2=O)cc1
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CSCCN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C1=O
OP(O)(=O)Oc1ccc(cc1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccccc2)C1=O
OP(O)(O)C(=O)C1CCCCC1
OP(O)(=O)C(=O)Nc1ccccc1OC(F)(F)F
c1cc(ccc1[N+](=O)[O-])OP(=O)(O)O
COc1cc(NC(=O)P(O)(O)=O)cc(OC)c1OC
CC(C)(C)c1ccc(OP(O)(O)=O)cc1
OP(O)(=O)C(=O)NCc1ccccc1
CC(C)c1ccc(cc1)C(=O)P(O)(O)O
CCCOc1ccc(cc1)C(=O)P(O)(O)O
OP(O)(=O)C(=O)NCCc1ccccc1
OP(O)(=O)Oc1cccc2ccccc12
Cc1cccc(OP(O)(O)=O)c1
OC(=O)c1ccccc1OP(O)(O)=O
COC(=O)c1cccc(OP(O)(O)=O)c1
OP(O)(=O)C(=O)Nc1ccc(OCc2ccccc2)cc1
Cc1cccc(C)c1OP(O)(O)=O
OP(O)(=O)Oc1ccc2ccccc2c1
COP(O)(=O)Oc1ccccc1C=O
Nc1ccc(OP(O)(O)=O)cc1
COC(=O)c1cc2ccccc2cc1OP(O)(O)=O
OP(O)(O)C(=O)c1ccccc1
CC(C)OP(O)(=O)Oc1ccccc1C=O
CCc1ccc(cc1)NC(=O)P(=O)(O)O
OP(O)(=O)Oc1ccc(SC(F)(F)F)cc1
OP(O)(O)C(=O)c1cccc2ccccc12
Oc1cccc2CC=C(C#N)N(OP(O)(O)=O)c12 |t:7|
CCOC(=O)c1ccc(NC(=O)P(O)(O)=O)cc1
OP(O)(O)C(=O)c1ccc(cc1)-c1ccccc1
CCCCOc1ccc(NC(=O)P(O)(O)=O)cc1
COc1ccccc1C(=O)P(O)(O)O
COc1ccc(OP(O)(O)=O)cc1
Oc1cccc2CCCN(OP(O)(O)=O)c12
Cc1ccc(cc1)OP(=O)(O)O
CC(=O)c1ccc2ccccc2c1OP(O)(O)=O
OP(O)(=O)Oc1c(C=O)cccc1C=O
COC(=O)c1ccc(OP(O)(O)=O)cc1
OP(O)(O)C(=O)c1ccc2ccccc2c1
c1ccc(c(c1)C=O)O[P@@](=O)(O)OCC2CCCCC2
OP(O)(=O)Oc1ccccc1Cl
Oc1cccc2CC=CN(OP(O)(O)=O)c12 |c:7|
Oc1[nH]c2ccccc2c1C1=Nc2ccccc2C1=O |t:12|
COC(=O)c1cc(C[C@@H](NC(C)=O)C(=O)N[C@H]2CCCCN(Cc3ccc(cc3)-c3ccccc3)C2=O)ccc1C(C(O)=O)C(O)=O
Cc1cc(C=O)cc(C)c1OP(O)(O)=O
CC(=O)N[C@@H](Cc1ccc(C(C(O)=O)C(O)=O)c(c1)C(O)=O)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccccc2)C1=O |r|
Cc1ccc(C(C(O)=O)C(O)=O)c(COC=O)c1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)c(C=O)c1)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccccc2)C1=O |r|
COC(=O)c1cc(C[C@H](NC(C)=O)C(=O)N[C@H]2CCCCN(Cc3ccc(cc3)-c3ccccc3)C2=O)ccc1C(C(O)=O)C(O)=O
Cc1ccc(CC(O)=O)c(C=O)c1
CC(=O)N[C@@H](Cc1ccc(CC(O)=O)c(c1)C(O)=O)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccccc2)C1=O |r|
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CC[C@@H](CC1)N1CCCCC1 |wU:26.33,23.26,(-1.51,4.17,;-1.51,2.63,;-2.84,1.87,;-2.85,.33,;-1.52,-.44,;-.19,.33,;1.28,-.16,;2.19,1.09,;1.28,2.33,;1.77,3.8,;3.27,4.1,;3.74,5.57,;2.73,6.71,;3.22,8.17,;4.72,8.48,;5.19,9.94,;6.7,10.27,;7.73,9.11,;7.26,7.64,;5.74,7.34,;1.22,6.39,;.75,4.94,;-.18,1.87,;1.75,-1.62,;.71,-2.78,;1.17,-4.25,;2.68,-4.56,;3.71,-3.41,;3.24,-1.96,;3.15,-6.02,;4.67,-6.33,;5.13,-7.8,;4.09,-8.94,;2.59,-8.62,;2.12,-7.16,)|
NCCn1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CNOC1
Nc1ncnc2n(CCO)cc(-c3ccc(Oc4ccccc4)cc3)c12
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)[C@H]1CC[C@@H](CC1)N1CCCCC1 |wU:23.26,wD:26.33,(.15,4.38,;.15,2.84,;-1.21,2.08,;-1.21,.55,;.12,-.23,;1.45,.54,;2.92,.06,;3.83,1.3,;2.92,2.54,;3.41,4.01,;4.93,4.31,;5.4,5.78,;4.37,6.92,;4.86,8.38,;6.38,8.69,;6.84,10.16,;8.34,10.46,;9.39,9.32,;8.9,7.86,;7.38,7.54,;2.88,6.62,;2.39,5.15,;1.48,2.08,;3.39,-1.41,;4.88,-1.73,;5.35,-3.2,;4.32,-4.35,;2.83,-4.02,;2.36,-2.55,;4.79,-5.81,;6.31,-6.12,;6.77,-7.59,;5.75,-8.73,;4.23,-8.41,;3.76,-6.94,)|
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCOCC1
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCNCC1
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCOC1
CN1CCN(CC1)[C@H]1CC[C@H](CC1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12 |wU:7.7,10.14,(2.19,-10.22,;1.73,-8.75,;2.75,-7.59,;2.29,-6.14,;.77,-5.83,;-.26,-6.95,;.21,-8.41,;.3,-4.36,;-1.21,-4.04,;-1.67,-2.57,;-.63,-1.42,;.86,-1.75,;1.33,-3.22,;-1.1,.05,;-.19,1.28,;-1.1,2.52,;-.61,4.01,;-1.63,5.13,;-1.16,6.58,;.35,6.92,;.84,8.36,;2.34,8.68,;2.81,10.15,;4.32,10.44,;5.35,9.29,;4.88,7.84,;3.36,7.52,;1.38,5.76,;.89,4.29,;-2.56,2.05,;-3.89,2.82,;-3.89,4.36,;-5.22,2.05,;-5.23,.54,;-3.9,-.26,;-2.57,.51,)|
Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCNC1
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C#N)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C(C)C)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Br)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)[N+]([O-])=O)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
Cc1[nH]c(=O)c2c3nc(Nc4c(Cl)cccc4Cl)[nH]c3ccc2c1C
O=C(Cc1ccc(cn1)-c1ccc(OCCN2CCOCC2)cc1)NCc1ccccc1
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)\C=C\c1ccc(O)c(O)c1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NOC(=O)Cc1cc(=O)oc2cc(O)ccc12)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)N=CCc1ccc(O)c(O)c1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |w:40.41|
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)\C=C\c1ccc(O)c(O)c1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(Cc1ccc(O)c(O)c1)NOC(=O)Cc1ccc(O)c2cc(O)ccc12)C(=O)N[C@@H](CCC(O)=O)C(O)=O
Fc1ccc(c(F)c1)-c1cc(cc2N(C(=O)NCc12)c1c(Cl)cccc1Cl)C1CCNCC1
CCN(CC)CC=Cc1[nH]c(=O)c2c3n(C)c(Nc4c(Cl)cccc4Cl)nc3ccc2c1C |w:6.5|
CCN1CCC(CC1)n1cc(C2=C(C(=O)NC2=O)c2cn(C)c3ccccc23)c2ccccc12 |t:12|
CN1CCC(CC1)n1cc(C2=C(C(=O)NC2=O)c2c[nH]c3ccccc23)c2ccccc12 |t:11|
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|
CN(C)C[C@@H]1CCn2cc(c3c2cccc3)C4=C(c5cn(c6c5cccc6)CCO1)C(=O)NC4=O
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(CC4CC4)CC3)c3ccccc23)c2ccccc12 |t:4|
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccc4)CC3)c3ccccc23)c2ccccc12 |t:4|
CN1CCC(CC1)n1cc(C2=C(C(=O)NC2=O)c2cn(C)c3ccccc23)c2ccccc12 |t:11|
COc1cc(Br)c(Br)c(\C=N\c2ccc3[nH]c(=O)[nH]c3c2)c1O
CCOc1cc(Br)c(Br)c(\C=N\c2ccc3[nH]c(=O)[nH]c3c2)c1O
Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)nc(NCC2CCCO2)n1
Cc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)nc(NCCO)n1
Cc1cccc(Cl)c1NC(=O)c1ccc2nc(Nc3cccc(NCCO)n3)sc2c1
Cc1cccc(Cl)c1NC(=O)c1ccc2nc(NC(=O)NC(C)(C)C)sc2c1
CNc1cc(Nc2nc3ccc(cc3s2)C(=O)Nc2c(C)cccc2Cl)ncn1
c1ccc(c(c1)C(=O)Nc2ccc(cc2)Cl)NCc3ccncc3
Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1
COc1cc2Cc3c(Nc2cc1OC)nc[nH]c3=O
COc1cc2cc3c(nc[nH]c3=O)nc2cc1OC
COCCOc1cc2nc3ncnc(Nc4cc(OC)c(Cl)cc4Cl)c3cc2cc1OC
COc1cccc(c1)-c1nn(-c2cccc(c2)P(O)(=O)CC(O)=O)c2ncnc(N)c12
Cc1ccc(cc1)-c1nn(-c2cccc(c2)C(=O)NCc2ccc(c(c2)P(O)(O)=O)P(O)(O)=O)c2ncnc(N)c12
CN(CCOP(O)(=O)CP(O)(O)=O)CCc1ccc(cc1)-n1cc(-c2cccc(O)c2)c2c(N)ncnc12
COc1cccc(c1)-c1cn(-c2cccc(c2)C(=O)Nc2ccc(cc2)C(P(O)(O)=O)P(O)(O)=O)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)-c1ccc(CCO)cc1
COc1cccc(c1)-c1cn(-c2ccc(cc2)C(=O)Nc2ccc(c(c2)P(O)(O)=O)P(O)(O)=O)c2ncnc(N)c12
Cc1ccc(cc1)-c1nn(CCCCOP(O)(=O)CP(O)(O)=O)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2cccc(c2)C(O)=O)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2cccc(c2)C(=O)NCCCP(O)(=O)CP(O)(O)=O)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2ccc(CCO)cc2)c2ncnc(N)c12
Cc1ccc(cc1)-c1cn(c2ncnc(N)c12)C(C)(C)C
COc1cccc(c1)-c1cn(-c2ccc(cc2)C(O)=O)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2cccc(c2)C(=O)Nc2ccc(c(c2)P(O)(O)=O)P(O)(O)=O)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2ccc(CCN(C)CCOP(O)(=O)CP(O)(O)=O)cc2)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2ccc(cc2)C(=O)NCCCP(O)(=O)CP(O)(O)=O)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2ccc(CCOP(O)(=O)CP(O)(O)=O)cc2)c2ncnc(N)c12
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)-c1ccc(CCOP(O)(=O)CP(O)(O)=O)cc1
Cc1ccc(cc1)-c1nn(-c2cccc(c2)C(=O)NCCCP(O)(=O)CP(O)(O)=O)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2ccc(cc2)C(=O)Nc2ccc(cc2)C(P(O)(O)=O)P(O)(O)=O)c2ncnc(N)c12
Nc1ncnc2n(nc(-c3cccc(O)c3)c12)-c1cccc(c1)P(O)(=O)CC(O)=O
CN(CCO)CCc1ccc(cc1)-n1cc(-c2cccc(O)c2)c2c(N)ncnc12
Cn1c2nc(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(3.94,-2.74,;3.93,-1.2,;2.6,-.43,;1.27,-1.2,;-.06,-.43,;-1.39,-1.21,;-2.73,-.45,;-2.73,1.1,;-4.06,1.86,;-5.41,1.09,;-5.38,-.47,;-4.05,-1.22,;-6.74,1.86,;-7.53,.53,;-5.97,3.19,;-8.09,2.61,;-9.4,1.82,;-10.19,3.17,;-10.91,1.42,;-9.02,.34,;-.07,1.11,;1.27,1.88,;2.6,1.11,;3.93,1.88,;5.26,1.11,;6.59,1.88,;6.59,3.42,;5.26,4.19,;7.92,4.19,;9.26,3.42,;9.26,1.88,;7.92,1.11,;7.92,-.43,;5.26,-.43,;6.6,-1.2,)|
Cn1c2nc(Nc3ccc(c(c3)P(O)(O)=O)P(O)(O)=O)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(3.82,-1.69,;3.82,-.15,;2.48,.62,;1.15,-.15,;-.19,.61,;-1.52,-.17,;-2.87,.6,;-2.87,2.14,;-4.2,2.91,;-5.53,2.13,;-5.52,.58,;-4.19,-.17,;-6.85,-.19,;-8.2,-.99,;-8.36,.72,;-6.19,-1.57,;-6.87,2.9,;-6.07,4.25,;-7.94,4.02,;-7.99,1.84,;-.2,2.17,;1.15,2.94,;2.48,2.17,;3.81,2.94,;5.15,2.15,;6.48,2.92,;6.48,4.48,;5.15,5.24,;7.82,5.25,;9.15,4.48,;9.15,2.92,;7.82,2.15,;7.82,.61,;5.15,.62,;6.48,-.15,)|
Cn1c2nc(Nc3ccc(CP(O)(=O)CP(O)(O)=O)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(5.26,-5.02,;5.25,-3.48,;3.9,-2.71,;2.57,-3.48,;1.24,-2.71,;-.09,-3.5,;-1.42,-2.74,;-1.42,-1.19,;-2.75,-.43,;-4.08,-1.2,;-5.43,-.43,;-5.43,1.11,;-6.97,1.16,;-3.89,1.09,;-5.41,2.64,;-6.74,3.42,;-5.94,4.76,;-7.81,4.54,;-7.86,2.37,;-4.08,-2.75,;-2.75,-3.51,;1.24,-1.17,;2.57,-.4,;3.9,-1.17,;5.23,-.4,;6.58,-1.17,;7.91,-.4,;9.24,-1.17,;9.24,-2.71,;10.58,-.4,;10.58,1.14,;9.24,1.91,;7.91,1.14,;6.58,1.91,;6.58,-2.71,;7.92,-3.48,)|
Cn1c2nc(Nc3ccc(OCC(O)=O)c(c3)P(O)(O)=O)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(4.7,-3.27,;4.67,-1.73,;3.34,-.96,;2.01,-1.73,;.68,-.96,;-.65,-1.73,;-1.98,-.98,;-1.98,.58,;-3.31,1.33,;-4.64,.55,;-5.99,1.32,;-5.99,2.86,;-7.33,3.63,;-8.67,2.85,;-7.34,5.17,;-4.64,-.99,;-3.31,-1.75,;-5.97,-1.77,;-7.3,-2.57,;-7.46,-.86,;-5.3,-3.15,;.68,.58,;2.01,1.35,;3.34,.58,;4.67,1.35,;6.02,.58,;7.35,1.35,;7.35,2.89,;6.02,3.66,;8.68,3.66,;10.02,2.89,;10.02,1.35,;8.68,.58,;8.68,-.96,;6.02,-.96,;7.36,-1.73,)|
Cn1c2nc(Nc3cccc(c3)P(O)(=O)CP(O)(O)=O)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(2.81,-5.78,;2.81,-4.24,;1.47,-3.47,;.14,-4.24,;-1.19,-3.48,;-2.53,-4.26,;-3.87,-3.49,;-5.19,-4.26,;-6.52,-3.52,;-6.54,-1.96,;-5.21,-1.18,;-3.87,-1.95,;-5.21,.37,;-6.75,.39,;-3.66,.37,;-5.21,1.91,;-6.55,2.68,;-5.78,4.01,;-7.64,3.78,;-7.66,1.61,;-1.21,-1.93,;.14,-1.15,;1.47,-1.93,;2.81,-1.15,;4.15,-1.94,;5.48,-1.17,;6.81,-1.94,;6.81,-3.48,;8.14,-1.17,;8.14,.39,;6.81,1.16,;5.48,.37,;4.15,1.15,;4.15,-3.47,;5.48,-4.24,)|
CN(C)CCCn1c2nc(Nc3ccc(cc3)P(O)(=O)CP(O)(O)=O)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(3.9,-7.22,;3.9,-5.68,;2.57,-4.91,;5.23,-4.91,;5.23,-3.37,;6.56,-2.59,;6.56,-1.05,;5.21,-.28,;3.88,-1.05,;2.55,-.29,;1.22,-1.06,;-.11,-.29,;-.11,1.25,;-1.44,2.01,;-2.78,1.23,;-2.77,-.31,;-1.44,-1.07,;-4.12,2,;-4.89,.67,;-3.35,3.34,;-5.45,2.77,;-5.45,4.31,;-6.99,4.32,;-5.86,5.8,;-4.12,5.09,;2.55,1.26,;3.88,2.03,;5.21,1.26,;6.54,2.03,;7.89,1.25,;9.22,2.02,;9.22,3.57,;7.89,4.33,;10.55,4.36,;11.88,3.57,;11.88,2.02,;10.55,1.25,;10.55,-.29,;7.89,-.28,;9.22,-1.05,)|
Cc1cccc(Cl)c1NC(=O)c1cnc(NC(=O)C2CC2)s1
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)C(\F)=C\CN(C)C
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4ccccc4c3CCCN(C)C)c2c1
CN(C)CCCc1c(\C=C2/C(=O)Nc3ccc(cc23)S(N)(=O)=O)[nH]c2CCCCc12
CCC(=O)N1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCC(O)=O)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CCO)CC3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CN3CCOCC3)c2c1
CN(C)CCCc1c2CCCCc2[nH]c1\C=C1/C(=O)Nc2ccc(cc12)S(=O)(=O)NCc1ccc(F)cc1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CC3)C(C)=O)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCC(O)CC3)c2c1
COc1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCOCC3)c2c1
CC(C)S(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
CC(C)CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CC3)C(C)=O)c2c1
CN(C)CCCc1c(\C=C2/C(=O)Nc3ccccc23)[nH]c2CCCCc12
CN(C)CCCc1c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)N(C)C)[nH]c2CCCCc12
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c(C)c(C)c3CCCN(C)C)c2c1
CCS(=O)(=O)Cc1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CC3)C(=O)CO)c2c1
CN(C)CCCc1c(\C=C2/C(=O)Nc3ccc(cc23)S(C)(=O)=O)[nH]c2CCCCc12
CN(C)CCCc1c2CCCCc2[nH]c1\C=C1/C(=O)Nc2ccc(cc12)S(=O)(=O)NCCO
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCC(=O)N3CCN(C)CC3)c2c1
CN(C)CCCc1c(\C=C2/C(=O)Nc3ccc(cc23)C(O)=O)[nH]c2CCCCc12
CN(C)CCCc1c(\C=C2/C(=O)Nc3ccc(F)cc23)[nH]c2CCCCc12
CNOC(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCC(=O)N3CCN(C)CC3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CC3)C(=O)CO)c2c1
CN(C)CCCc1c2CCCCc2[nH]c1\C=C1/C(=O)Nc2ccc(cc12)S(=O)(=O)Nc1ccccc1Cl
CN(C)CCCc1c(\C=C2/C(=O)Nc3ccc(cc23)-c2ccccc2)[nH]c2CCCCc12
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCNCC3)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCOCC3)c2c1
CCC(=O)N1CCN(CCCc2c(\C=C3/C(=O)Nc4ccc(cc34)S(=O)(=O)CC)[nH]c3CCCCc23)CC1
CN(Cc1ccccc1)C(=O)c1ccc(cc1)S(=O)(=O)Nc1ccccc1
Brc1ccc(Nc2ncnc3ccc(NC(=O)Cc4cccc(Br)c4)cc23)cc1
CC(C)S(=O)(=O)c1ccccc1Nc1nc(Nc2cccc(NC(=O)CN)c2)ncc1Cl
COc1cc(ccc1NC(=O)c1cc2ccccc2n1C)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |wU:24.26,wD:27.33,(1.55,-1.69,;1.62,-3.24,;3.01,-3.96,;3.06,-5.49,;4.43,-6.21,;5.72,-5.39,;5.67,-3.86,;4.32,-3.13,;4.3,-1.59,;5.62,-.8,;6.97,-1.55,;5.6,.74,;6.72,1.79,;6.09,3.17,;6.72,4.59,;5.81,5.83,;4.29,5.68,;3.66,4.26,;4.56,3.01,;4.25,1.49,;2.85,.85,;4.49,-7.75,;5.72,-8.66,;5.25,-10.12,;6.2,-11.32,;7.73,-11.09,;8.68,-12.27,;8.12,-13.71,;6.6,-13.95,;5.63,-12.74,;9.08,-14.91,;10.61,-14.67,;11.57,-15.87,;11.02,-17.3,;11.97,-18.52,;9.49,-17.54,;8.52,-16.33,;3.72,-10.12,;2.68,-11.25,;1.19,-10.92,;.71,-9.48,;1.73,-8.33,;1.27,-6.86,;3.24,-8.66,)|
COc1cc(ccc1NC(=O)c1cc2ccccc2[nH]1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |wU:23.25,wD:26.32,(1.45,-1.92,;1.52,-3.48,;2.9,-4.2,;2.97,-5.74,;4.32,-6.46,;5.63,-5.64,;5.57,-4.09,;4.21,-3.37,;4.2,-1.83,;5.51,-1.03,;6.86,-1.8,;5.49,.51,;6.63,1.55,;5.98,2.93,;6.61,4.35,;5.7,5.59,;4.18,5.43,;3.55,4.03,;4.46,2.77,;4.16,1.25,;4.39,-8,;5.62,-8.89,;5.14,-10.36,;6.09,-11.55,;7.63,-11.32,;8.58,-12.52,;8.02,-13.95,;6.49,-14.19,;5.53,-12.99,;8.99,-15.14,;10.5,-14.91,;11.47,-16.1,;10.91,-17.54,;11.88,-18.76,;9.38,-17.78,;8.43,-16.58,;3.61,-10.36,;2.57,-11.5,;1.08,-11.17,;.61,-9.71,;1.64,-8.57,;1.17,-7.1,;3.13,-8.89,)|
COc1cc(ccc1NCc1ccco1)-c1nn([C@H]2CC[C@@H](CC2)N2CCN(C)CC2)c2ncnc(N)c12 |wU:18.19,wD:21.26,(1.27,4.51,;1.34,2.96,;2.73,2.24,;2.78,.71,;4.15,-.01,;5.44,.81,;5.39,2.35,;4.04,3.08,;4.02,4.61,;5.34,5.4,;6.69,4.65,;8.02,5.45,;9.17,4.42,;8.56,3.02,;7.04,3.15,;4.2,-1.55,;5.44,-2.46,;4.96,-3.92,;5.92,-5.11,;7.44,-4.88,;8.4,-6.07,;7.84,-7.5,;6.32,-7.75,;5.35,-6.53,;8.79,-8.7,;8.24,-10.12,;9.21,-11.33,;10.73,-11.09,;11.68,-12.31,;11.29,-9.66,;10.33,-8.46,;3.43,-3.92,;2.4,-5.04,;.91,-4.72,;.43,-3.27,;1.45,-2.13,;.99,-.65,;2.96,-2.46,)|
COc1ccc(\C=C\C(=O)c2c(O)ccc3c(C)cc(=O)oc23)cc1O
CN1CCN(CC1)c1ccc2n(c(nc2n1)-c1ccc(F)cc1)-c1ccnc(NC2CCCC2)n1
OC1(CCNCC1)c1nc(c(o1)-c1ccnc(NC2CCCCC2)c1)-c1ccc(F)cc1
CN1CCC(O)(CC1)c1cn(c(n1)-c1cccc(c1)C(F)(F)F)-c1ccnc(NC2CCCC2)n1
COC(=O)c1cc(OCC(=O)N[C@H](C(=O)NCc2ccc3OCOc3c2)c2ccccc2)cc(n1)C(=O)OC
COC(=O)c1cc(OCC(=O)N[C@@H](C(C)C)C(=O)NCc2cccc(OC)c2)cc(n1)C(=O)OC
COC(=O)c1cc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)NCc2ccc3OCOc3c2)cc(n1)C(=O)OC
COc1ccc(CNC(=O)[C@H](CC(C)C)NC(=O)COc2cc(cc(c2)C(O)=O)C(O)=O)cc1
COC(=O)c1cc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)NCc2cccc(OC)c2)cc(n1)C(=O)OC
COc1cccc(CNC(=O)[C@@H](NC(=O)COc2cc3C(=O)O[Cu]4(O)OC(=O)c(c2)[n+]34)c2ccccc2)c1
COc1cccc(CNC(=O)[C@H](Cc2ccccc2)NC(=O)COc2cc3C(=O)O[Cu]4(O)OC(=O)c(c2)[n+]34)c1
C[C@H]1CN(CCN1)c1ccc2nc(Nc3c(C)cccc3Cl)c3cncn3c2n1
Cn1c(Nc2cccc(c2)C(C)(C)C)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
CC(=O)Nc1cc(Oc2ccc3n(C)c(Nc4cccc(c4)C(C)(C)C)nc3c2)ccn1
Oc1cc(cc(O)c1O)C1C(=O)C(=O)C(C(=O)C1=O)c1ccccc1 |(23.7,-16.67,;22.86,-15.37,;21.33,-15.44,;20.5,-14.15,;21.2,-12.78,;22.73,-12.7,;23.43,-11.33,;23.57,-14,;25.11,-13.93,;18.96,-14.22,;18.13,-12.92,;18.83,-11.55,;16.59,-13,;15.75,-11.7,;15.89,-14.36,;16.72,-15.66,;16.02,-17.03,;18.26,-15.59,;19.09,-16.88,;14.35,-14.44,;13.51,-13.15,;11.98,-13.22,;11.27,-14.6,;12.1,-15.89,;13.64,-15.82,)|
Oc1cc2oc3c(C(=O)C(=O)C(C3=O)c3ccccc3)c2cc1O
Oc1ccc(cc1O)C1C(=O)C(=O)C(C(=O)C1=O)c1ccccc1 |(4.74,-13.67,;3.2,-13.75,;2.36,-12.45,;.83,-12.52,;.13,-13.89,;.96,-15.19,;2.49,-15.11,;3.32,-16.41,;-1.41,-13.96,;-2.24,-12.67,;-1.54,-11.3,;-3.79,-12.74,;-4.62,-11.44,;-4.48,-14.11,;-3.65,-15.4,;-4.35,-16.77,;-2.12,-15.33,;-1.28,-16.62,;-6.02,-14.18,;-6.86,-12.89,;-8.39,-12.97,;-9.1,-14.34,;-8.27,-15.63,;-6.73,-15.57,)|
O=C1C(C(=O)C(=O)C(C1=O)c1ccccc1)c1ccccc1 |(-5.28,2.61,;-4.44,1.32,;-5.14,-.05,;-4.31,-1.35,;-5.01,-2.72,;-2.77,-1.27,;-1.94,-2.57,;-2.07,.09,;-2.9,1.39,;-2.2,2.76,;-.53,.17,;.3,-1.13,;1.83,-1.06,;2.54,.31,;1.7,1.61,;.17,1.53,;-6.68,-.13,;-7.52,1.16,;-9.05,1.09,;-9.76,-.28,;-8.93,-1.58,;-7.38,-1.51,)|
Oc1ccc(cc1)C1C(=O)C(=O)C(C(=O)C1=O)c1ccccc1 |(22.55,.44,;21.01,.36,;20.3,-1.01,;18.77,-1.08,;17.94,.22,;18.64,1.58,;20.17,1.66,;16.4,.15,;15.57,1.44,;16.27,2.81,;14.03,1.37,;13.19,2.66,;13.33,0,;14.17,-1.3,;13.46,-2.67,;15.7,-1.22,;16.53,-2.52,;11.79,-.08,;10.95,1.22,;9.42,1.14,;8.71,-.23,;9.54,-1.53,;11.09,-1.46,)|
CS(=O)(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:11.13,wD:4.3,(1.06,4.97,;1.05,3.73,;1.93,3.21,;2.12,4.34,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;2.34,1.32,;2.39,2.86,;3.74,3.59,;5.05,2.78,;5.01,1.24,;3.65,.51,;3.61,-.72,;3.79,5.12,;5.05,5.94,;4.63,7.43,;3.1,7.48,;2.12,8.67,;.58,8.39,;.06,6.95,;-1.15,6.73,;1.06,5.75,;2.58,6.04,)|
Oc1cc([nH]n1)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:6.6,wD:13.16,(7.34,-.85,;6.12,-.67,;5.04,-1.77,;3.68,-1.07,;3.89,.44,;5.4,.7,;2.26,-1.79,;2.13,-3.4,;.73,-4.07,;-.57,-3.2,;-.48,-1.66,;.83,-1.64,;.86,-3.36,;.93,-.96,;.98,.59,;-.32,1.41,;-.27,2.95,;-1.58,3.76,;-2.94,3.04,;-2.99,1.5,;-1.68,.69,;-1.73,-.55,;-1.52,5.3,;-2.72,6.2,;-2.21,7.66,;-.67,7.61,;.39,8.73,;1.9,8.35,;2.32,6.88,;3.52,6.58,;1.25,5.75,;-.25,6.14,)|
[H][C@]1(C(O)CO)C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wD:12.14,1.0,TLB:2:1:8.7:10.11,THB:13:12:8.7:10.11,(-.64,1.55,;.13,.87,;1.58,1.51,;2.6,.82,;1.69,3.04,;2.79,3.59,;1.39,,;2.86,.48,;2.23,-.94,;,-.67,;-.29,-2.25,;1.15,-1.65,;-1.3,.28,;-2.82,.5,;-3.77,-.71,;-3.2,-2.14,;-4.15,-3.35,;-5.68,-3.13,;-6.25,-1.7,;-5.3,-.49,;-5.76,.65,;-3.58,-4.78,;-4.4,-6.04,;-3.43,-7.23,;-2,-6.66,;-.62,-7.36,;.67,-6.49,;.57,-4.96,;1.59,-4.28,;-.83,-4.26,;-2.1,-5.13,)|
[H][C@]1(C(C)O)C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wD:11.13,1.0,TLB:2:1:7.6:9.10,THB:12:11:7.6:9.10,(-.64,1.54,;.13,.87,;1.58,1.51,;1.76,2.72,;2.54,.74,;1.38,,;2.86,.48,;2.23,-.94,;,-.67,;-.29,-2.25,;1.15,-1.65,;-1.3,.28,;-2.82,.5,;-3.77,-.71,;-3.2,-2.14,;-4.15,-3.35,;-5.67,-3.13,;-6.25,-1.7,;-5.29,-.49,;-5.75,.65,;-3.58,-4.78,;-4.4,-6.03,;-3.42,-7.22,;-2,-6.66,;-.62,-7.36,;.67,-6.49,;.57,-4.96,;1.59,-4.27,;-.83,-4.26,;-2.1,-5.13,)|
CNC(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:11.13,wD:4.3,(3.45,3.56,;2.38,2.95,;1.05,3.73,;1.06,4.97,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.83,-3.93,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.12,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
Cc1nnc(o1)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:6.6,wD:13.16,(7.33,-.85,;6.11,-.67,;5.4,.7,;3.88,.44,;3.68,-1.07,;5.04,-1.77,;2.26,-1.79,;2.12,-3.4,;.73,-4.07,;-.57,-3.2,;-.48,-1.66,;.83,-1.64,;.86,-3.35,;.93,-.96,;.98,.59,;-.32,1.41,;-.27,2.95,;-1.57,3.76,;-2.93,3.04,;-2.99,1.5,;-1.68,.68,;-1.73,-.55,;-1.52,5.3,;-2.72,6.2,;-2.2,7.65,;-.67,7.61,;.39,8.73,;1.9,8.35,;2.32,6.87,;3.52,6.58,;1.24,5.75,;-.25,6.13,)|
Cc1noc(n1)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:13.16,wD:6.6,(4.75,4.05,;3.52,4.21,;2.78,5.56,;1.27,5.27,;1.1,3.76,;2.47,3.09,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.83,-3.93,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.12,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
CC(=O)NS(=O)(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:14.16,wD:7.6,(3.73,4.94,;3.72,3.71,;4.78,3.08,;2.38,2.95,;1.05,3.73,;1.06,4.97,;2.12,4.34,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.83,-3.93,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.12,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
Oc1cc(no1)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:13.16,wD:6.6,(4.75,4.05,;3.53,4.21,;2.47,3.09,;1.1,3.76,;1.27,5.28,;2.79,5.56,;-.29,2.98,;-1.7,3.76,;-3.04,2.98,;-3.04,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.03,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.84,-3.94,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.13,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
Fc1cnc2[nH]cc(-c3ncc(F)c(N[C@H]4C5CCC(CC5)[C@@H]4c4nc(=O)o[nH]4)n3)c2c1 |r,wU:22.24,wD:15.14,(3.52,6.58,;2.32,6.87,;1.9,8.35,;.39,8.73,;-.67,7.61,;-2.2,7.65,;-2.72,6.2,;-1.52,5.3,;-1.57,3.76,;-2.93,3.04,;-2.99,1.5,;-1.68,.68,;-1.73,-.55,;-.32,1.41,;.98,.59,;.93,-.96,;-.48,-1.66,;-.57,-3.2,;.73,-4.07,;2.12,-3.4,;.86,-3.35,;.83,-1.64,;2.26,-1.79,;3.68,-1.07,;5.04,-1.77,;6.11,-.67,;7.33,-.85,;5.4,.7,;3.88,.44,;-.27,2.95,;-.25,6.13,;1.24,5.75,)|
Oc1cc(on1)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:13.16,wD:6.6,(4.75,4.05,;3.53,4.21,;2.47,3.09,;1.1,3.76,;1.27,5.28,;2.79,5.56,;-.29,2.98,;-1.7,3.76,;-3.04,2.98,;-3.04,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.03,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.84,-3.94,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.13,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
NS(=O)(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:11.13,wD:4.3,(1.06,4.97,;1.05,3.73,;1.93,3.21,;2.12,4.34,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;2.34,1.32,;2.39,2.86,;3.74,3.59,;5.05,2.78,;5.01,1.24,;3.65,.51,;3.61,-.72,;3.79,5.12,;5.05,5.94,;4.63,7.43,;3.1,7.48,;2.12,8.67,;.58,8.39,;.06,6.95,;-1.15,6.73,;1.06,5.75,;2.58,6.04,)|
OP(O)(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:11.13,wD:4.3,(1.06,4.97,;1.05,3.73,;2.12,4.34,;1.93,3.21,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;2.34,1.32,;2.39,2.86,;3.74,3.59,;5.05,2.78,;5.01,1.24,;3.65,.51,;3.61,-.72,;3.79,5.12,;5.05,5.94,;4.63,7.43,;3.1,7.48,;2.12,8.67,;.58,8.39,;.06,6.95,;-1.15,6.73,;1.06,5.75,;2.58,6.04,)|
Fc1cnc2[nH]cc(-c3ncc(F)c(N[C@H]4C5CCC(CC5)[C@@H]4c4nnn[nH]4)n3)c2c1 |r,wU:15.14,wD:22.24,(-5.47,-.22,;-5.12,-1.4,;-6.19,-2.51,;-5.76,-4.01,;-4.26,-4.36,;-3.53,-5.71,;-2.01,-5.43,;-1.83,-3.93,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;.93,-.95,;.98,.59,;-.33,1.41,;-1.7,.63,;-3.03,1.41,;-3.03,2.98,;-1.7,3.76,;-2.37,2.68,;-.96,1.7,;-.29,2.98,;1.1,3.76,;2.47,3.09,;3.52,4.21,;2.78,5.56,;1.27,5.27,;-.42,-1.67,;-3.19,-3.25,;-3.61,-1.77,)|
Fc1cnc2[nH]cc(-c3ncc(F)c(N[C@H]4C5CCC(CC5)[C@@H]4Cn4oc(=O)[nH]c4=O)n3)c2c1 |r,wU:15.14,wD:22.24,(-5.47,-.22,;-5.12,-1.4,;-6.19,-2.51,;-5.76,-4.01,;-4.26,-4.36,;-3.53,-5.71,;-2.01,-5.43,;-1.83,-3.93,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;.93,-.95,;.98,.59,;-.33,1.41,;-1.7,.63,;-3.03,1.41,;-3.03,2.98,;-1.7,3.76,;-2.37,2.68,;-.96,1.7,;-.29,2.98,;1.05,3.73,;2.38,2.95,;2.5,1.43,;4,1.09,;4.49,-.04,;4.79,2.42,;3.77,3.57,;4.03,4.78,;-.42,-1.67,;-3.19,-3.25,;-3.61,-1.77,)|
OP(O)(=O)CC[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:13.15,wD:6.5,(3.73,4.94,;3.72,3.71,;4.79,4.32,;4.78,3.08,;2.38,2.95,;1.05,3.73,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.83,-3.93,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.12,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
Fc1ccc(Nc2c(cnc3cnc(NCc4cccnc4)cc23)C#N)cc1Cl
N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Oc2ccccc2)cc1
Fc1ccc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1Cl
N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Cc2ccccc2)cc1
N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Sc2ccccc2)cc1
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(O)=O
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
COc1cnc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC4CCOCC4)c23)c1
COc1cnc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC(C)C)c23)c1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCN4CCN(CC4)C(C)=O)cc(OC(C)C)c23)n1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCN4CCN(C)CC4)cc(OC(C)C)c23)n1
COc1cnc(Cl)c(Nc2ncnc3cc(OCCN4CCN(CC4)C(C)=O)cc(OC(C)C)c23)n1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCN4CCCC4)cc(OC(C)C)c23)n1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCN4CCOCC4)cc(OC(C)C)c23)n1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC4CCOCC4)c23)n1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCN(C)CC4)cc(OC(C)C)c23)n1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCCC4)cc(OC(C)C)c23)n1
COc1ncc(Cl)c(Nc2ncnc3cc(OCCN4CCN(CC4)C(C)=O)cc(OC(C)C)c23)n1
COc1cc(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC(C)C)c23)c(Cl)cn1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCN(CC4)C(C)=O)cc(OC(C)C)c23)n1
COc1cc(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC4CCOCC4)c23)c(Cl)cn1
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC(C)C)c23)n1
CC(=O)N1CCN(CC1)C2CCC(CC2)n3c4c(c(n3)c5ccc(c(c5)OC)NC(=O)c6cc7ccccc7n6C)c(ncn4)N
COc1cc(ccc1NC(=O)c1cc2ccccc2n1C)-c1nn(C2CCN(CC2)C2CCN(CC2)C(C)=O)c2ncnc(N)c12
COc1cc2Cc3c(Nc4cccc(F)c4)[nH]nc3-c2cc1OC
CN1CCN(CC1)c2ccc(cc2)Nc3ncc(c(n3)NC[C@H]4CCCO4)Cl
c1cc(c(cc1/C=C/C(=O)c2ccc(cc2O)O)O)O
CN1CCN(CC1)c1ccc(NC(=O)c2cc(c[nH]c2=O)-c2ccc3OCOc3c2)cc1
CN1CCN(Cc2ccc(NC(=O)c3cc(c[nH]c3=O)-c3ccc4OCOc4c3)cc2)CC1
CN1CCN(CCc2ccc(NC(=O)c3cc(c[nH]c3=O)-c3ccc4OCOc4c3)cc2)CC1
CN1CCN(CCCc2ccc(NC(=O)c3cc(c[nH]c3=O)-c3ccc4OCOc4c3)cc2)CC1
CCn1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
Cc1ccc(cc1C#Cc2cnc3n2nccc3)C(=O)Nc4ccc(c(c4)C(F)(F)F)CN5CCN(CC5)C
CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3nn(C4CCN(CC4)C(=O)C=C)c4ncnc(N)c34)cc2C(F)(F)F)CC1
CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3nn(C4CCNCC4)c4ncnc(N)c34)cc2C(F)(F)F)CC1
CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3nn([C@@H]4CCOC4)c4ncnc(N)c34)cc2C(F)(F)F)CC1 |r|
CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3nn([C@H]4CCOC4)c4ncnc(N)c34)cc2C(F)(F)F)CC1 |r|
COCn1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3nn(C4CCCC4)c4ncnc(N)c34)cc2C(F)(F)F)CC1
CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3nn(C4CCC4)c4ncnc(N)c34)cc2C(F)(F)F)CC1
CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3nn(C)c4ncnc(N)c34)cc2C(F)(F)F)CC1
CC(C)n1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(CCO)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3nn(C(C)C)c4ncnc(N)c34)cc2C(F)(F)F)CC1
CC(C)n1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCOCC3)c(c2)C(F)(F)F)c2c(N)ncnc12
CC(C)n1nc(C#Cc2cc(ccc2C)C(=O)Nc2cccc(c2)C(F)(F)F)c2c(N)ncnc12
CC(C)n1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(C)CC3)c(Br)c2)c2c(N)ncnc12
CC(C)n1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(C)CC3)c(Cl)c2)c2c(N)ncnc12
CC(C)n1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(C)CC3)cc2)c2c(N)ncnc12
CC(C)n1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
CCn1nc(C#Cc2cc(ccc2O)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
CCn1nc(C#Cc2cc(ccc2OC)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
CCn1nc(C#Cc2cc(ccc2C(C)C)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
CCc1ccc(cc1C#Cc1nn(CC)c2ncnc(N)c12)C(=O)Nc1ccc(CN2CCN(C)CC2)c(c1)C(F)(F)F
CCn1nc(C#Cc2cc(ccc2Cl)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
CCn1nc(C#Cc2cccc(c2)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
CSc1nc(N2CCCCC2)c2cnn(CC(Cl)c3ccccc3)c2n1
CCCNc1nc(SC)nc2n(CC(Cl)c3ccccc3)ncc12
BrC(Cn1ncc2c(NCc3ccccc3)ncnc12)c1ccccc1
CCOCCNc1ncnc2n(CC(Br)c3ccccc3)ncc12
CSc1nc(NCCc2ccccc2)c2cnn(CC(Cl)c3ccccc3)c2n1
CC(C)Nc1ncnc2n(CC(Br)c3ccccc3)ncc12
CCCCNc1ncnc2n(CC(Br)c3ccccc3)ncc12
BrC(Cn1ncc2c(ncnc12)N1CCCC1)c1ccccc1
C1CCC(CC1)Nc1ncnc2n(\C=C/c3ccccc3)ncc12
CCCNc1nc(SCC)nc2n(CC(Cl)c3ccccc3)ncc12
CCN(CC)c1nc(SC)nc2n(CC(Cl)c3ccccc3)ncc12
OC(Cn1ncc2c(NCc3ccccc3)ncnc12)c1ccccc1
CSc1nc(N2CCOCC2)c2cnn(CC(Cl)c3ccccc3)c2n1
CCCCNc1nc(SCC)nc2n(CC(Cl)c3ccccc3)ncc12
CCSc1nc(N2CC(C)OC(C)C2)c2cnn(\C=C/c3ccccc3)c2n1
OC(Cn1ncc2c(NCCc3ccccc3)ncnc12)c1ccccc1
CCCNc1ncnc2n(CC(Br)c3ccccc3)ncc12
C(Nc1ncnc2n(\C=C/c3ccccc3)ncc12)c1ccccc1
BrC(Cn1ncc2c(ncnc12)N1CCCCC1)c1ccccc1
CCSc1nc(NCc2ccccc2)c2cnn(CC(Cl)c3ccccc3)c2n1
CSc1nc(NCc2ccccc2)c2cnn(CC(Cl)c3ccccc3)c2n1
CCSc1nc(N2CCOCC2)c2cnn(CC(Cl)c3ccccc3)c2n1
CCCCNc1nc(SC)nc2n(CC(Cl)c3ccccc3)ncc12
CCSc1nc(N2CCCCC2)c2cnn(CC(Cl)c3ccccc3)c2n1
C1CC1Nc1ncnc2n(\C=C/c3ccccc3)ncc12
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)C1(CN(C)C1)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)C1CCNC1=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCC[C@@H]1C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)CC(N)=O
CO[C@@H]1C[C@@H](N(Cc2cc3c(Nc4cccc(Cl)c4F)ncnc3cc2OC)C1)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)C1(CCN(C)CC1)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCC1C(N)=O
COC[C@H](N(C)Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCN(C)CC1C(N)=O
COCCN1CC(C1)(N(C)Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC)C(N)=O
COCC[C@H](N(C)Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCC[C@@H]1C(=O)N(C)C
CNC(=O)[C@@H](C)N(C)Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)[C@H](C)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(CCN(C)C)[C@@H](C)C(N)=O
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1CN1CCC[C@@H]1C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)[C@@H](CO)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)[C@H](C)C(=O)N(C)C
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCC[C@H]1C(N)=O
COCCN(Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC)[C@@H](C)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCCC[C@@H]1C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCC[C@H]1CC(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)[C@@H](C)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCCC1
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C(C)C)[C@@H](C)C(N)=O
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1CN1CCC[C@H]1C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)[C@@H](CN(C)C)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN[C@H](C)C(N)=O
CNC(=O)[C@H]1CCCN1Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCOCC1C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CC[C@@H](C1)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)C1(CN(C1)C(C)C)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CC(C1)C(N)=O
COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)C1(CCN(CC1)C(C)C)C(N)=O
Clc1ccc(C(=O)Nc2nnc(CCc3ccccc3)s2)c(Cl)c1
O=C1NN(C(=O)C1=Cc1ccccc1OCc1ccccc1)c1ccccc1 |w:7.8|
COc1cc(SC)ccc1C(=O)Nc1nnc(CCc2ccccc2)s1
Clc1ccc(cc1Cl)N1NC(=O)C(=Cc2cccc(OCc3ccccc3)c2)C1=O |w:13.14|
Ic1ccc(C=C2C(=O)NN(C2=O)c2ccc(I)cc2)cc1 |w:5.4|
Ic1ccc(cc1)N1NC(=O)C(=Cc2ccccc2)C1=O |w:12.13|
COc1ccc(cc1)C(=O)Nc1nnc(Cc2c[nH]c3ccccc23)s1
CCN(CC)c1ccc(C=C2C(=O)NN(C2=O)c2ccc(I)cc2)c(O)c1 |w:9.8|
Brc1cc2OCOc2cc1C=C1C(=O)NN(C1=O)c1ccc(I)cc1 |w:10.11|
Cc1ccc(cc1C)N1NC(=O)C(=Cc2ccc(o2)-c2ccc(C)c(Cl)c2)C1=O |w:13.14|
Nc1ncnc2n[nH]c(-c3ccc(Cl)cc3)c12
COc1cc(Nc2c(cnc3cc(C#Cc4cccc(CN5CCN(C)CC5)n4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#Cc4ccc(CN5CCN(C)CC5)cn4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#Cc4ccc(CN(C)C)cc4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#Cc4ccc(CN(C)C)s4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#Cc4cccc(CN(C)C)c4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#Cc4cc(CN(C)C)ccn4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#Cc4cccc(CN(C)C)n4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)C#Cc2cccc(CN(C)C)n2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#Cc4cccc(CCN(C)C)n4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#Cc4cccc(CCN5CCN(C)CC5)n4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#Cc4cncc(CN(C)C)c4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc2c(Nc3cc(OC)c(OC)c(OC)c3)c(cnc2cc1C#Cc1cccc(CN(C)C)n1)C#N
COc1cc(Nc2c(cnc3cc(C#Cc4ccc(CN(C)C)cn4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)C#Cc2cccc(CN(C)C)n2)C#N)cc(OC)c1OC
CCOc1cc2c(Nc3cc(OC)c(Cl)cc3Cl)c(cnc2cc1C#Cc1cccc(CN(C)C)n1)C#N
COc1cc(Nc2c(cnc3cc(C#Cc4ncccc4CN(C)C)c(OC)cc23)C#N)c(Cl)cc1Cl
Clc1cccc(Cl)c1C1=Cc2cnc(Nc3ccc(cc3)N3CCOCC3)nc2N2CCC(=O)N12 |t:9|
CCN(CC)CCOc1ccc(Nc2ncc3C=C(N4N(CCC4=O)c3n2)c2c(Cl)cccc2Cl)cc1 |c:17|
CN(C)c1ccc(Nc2ncc3C=C(N4N(CCC4=O)c3n2)c2cc(O)ccc2Cl)cc1 |c:12|
CN1CCN(CC1)c1ccc(Nc2ncc3C=C(N4N(CCC4=O)c3n2)c2cc(O)ccc2Cl)cc1 |c:17|
N#Cc1ccc(cc1)-c1cnc2ccc(NCc3ccccc3)nn12
OC1CCN(CC1)c1cc(ccn1)-c1cnc2ccc(nn12)N1CCC[C@@H]1c1cccc(F)c1 |r|
OC(=O)CN1CCN(CC1)c1cc(ccn1)-c1cnc2ccc(nn12)N1CCC[C@@H]1c1cccc(F)c1 |r|
Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
COc1cc(cnc1Cl)N1CCc2nc(NC(=O)NCCc3cn(CC(F)F)cn3)sc2C1
COc1cncc(n1)N1CCc2nc(NC(=O)NCCc3cn(CC(F)F)cn3)sc2C1
Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
Nc1nnc2cc(ccc2n1)-c1cccc(O)c1
CCOC1CN(C)CCN1c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(NS(=O)(=O)CCN4CCCC4)c3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(NS(=O)(=O)CCN4CCCC4)cc3)nnc2c1
CCCOC1CN(C)CCN1c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1
Nc1nnc2cc(ccc2n1)-c1ccc2ccccc2c1
CCOC1CN(C)CCN1c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Cc1cccc(C)c1-c1ccc2nc(N)nnc2c1
CCOC1CN(CCO1)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Cc1cc(cc2nnc(N)nc12)-c1cc(O)ccc1Cl
Nc1nnc2cc(ccc2n1)-c1ccccc1
CCCOC1CN(C)CCN1c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Nc1nnc2cc(ccc2n1)-c1ccc2OCOc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(N)nnc2c1
Cc1cc(cc2nnc(N)nc12)-c1c(Cl)cccc1Cl
Cc1cc(cc2nnc(N)nc12)-c1ccccc1Cl
CNc1ncc2cc(c(C)nc2n1)-c1cc(NC(=O)NCCC(C)(C)C)c(F)cc1C
Cc1ccc(cc1-c1ccc2nc(NCCN3CCOCC3)ncc2c1)C(=O)Nc1cccc(c1)C(F)(F)F
CNc1ncc2cc(ccc2n1)-c1cc(ccc1C)C(=O)Nc1cc(ccc1OC1CCN(C)CC1)C(F)(F)F
CCN(CC)CCNc1cc(Nc2cc(O)ccc2C)nc(n1)-n1cnc2ccccc12
Cc1cc2cn[nH]c2cc1-c1cccc2c(N)c(nnc12)C(N)=O
N[C@@H](Cc1ccc(O)cc1)C(=O)NO |r|
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12 |t:13|
CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl
COc1cc(Nc2c(cnc3cc(C#CCCN4CCNCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#CCCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#CCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc2c(Nc3cc(OC)c(OC)c(OC)c3)c(cnc2cc1C#CCCN1CCN(C)CC1)C#N
CCOc1cc2c(Nc3cc(OC)c(Cl)cc3Cl)c(cnc2cc1C#CCCN1CCN(C)CC1)C#N
COc1cc(Nc2c(cnc3ccc(cc23)C#CCCN2CCN(C)CC2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)C#CCCN2CCN(C)CC2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(C#CCCN(C)C)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)C#CCCN2CCN(C)CC2)C#N)cc(OC)c1OC
COc1cc2c(Nc3ccc(Cl)cc3Cl)c(cnc2cc1C#CCCN1CCN(C)CC1)C#N
COc1cc(Nc2c(cnc3cc(C#CCCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
Fc1cccc(Nc2nc(SC3CCCC3)nc3n(CC(Cl)c4ccccc4)ncc23)c1
Oc1cccc(Nc2nc(SC3CCCC3)nc3n(CC(Cl)c4ccccc4)ncc23)c1
ClC(Cn1ncc2c(Nc3cccc(Br)c3)nc(SCCN3CCOCC3)nc12)c1ccccc1
COc1cc(ccc1NC(=O)c1cc2ccccc2n1C)-c1csc2c(\C=C\CN[C@@H]3CC[C@H](N)CC3)cnc(N)c12 |wU:30.32,33.36,(28.87,-24.7,;27.4,-24.22,;26.26,-25.25,;24.79,-24.77,;23.65,-25.8,;23.98,-27.31,;25.43,-27.78,;26.58,-26.75,;28.03,-27.23,;28.36,-28.73,;27.21,-29.77,;29.82,-29.21,;30.29,-30.69,;31.84,-30.68,;32.87,-31.82,;34.38,-31.5,;34.86,-30.04,;33.82,-28.89,;32.32,-29.21,;31.08,-28.3,;31.08,-26.76,;22.18,-25.32,;20.94,-26.24,;19.69,-25.33,;20.17,-23.87,;19.4,-22.55,;17.86,-22.55,;17.09,-21.22,;15.55,-21.23,;14.78,-19.89,;15.54,-18.56,;17.09,-18.56,;17.85,-17.23,;17.09,-15.9,;17.86,-14.57,;15.55,-15.9,;14.78,-17.23,;20.16,-21.22,;21.7,-21.22,;22.47,-22.55,;24.01,-22.55,;21.7,-23.87,)|
COc1cc(ccc1NC(=O)c1cc2ccccc2n1C)-c1csc2c(\C=C\CN[C@H]3CC[C@H](N)CC3)cnc(N)c12 |wU:30.32,wD:33.36,(5.61,-23.77,;4.15,-23.29,;3.01,-24.32,;1.54,-23.84,;.4,-24.87,;.73,-26.38,;2.18,-26.85,;3.33,-25.82,;4.78,-26.3,;5.1,-27.8,;3.96,-28.84,;6.57,-28.28,;7.04,-29.76,;8.59,-29.75,;9.62,-30.9,;11.13,-30.57,;11.61,-29.11,;10.57,-27.96,;9.07,-28.28,;7.83,-27.37,;7.83,-25.83,;-1.07,-24.39,;-2.31,-25.31,;-3.56,-24.4,;-3.08,-22.94,;-3.85,-21.62,;-5.39,-21.62,;-6.16,-20.29,;-7.7,-20.3,;-8.47,-18.96,;-7.71,-17.63,;-8.47,-16.3,;-7.7,-14.97,;-6.16,-14.97,;-5.39,-13.64,;-5.4,-16.3,;-6.16,-17.63,;-3.09,-20.3,;-1.55,-20.29,;-.79,-21.62,;.75,-21.62,;-1.55,-22.94,)|
COc1cc(ccc1NC(=O)c1cc2ccccc2n1C)-c1csc2c(\C=C\CN3CCC(O)CC3)cnc(N)c12
CCN(CC)C\C=C\c1cnc(N)c2c(csc12)-c1ccc(NC(=O)c2cc3ccccc3n2C)c(OC)c1
COc1cc(ccc1NC(=O)c1cc2ccccc2n1C)-c1csc2c(\C=C\CNC3CCNCC3)cnc(N)c12
CCOc1cccc2n(C)cc(C=c3c(=O)[nH][nH]\c3=c3/snnc3=C)c12 |w:12.11|
CCSc1nc(Nc2cccc(F)c2)c2cnn(CC(C)c3ccccc3)c2n1
CCSc1nc(Nc2cccc(Cl)c2)c2cnn(CC(C)c3ccccc3)c2n1
CC(C)Sc1nc(Nc2cccc(O)c2)c2cnn(CC(Cl)c3ccccc3)c2n1
CCSc1nc(Nc2cccc(Br)c2)c2cnn(CC(C)c3ccccc3)c2n1
ClC(Cn1ncc2c(Nc3ccccc3)nc(SC3CCCC3)nc12)c1ccccc1
ClC(Cn1ncc2c(Nc3ccccc3)nc(SCCN3CCOCC3)nc12)c1ccccc1
ClC(Cn1ncc2c(Nc3cccc(Cl)c3)nc(SCCN3CCOCC3)nc12)c1ccccc1
Cl.CC(Cn1ncc2c(Nc3cccc(O)c3)nc(SCCN3CCOCC3)nc12)c1ccccc1
CSc1nc(Nc2cccc(O)c2)c2cnn(CCc3ccccc3)c2n1
CSc1nc(Nc2cccc(O)c2)c2cnn(CC(Cl)c3ccccc3)c2n1
Clc1cccc(Nc2nc(SCCN3CCOCC3)nc3n(CCc4ccccc4)ncc23)c1
CCCCSc1nc(Nc2cccc(O)c2)c2cnn(CC(Cl)c3ccccc3)c2n1
Cl.Oc1cccc(Nc2nc(SCCN3CCOCC3)nc3n(CCc4ccccc4)ncc23)c1
CC(C)Sc1nc(Nc2ccccc2)c2cnn(CC(Cl)c3ccccc3)c2n1
CC(C)Sc1nc(Nc2cccc(F)c2)c2cnn(CC(Cl)c3ccccc3)c2n1
CC(C)Sc1nc(Nc2cccc(Br)c2)c2cnn(CC(Cl)c3ccccc3)c2n1
c1ccc(cc1)[C@H](Cn2c3c(cn2)c(nc(n3)SCCN4CCOCC4)Nc5ccccc5)Cl
CCSc1nc(Nc2cccc(O)c2)c2cnn(CC(C)c3ccccc3)c2n1
Cl[C@H](Cn1ncc2c(Nc3ccccc3)nc(SCCN3CCOCC3)nc12)c1ccccc1 |r|
CC(Cn1ncc2c(Nc3ccccc3)nc(SCCN3CCOCC3)nc12)c1ccccc1
CSc1nc(Nc2ccccc2)c2cnn(CCc3ccccc3)c2n1
CC(Cn1ncc2c(Nc3cccc(F)c3)nc(SCCN3CCOCC3)nc12)c1ccccc1
CSc1nc(Nc2cccc(F)c2)c2cnn(CCc3ccccc3)c2n1
CC(Cn1ncc2c(Nc3cccc(Cl)c3)nc(SCCN3CCOCC3)nc12)c1ccccc1
CSc1nc(Nc2cccc(Br)c2)c2cnn(CCc3ccccc3)c2n1
CC(C)Nc1ncnc2oc(c(-c3ccccc3)c12)-c1ccc(OCCN2CCCC2)cc1
C(CN1CCNCC1)Nc1ncnc2oc(c(-c3ccccc3)c12)-c1ccc(OCCN2CCCC2)cc1
Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(ccc-21)C(=O)NCc1ccncc1
O[C@H]1CC[C@@H](CC1)NC(=O)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1 |wU:4.7,wD:1.0,(19.77,-1.9,;21.02,-1.01,;22.42,-1.66,;23.69,-.77,;23.53,.76,;22.14,1.41,;20.89,.52,;24.79,1.65,;26.19,1.01,;26.33,-.53,;27.44,1.9,;27.3,3.44,;28.55,4.33,;29.95,3.7,;30.1,2.15,;31.61,1.81,;32.4,3.14,;33.83,3.77,;33.68,5.31,;32.16,5.65,;31.37,4.31,;35.16,2.99,;35.15,1.44,;36.46,.66,;37.81,1.42,;37.82,2.96,;36.49,3.74,;39.13,.64,;39.12,-.9,;40.44,-1.67,;41.78,-.91,;43.11,-1.69,;41.78,.63,;40.46,1.4,;28.85,1.26,)|
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
CNc1ncnc(n1)-c1cccnc1Oc1cc(NC(=O)c2cccc(OC(F)(F)C(F)F)c2)ccc1C
COCC(=O)Nc1cccc-2c1Cc1c-2n[nH]c1-c1csc(c1)C#CCOc1ccccc1
CN1CCN(CC(=O)Nc2cccc-3c2Cc2c-3n[nH]c2-c2csc(c2)C#CCOc2ccccc2)CC1
COCCOCC(=O)Nc1cccc-2c1Cc1c-2n[nH]c1-c1csc(c1)C#CCOc1ccccc1
COC(=O)C(=O)Nc1cccc-2c1Cc1c-2n[nH]c1-c1csc(c1)C#CCOc1ccccc1
CCOC(=O)CC(=O)Nc1cccc-2c1Cc1c-2n[nH]c1-c1csc(c1)C#CCOc1ccccc1
COCCOCC#Cc1cc(cs1)-c1[nH]nc-2c1Cc1ccc(Cn3cncn3)cc-21
CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(-c2ccc(CN3CCOCC3)nc2)c2ccccc12)C(C)(C)C
C=CC(=O)Nc1ccc2c(Nc3cc[nH]n3)nc(nc2c1)-c1ccccc1
CCC(=O)Nc1ccc2c(Nc3cc[nH]n3)nc(nc2c1)-c1ccccc1
Cc1cc(n[nH]1)Nc2cc(nc(n2)Oc3cccc(c3)NC(=O)C=C)N4CCN(CC4)C
CCC(=O)Nc1cccc(Oc2nc(Nc3cc(C)[nH]n3)cc(n2)N2CCN(C)CC2)c1
CN1CCN(CC1)c1cc(Nc2n[nH]c3ccccc23)nc(Oc2cccc(NC(=O)C=C)c2)n1
CCC(=O)Nc1cccc(Oc2nc(Nc3n[nH]c4ccccc34)cc(n2)N2CCN(C)CC2)c1
COc1cc(ccc1N)-c1ccc2c(Nc3ccc(CC(=O)Nc4ccc(cc4)N4CCOCC4)cc3NC2=O)c1
COc1cc(ccc1N)-c1ccc2c(Nc3ccc(cc3NC2=O)C(C)(C)C(=O)Nc2ccc(cc2)N2CCOCC2)c1
N#Cc1cnc2cnc(NCc3cccnc3)cc2c1NC1CCCCCC1
Oc1ccc2[nH]c3c(c4C(=O)NC(=O)c4c4c(O)ccc(O)c34)c2c1
O=C1NC(=O)c2c1c1[nH]cnc1c1[nH]c3ccccc3c21
COCCOc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OC
COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OC1CCN(C)CC1)C#N
COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OC
N#Cc1cnc2ccc(cc2c1N[C@@H]1C[C@H]1c1ccccc1)-c1ccc(CN2CCOCC2)cc1
COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OCc1ccccc1
COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OCCCN1CCOCC1
COc1ccc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2c1)C#N
COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCc1cccnc1)C#N
COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OCCCc1cccnc1
COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OCCN1CCOCC1
N#Cc1cnc2ccc(cc2c1N[C@@H]1C[C@H]1c1ccccc1)-c1cccc(CN2CCOCC2)c1
COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCN1CCN(C)CC1)C#N
N#Cc1cnc2cc(ccc2c1N[C@@H]1C[C@H]1c1ccccc1)-c1ccc(CN2CCOCC2)cc1
COc1ccc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2c1
NCc1ccc(cc1)-c1ccc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2c1
COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCN1CCOCC1)C#N
Fc1ccc(Nc2c(cnc3c(Cl)cc(NCc4cnc[nH]4)cc23)C#N)cc1Cl
Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl
OC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1
CN1CCN(CCCn2c3ccc(O)cc3c3c4C(=O)NC(=O)c4c(cc23)-c2ccccc2)CC1
Oc1ccc2n(CCCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
CN(C)CCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1
Oc1ccc2n(CCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
CN(C)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1
OCC(O)Cn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl
CN(CCOc1cccc2ncnc(Nc3ccc(OCc4ccccn4)c(Cl)c3)c12)C(=O)CO
ClC(Cn1ncc2c(Nc3cccc(Cl)c3)ncnc12)c1ccccc1 |w:1.0|
CSc1nc(NCCc2ccccc2Cl)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:20.21|
CCSc1nc(NCCc2ccccc2)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:20.21|
CSc1nc(NCc2ccccc2)c2cnn(CC(Cl)c3ccc(F)cc3)c2n1 |w:18.19|
CCSc1nc(Nc2cccc(Cl)c2)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:19.20|
CSc1nc(NCc2ccc(F)cc2)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:19.20|
CSc1nc(NCCc2cccc(F)c2)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:20.21|
CSc1nc(NCCc2ccc(Cl)cc2)c2ccn(CC(Cl)c3ccccc3)c2n1 |w:20.21|
CSc1nc(NCc2ccccc2)c2cnn(CC(Cl)c3ccc(Cl)cc3)c2n1 |w:18.19|
CCCSc1nc(Nc2cccc(Cl)c2)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:20.21|
CSc1nc(NCc2ccc(Cl)cc2)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:19.20|
CSc1nc(NCCc2ccc(C)cc2)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:20.21|
CSc1nc(NCc2ccccc2F)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:19.20|
CSc1nc(NCCc2cccc(Cl)c2)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:20.21|
CSc1nc(Nc2cccc(Br)c2)c2cnn(CC(Cl)c3ccc(F)cc3)c2n1 |w:18.19|
CSc1nc(Nc2cccc(Cl)c2)c2cnn(CC(Cl)c3ccccc3)c2n1
CSc1nc(NCCc2ccccc2)c2cnn(CC(Cl)c3ccc(Cl)cc3)c2n1 |w:19.20|
CSc1nc(Nc2cccc(F)c2)c2cnn(CC(Cl)c3ccccc3)c2n1
CSc1nc(NCc2cccc(F)c2)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:19.20|
CSc1nc(Nc2ccccc2)c2cnn(CC(Cl)c3ccccc3)c2n1
COc1ccc(CCNc2nc(SC)nc3n(CC(Cl)c4ccccc4)ncc23)cc1 |w:18.18|
CSc1nc(NCc2ccccc2Cl)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:19.20|
CSc1nc(Nc2cccc(Br)c2)c2cnn(CC(Cl)c3ccccc3)c2n1 |w:18.19|
Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCF)CC1
Nc1ccc2c(cc(=O)oc2c1)C(F)(F)F
CCCCCCCCCCc1c(C)c2ccc(N)cc2oc1=O
CCCCCCCCCCc1c(C)c2ccc(cc2oc1=O)N(CC)CCCC(O)=O
CCCCCCc1c(C)c2ccc(cc2oc1=O)N(CC)CCCC(O)=O
CN1CCN(C(C1)c1ccccc1)C(=O)CCSCCC(=O)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1
SCCC(=O)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1
C=CC(=O)N1CCCC1c1ccco1
C[C@@H](NC(=O)CCCCCC(=O)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1)c1ccco1 |r|
C[C@H](NC(=O)CCCCCC(=O)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1)c1ccco1 |r|
O=C(CCCCCC(=O)N1CCC[C@@H]1c1ccco1)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1 |r|
O=C(CCCCCC(=O)N1CCC[C@H]1c1ccco1)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1 |r|
CC(NC(=O)CCCCCC(=O)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1)c1ccco1
O=C(CCCCCC(=O)N1CCCC1c1ccco1)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1
CN1CCN(C(C1)c1ccccc1)C(=O)CCCCCC(=O)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1
CCCC(=O)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1
CC(=O)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1
CCN(CC)CCOc1ccc(Nc2cc(NC(=O)Nc3c(Cl)cccc3Cl)ncn2)cc1
CO\N=C(/C)c1ccc2n(CC(C)C)c3c4CCc5nn(C)cc5-c4c4C(=O)NCc4c3c2c1
CCO\N=C(/C)c1ccc2n(C(C)C)c3c4CCc5nn(C)cc5-c4c4C(=O)NCc4c3c2c1
N[C@@H](CCCCN=CC1C(=O)Nc2ccc(Br)cc12)C(O)=O |r,w:7.7|
N[C@@H](CCCN=CC1C(=O)Nc2ccc(Br)cc12)C(O)=O |r,w:6.6|
N[C@@H](CCCN=CC1C(=O)Nc2ccccc12)C(O)=O |r,w:6.6|
N[C@@H](CCCCN=CC1C(=O)Nc2ccccc12)C(O)=O |r,w:7.7|
CSc1nc(NCCc2ccccc2F)c2cnn(CC(Cl)c3ccccc3)c2n1
CCCNc1nc(SC)nc2n(CC(Cl)c3ccc(F)cc3)ncc12
CCCCNc1nc(SC)nc2n(CC(Cl)c3ccc(F)cc3)ncc12
CSc1nc(N2CCOCC2)c2cnn(CC(Cl)c3ccc(F)cc3)c2n1
CSc1nc(NCc2ccc(F)cc2)c2cnn(CC(Cl)c3ccc(F)cc3)c2n1
CSc1nc(NCc2ccccc2F)c2cnn(CC(Cl)c3ccc(F)cc3)c2n1
CSc1nc(NCCc2ccccc2)c2cnn(CC(Cl)c3ccc(F)cc3)c2n1
CSc1nc(Nc2cccc(F)c2)c2cnn(CC(Cl)c3ccc(F)cc3)c2n1
CCCNc1nc(SC)nc2n(CC(Cl)c3ccc(Cl)cc3)ncc12
CCCCNc1nc(SC)nc2n(CC(Cl)c3ccc(Cl)cc3)ncc12
CCN(CC)c1nc(SC)nc2n(CC(Cl)c3ccc(Cl)cc3)ncc12
CSc1nc(N2CCOCC2)c2cnn(CC(Cl)c3ccc(Cl)cc3)c2n1
CCSc1nc(N(CC)CC)c2cnn(CC(Cl)c3ccccc3)c2n1
CCCNc1nc(SCCC)nc2n(CC(Cl)c3ccccc3)ncc12
CCCCNc1nc(SCCC)nc2n(CC(Cl)c3ccccc3)ncc12
CCCSc1nc(N(CC)CC)c2cnn(CC(Cl)c3ccccc3)c2n1
CCCSc1nc(NCc2ccccc2)c2cnn(CC(Cl)c3ccccc3)c2n1
CCCNc1nc(SC)nc2n(CC(Br)c3ccccc3)ncc12
CCCCNc1nc(SC)nc2n(CC(Br)c3ccccc3)ncc12
CCOCCNc1nc(SC)nc2n(CC(Br)c3ccccc3)ncc12
CSc1nc(N2CCCC2)c2cnn(CC(Br)c3ccccc3)c2n1
CSc1nc(N2CCCCC2)c2cnn(CC(Br)c3ccccc3)c2n1
CSc1nc(N2CCOCC2)c2cnn(CC(Br)c3ccccc3)c2n1
CSc1nc(NCc2ccccc2)c2cnn(CC(Br)c3ccccc3)c2n1
CSc1nc(NCCc2ccccc2)c2cnn(CC(Br)c3ccccc3)c2n1
CCCNc1nc(nc2n(CC(Cl)c3ccccc3)ncc12)N(C)C
CN(C)c1nc(N2CCOCC2)c2cnn(CC(Cl)c3ccccc3)c2n1
CN(C)c1nc(NCc2ccccc2)c2cnn(CC(Cl)c3ccccc3)c2n1
CC(C)(C)N1CN(C(=N)c2cn[nH]c12)c1ccc(Cl)cc1
CC1=C(C(=O)N(C=C1)c2ccc3c(c2)NCC3(C)C)c4ccc5c(c4)cnc(n5)N
Cc1ccn(CCC2CCCC2)c(=O)c1-c1ccc2nc(N)ncc2c1
Cc1ccc(cc1C(=O)Nc2ccc(nc2)N)C(=O)NCCC3CCCC3
Cc1ccn(-c2ccc(cc2)-c2ncco2)c(=O)c1-c1ccc2nc(N)ncc2c1
Cc1ccn(-c2ccc(cc2)-n2cccn2)c(=O)c1-c1ccc2nc(N)ncc2c1
Cc1ccn(-c2ccc(cc2)N2CCOCC2)c(=O)c1-c1ccc2nc(N)ncc2c1
CCOC(=O)c1ccc(cc1)-n1ccc(C)c(-c2ccc3nc(N)ncc3c2)c1=O
CC(=O)c1ccc(cc1)-n1ccc(C)c(-c2ccc3nc(N)ncc3c2)c1=O
Cc1cc(ccc1F)-n1ccc(C)c(-c2ccc3nc(N)ncc3c2)c1=O
Cc1ccc(cc1F)-n1ccc(C)c(-c2ccc3nc(N)ncc3c2)c1=O
Cc1ccn(-c2ccc(Cl)c(F)c2)c(=O)c1-c1ccc2nc(N)ncc2c1
COc1cccc(c1)-n1ccc(C)c(-c2ccc3nc(N)ncc3c2)c1=O
CC1=C(C(=O)N(C=C1)c2cccc(c2)C(F)(F)F)c3ccc4c(c3)cnc(n4)N
Cc1ccn(-c2ccc(Cl)cc2)c(=O)c1-c1ccc2nc(N)ncc2c1
COc1ccc(cc1)-n1ccc(C)c(-c2ccc3nc(N)ncc3c2)c1=O
Cc1ccn(-c2ccc(cc2)C(F)(F)F)c(=O)c1-c1ccc2nc(N)ncc2c1
Cc1ccn(-c2ccc(cc2)C(C)(C)C)c(=O)c1-c1ccc2nc(N)ncc2c1
Cc1ccn(-c2ccccc2)c(=O)c1-c1ccc2nc(N)ncc2c1
COc1cc2nccc(Oc3ccccc3C(=O)c3ccccc3)c2cc1OC
COc1cc2nccc(Oc3ccc(C)cc3C(=O)c3ccccc3)c2cc1OC
COc1cc2nccc(Oc3ccc(C)cc3C(C)=O)c2cc1OC
COc1cc2nccc(Oc3cc(C)c(C)cc3C(C)=O)c2cc1OC
Nc1ncnc2n(CC(=O)c3cccnc3)cnc12
Nc1ncnc2ncn(CC(=O)c3c[nH]c4ccccc34)c12
COc1ccc(cc1)C1=C(C(=O)NC1)c1cn(C)c2ccccc12 |t:9|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1cn(COCc2ccccc2)c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1cn(COc2ccccc2)c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1cn(COC(C)(C)C)c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1cn(COC(C)C)c2ccccc12 |t:13|
CCOCn1cc(C2=C(C(=O)NC2)c2cc(OC)c(OC)c(OC)c2)c2ccccc12 |t:7|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1cn(COCC[Si](C)(C)C)c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1)c1c[nH]c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1c[nH]c2ccccc12 |t:13|
CCn1c(cc2c1nc(c3c2n(cn3)C)Nc4nc(c(s4)C)C)C(=O)N(C5CC5)C6CC6
Cc1ccc(cc1C(=O)Nc1cncnc1)C(=O)Nc1cccc(c1)C(F)(F)F
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C(=O)Nc1cncnc1
Cc1ccc(cc1NC(=O)c1cncnc1)C(=O)Nc1cccc(c1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Oc2cc3c(cc2OC)ncnc3Nc4cccc(c4F)Cl)C
Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Oc1ccc2[C@H]3c4cc(O)c(O)cc4C[C@@]3(O)COc2c1O |r|
O[C@@H]1c2ccc(O)c(O)c2OC[C@]1(O)Cc1ccc(O)c(O)c1 |r|
Oc1ccc(C[C@@]2(O)COc3c(O)c(O)ccc3C2=O)cc1O |r|
Oc1ccc(CC2=Cc3ccc(O)c(O)c3OC2)cc1O |t:6|
CCCP(=O)(CCC)c1ccc(Nc2nc(nc3n(\C=C\c4c(C)cccc4C)cnc23)C(C)C)cc1
Cc1cccc(C)c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)nc(nc12)C1CCCC1
CC(C)c1nc(Nc2ccc(cc2)P(C)(C)=O)c2ncn(\C=C\c3c(C)cccc3C)c2n1
Cc1cccc(C)c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)nc(nc12)N1CCCC1
CN(C)c1nc(Nc2ccc(cc2)P(C)(C)=O)c2ncn(\C=C\c3c(C)cccc3C)c2n1
CCCP(=O)(CCC)c1ccc(Nc2ncnc3n(\C=C\c4c(C)cccc4C)cnc23)cc1
CP(C)(=O)c1ccc(Nc2ncnc3n(\C=C\c4cccc5[nH]ncc45)cnc23)cc1
CP(C)(=O)c1ccc(Nc2ncnc3n(\C=C\c4cccc5[nH]ccc45)cnc23)cc1
CP(C)(=O)c1ccc(Nc2ncnc3n(\C=C\c4ccccc4Cl)cnc23)cc1
Cc1cccc(Cl)c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)ncnc12
Cc1cccc(C)c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)ncnc12
CCCP(=O)(CCC)c1ccc(Nc2nc(nc3n(\C=C/c4ccccc4)cnc23)C(C)C)cc1
CCCP(=O)(CCC)c1ccc(Nc2nc(nc3n(\C=C\c4ccccc4)cnc23)C(C)C)cc1
CCCP(=O)(CCC)c1ccc(Nc2nc(nc3n(\C=C/c4c(C)cccc4C)cnc23)C(C)C)cc1
c1cc(cc(c1)Nc2c3ccc(c(c3on2)C(=O)Nc4cncnc4)Cl)C(F)(F)F
c1cnc(cc1C#N)Nc2cc(n(n2)C3CCCC3)C4CCN(CC4)C5COC5
Cc1cccc(Cl)c1Nc1nc2ccccc2n1-c1cc(Nc2ccc(CCN3CCOCC3)cn2)ncn1
Cc1nc(Nc2cc(ncn2)-n2c(Nc3c(C)cccc3Cl)nc3ccccc23)cc(n1)N1CCN(CCO)CC1
Brc1cccc(NC(=O)Nc2ccc(Oc3ncnc4sc5CCCCc5c34)cc2)c1
Brc1cccc(NC(=O)Nc2ccc(Oc3ncnc4sccc34)cc2)c1
Brc1cccc(NC(=O)Nc2ccc(Oc3ncnc4ccccc34)cc2)c1
COc1cc2ncnc(Oc3ccc(NC(=O)Nc4cccc(Br)c4)cc3)c2cc1OC
Brc1cccc(NC(=O)Nc2ccc(Nc3ncnc4sc5CCCCc5c34)cc2)c1
Brc1cccc(NC(=O)Nc2ccc(Nc3ncnc4sccc34)cc2)c1
Brc1cccc(NC(=O)Nc2ccc(Nc3ncnc4ccccc34)cc2)c1
CCN1CCN(CC\C=C\c2ccc3c(Nc4ccc(Sc5nccn5C)c(Cl)c4)c(cnc3c2)C#N)CC1
CN(C)CCCOc1cc2ncc(C#N)c(Nc3ccc4nc(N)[nH]c4c3)c2cc1C
CC1CC(C)CN(CCCOc2cc3ncc(C#N)c(Nc4ccc5nc(N)sc5c4)c3cc2C)C1
CCN(CC)CCCOc1cc2ncc(C#N)c(Nc3ccc4nc(N)sc4c3)c2cc1C
CC1CN(CCCOc2cc3ncc(C#N)c(Nc4ccc5nc(N)sc5c4)c3cc2C)CC(C)N1
CC1CCN(CCCOc2cc3ncc(C#N)c(Nc4ccc5nc(N)sc5c4)c3cc2C)CC1
Cc1cc2c(Nc3ccc4nc(N)sc4c3)c(cnc2cc1OCCCN1CCNCC1)C#N
Cc1cc2c(Nc3ccc4nc(N)sc4c3)c(cnc2cc1OCCCN1CCOCC1)C#N
CN1CCN(CCCOc2cc3ncc(C#N)c(Nc4ccc5nc(N)sc5c4)c3cc2C)CC1
Cc1ccc2nc(Nc3c(cnc4cc(OCCCN5CCCCC5)c(C)cc34)C#N)sc2c1
Cc1cc2c(Nc3ccc4nc(N)sc4c3)c(cnc2cc1OCCN1CCCCC1)C#N
COc1cc2c(Nc3ccc4nc(N)sc4c3)c(cnc2cc1OCCCN1CCNCC1)C#N
Cc1cc2c(Nc3ccc4nc(N)[nH]c4c3)c(cnc2cc1OCCCN1CCCC1)C#N
C[C@H](CO)NC(=O)c1sc(nc1C)-c1ccnc(Nc2cc(C)cc(C)c2)n1 |r|
Cc1cc(cc(c1)Nc2nccc(n2)c3nc(c(s3)C(=O)N[C@@H](C)CO)C)C
OCCCOc1cc(Nc2nccc(n2)-c2nccs2)cc(c1)C(F)(F)F
Oc1cc(Nc2nccc(n2)-c2nccs2)cc(c1)C(F)(F)F
Cc1cc(Nc2nccc(n2)-c2nc(CO)cs2)cc(c1)C(F)(F)F
COc1cc(Nc2nccc(n2)-c2ncc(C)s2)cc(c1)C(F)(F)F
OCc1csc(n1)-c1ccnc(Nc2cc(O)cc(c2)C(F)(F)F)n1
COc1cc(Nc2nccc(n2)-c2nc(CO)cs2)cc(c1)C(F)(F)F
Cc1nc(sc1CCO)-c1ccnc(Nc2cc(C)cc(c2)C(F)(F)F)n1
Cc1nc(sc1CCO)-c1ccnc(Nc2cc(C)cc(C)c2)n1
Cc1cc(C)cc(Nc2nccc(n2)-c2nc(CO)cs2)c1
Cc1cc(C)cc(Nc2nccc(n2)-c2ncc(CO)s2)c1
Cc1csc(n1)-c1ccnc(Nc2cc(C)cc(C)c2)n1
Cc1cnc(s1)-c1ccnc(Nc2cc(C)cc(C)c2)n1
Cc1ccc(C)c(Nc2nccc(n2)-c2nccs2)c1
Cc1cccc(Nc2nccc(n2)-c2nccs2)c1
COc1cc(Nc2nccc(n2)-c2nccs2)cc(OC)c1
Cc1cc(Nc2nccc(n2)-c2nccs2)cc(c1)C(F)(F)F
COc1cc(Nc2nccc(n2)-c2nccs2)cc(c1)C(F)(F)F
Cc1cc(C)cc(Nc2nccc(n2)-c2nccs2)c1
CS(=O)(=O)c1ccc(CNCc2cc(C(O)=O)c(Nc3ccc(I)cc3F)c(F)c2F)cc1
N[C@@H](CC(N)=O)C(=O)NCc1cc(C(O)=O)c(Nc2ccc(I)cc2F)c(F)c1F |r|
OCc1ccc(o1)C(=O)NN=Cc1cc(C(O)=O)c(Nc2ccc(I)cc2F)c(F)c1F |w:11.12|
OC(=O)c1cc(C=NNC(=O)CS(=O)(=O)c2ccc(Cl)cc2)c(F)c(F)c1Nc1ccc(I)cc1F |w:6.5|
Cc1c(ccc(c1NC(=O)c2cc3ccccc3s2)F)C4=NNC(=O)C(=C4)Nc5cc6n(n5)CCN(C6)C
NC(=N)SCCCn1c(=O)c2c(n3c(cc4ccccc34)c3cccc4ccn2c34)c1=O
Nc1ncc(NC(=O)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2Cl)cc1Cl
COc1ccc(CN(C)C)c(c1)-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F
N(c1ccc(cc1)-c1nc2ccccc2s1)c1ncnc2[nH]ccc12
N(c1cccc(c1)-c1nc2ccccc2s1)c1ncnc2nc[nH]c12
COc1cc2nc(Nc3cc(C)n[nH]3)nc(Nc3cccc(c3)-c3nc4ccccc4s3)c2cc1OC
Fc1cc(ccc1Nc1ncnc2ccsc12)-c1nc2ccccc2s1
Clc1cc(Nc2ncnc3ccsc23)ccc1-c1nc2ccccc2s1
COc1cc(Nc2ncnc3ccsc23)ccc1-c1nc2ccccc2s1
N(c1ccc(cc1)-c1nc2ccccc2s1)c1ncnc2ccsc12
COc1cc(Nc2ncnc3nc[nH]c23)ccc1-c1nc2ccccc2s1
N(c1ccc(cc1)-c1nc2ccccc2s1)c1ncnc2nc[nH]c12
COc1cc(Nc2ncnc3[nH]ccc23)ccc1-c1nc2ccccc2s1
COc1nc(Nc2ccc(cc2)-c2nc3ccccc3s2)c2cc[nH]c2n1
COc1cc2nc(Nc3cc(C)n[nH]3)nc(Nc3ccc(cc3)-c3nc4ccccc4s3)c2cc1OC
COc1nc(Nc2ccc(-c3nc4ccccc4s3)c(OC)c2)c2cc[nH]c2n1
N(c1cccc(c1)-c1nc2ccccc2s1)c1ncnc2[nH]ccc12
CNc1nc(Nc2ccc(cc2)-c2nc3ccccc3s2)c2cc(OC)c(OC)cc2n1
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(OC)c3)c2cc1OC
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(O)c3)c2cc1OC
COc1cc2ncnc(Nc3ccc(cc3C)-c3nc4ccccc4s3)c2cc1OC
COc1cc2ncnc(Nc3ccc(cc3)-c3nc4ccccc4s3)c2cc1OC
COc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1-c1nc2ccccc2s1
Fc1cc(ccc1Nc1ncnc2cc(Cl)ccc12)-c1nc2ccccc2s1
Clc1ccc2c(Nc3ccc(cc3)-c3nc4ccccc4s3)ccnc2c1
Clc1ccc2c(Nc3ccc(-c4nc5ccccc5s4)c(Cl)c3)ncnc2c1
Cc1cc2c(Nc3ccc(cc3)-c3nc4ccccc4s3)ncnc2cc1Cl
Cc1cc(Nc2ccnc(Nc3cccc(c3)-c3nc4ccccc4s3)n2)[nH]n1
Oc1ccc(NC(=S)NC(=O)c2ccc(cc2)[N+]([O-])=O)cc1-c1nc2ccccc2s1
Oc1cc(CNC=C2C(=O)NC(=O)c3ccc(I)cc23)ccc1-c1ccoc1 |w:6.5|
COCCOc1cc2ncnc(Nc3c4OCOc4ccc3Cl)c2cc1NC(=O)[C@@H]1CCCN1 |r|
COCCOc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)[C@@H]1CCCN1 |r|
C[C@@H](Nc1c(Nc2ccncc2)c(=O)c1=O)c1ccccc1 |r|
NC(=O)C(Nc1c(Nc2ccncc2)c(=O)c1=O)c1ccccc1
NC(=O)C(Nc1c(Nc2ccncc2)c(=O)c1=O)c1cccc(O)c1
C[C@@H](Nc1c(Nc2ccnc(c2)-c2ccccc2F)c(=O)c1=O)c1ccccc1 |r|
C[C@@H](Nc1c(Nc2ccnc(c2)-c2ccco2)c(=O)c1=O)c1ccccc1 |r|
C[C@@H](Nc1c(Nc2ccnc(c2)-c2ccsc2)c(=O)c1=O)c1ccccc1 |r|
O[C@H]1CC[C@@H](CC1)Nc1ccc2nnc(-c3cccc(c3)C(F)(F)F)n2n1 |r,wU:1.0,wD:4.7,(9.27,-14.54,;10.6,-15.32,;11.94,-14.55,;13.26,-15.32,;13.27,-16.87,;11.93,-17.64,;10.6,-16.86,;14.6,-17.63,;15.94,-16.86,;15.94,-15.32,;17.27,-14.54,;18.59,-15.32,;20.06,-14.85,;20.97,-16.09,;20.06,-17.34,;20.82,-18.68,;20.03,-20,;20.78,-21.34,;22.32,-21.36,;23.11,-20.02,;22.35,-18.69,;24.65,-20.03,;26.17,-20.13,;24.7,-18.5,;24.61,-21.57,;18.59,-16.86,;17.27,-17.62,)|
FC(F)(F)c1cccc(c1)-c1nnc2ccc(NC3CCNCC3)nn12
Cn1cc(cn1)-c1cnc(Nc2cccc(Cn3nc(ccc3=O)-c3cnn(C)c3)c2)nc1
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
CCOc1ccc2cc(cnc2c1)-c1nn(C(C)C)c(N)c1C(N)=O
CO[C@H]1[C@H](C[C@@H]2O[C@@]1(C)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)CCC(O)=O
CCOc1ccc2cc(cnc2c1)-c1nn(CC2CC2)c(N)c1C(N)=O
CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4C(=O)NC(=O)c4c4c5ccccc5n2c4c13
CCOc1ccc2cc(cnc2c1)-c1nn(C2CCC2)c(N)c1C(N)=O
CCOc1ccc2cc(cnc2c1)-c1nn(C2CCCC2)c(N)c1C(N)=O
CCOc1ccc2cc(cnc2c1)-c1nn(C2CCCCC2)c(N)c1C(N)=O
CCOc1ccc2cc(cnc2c1)-c1nn(C2CCCCCC2)c(N)c1C(N)=O
CCOc1ccc2cc(cnc2c1)-c1nn(CC(C)(C)CO)c(N)c1C(N)=O
CCOc1ccc2cc(ccc2n1)-c1nn(c(N)c1C(N)=O)C(C)(C)C
CCOc1ccc2cc(ccc2n1)-c1nn(C(C)C)c(N)c1C(N)=O
CCOc1ccc2cc(ccc2n1)-c1nn(CC2CC2)c(N)c1C(N)=O
CCOc1ccc2cc(ccc2n1)-c1nn(C2CCCCC2)c(N)c1C(N)=O
CCOc1ccc2cc(ccc2n1)-c1nn(CC(C)(C)CO)c(N)c1C(N)=O
CC(C)(C)n1nc(c(C(N)=O)c1N)-c1cnc2cc(F)ccc2c1
COc1ccc2cc(cnc2c1)-c1nn(c(N)c1C(N)=O)C(C)(C)C
CCN(C)[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
CCCOc1ccc2cc(cnc2c1)-c1nn(c(N)c1C(N)=O)C(C)(C)C
CC(C)(C)n1nc(c(C(N)=O)c1N)-c1cnc2cc(OCC3CC3)ccc2c1
CC(C)(C)n1nc(c(C(N)=O)c1N)-c1cnc2cc(OC3CC3)ccc2c1
CC(C)(C)n1nc(c(C(N)=O)c1N)-c1ccc2nc(OC3CC3)ccc2c1
CC(C)(C)n1nc(c(C(N)=O)c1N)-c1cnc2cc(OC3CCC3)ccc2c1
CC(C)(C)n1nc(c(C(N)=O)c1N)-c1ccc2nc(OC3CCC3)ccc2c1
CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4[C@@H](O)NC(=O)c4c4c5ccccc5n2c4c13
CO[C@H]1[C@H](C[C@@H]2O[C@@]1(C)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)CNC(=O)OC(C)(C)C
CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4C(=O)N[C@@H](O)c4c4c5ccccc5n2c4c13
O=c1[nH]cnc2[nH]c3ccccc3c12
O=c1[nH]cnc2Nc3ccccc3Cc12
CCN1c2ccccc2Cc2c1nc[nH]c2=O
COc1cc2Cc3c(Nc2cc1OC)ncn(C)c3=O
COc1ccc2Cc3c(Nc2c1)nc[nH]c3=O
COc1cc2Cc3c(Nc2cc1OC)ncn(CCN1CCOCC1)c3=O
O=c1cc(Nc2ccccc2)nc[nH]1
COc1ccc2Nc3nc[nH]c(=O)c3Cc2c1
CCc1nc2Nc3ccccc3Cc2c(=O)[nH]1
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)c1ccccc1O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](CC(O)=O)Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(CCC(O)=O)NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)c1ccc2ccccc2c1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NC(CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1c(C)cc(OP(O)(O)=O)cc1C)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(=C\c1ccc(OP(O)(O)=O)cc1)\C(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(CCC(O)=O)NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)c1cccc2ccccc12
C[C@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NC(CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
Cc1cc(OP(O)(O)=O)cc(C)c1CCC(=O)NC(CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)\C=C\c1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(CCC(O)=O)NC(=O)CCc1ccc(OP(O)(O)=O)cc1
NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(CCC(O)=O)NC(=O)\C=C\c1ccc(OP(O)(O)=O)cc1
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(CCC(O)=O)NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)c1ccccc1
Cc1ccc(NC(=O)c2ccc3ccccc3c2)cc1Nc1nccc(n1)-c1cccnc1
Cc1ccc(NC(=O)c2ccccc2)cc1Nc1nccc(n1)-c1cccs1
Cc1ccc(cc1)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1
Cc1ccc(N)cc1Nc1nccc(n1)-c1cccnc1
O=C(Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1)c1ccccc1
CC(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1
COc1ccccc1C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1
Cc1ccc(NC(=O)c2ccc(Cl)cc2)cc1Nc1nccc(n1)-c1cccnc1
Cc1ccc(NC(=O)c2ccccc2)cc1Nc1nccc(n1)-c1cccnc1
Cc1ccc(cc1Nc1nccc(n1)-c1cccnc1)[N+]([O-])=O
CN(CCCC1CCCCC1)C(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
CC[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(C)=O)C(=O)N(C)CCCC1CCCCC1
CN(CCCC1CCCCC1)C(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(cc1)P(O)(O)=O)NC(C)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(cc1)P(O)(O)=O)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N(C)CCCC1CCCCC1
CNc1nc(Nc2ccc(C)c(N)c2)ncc1C(=O)Nc1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C
Fc1ccc(cc1)C(=O)Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1
NCCCNC(=O)c1cccc(Nc2nccc(n2)-c2cccnc2)c1
CN1CCN(Cc2ccc(cc2)C(=O)Nc2cccc(Nc3nccc(n3)-c3cccnc3)c2)CC1
FC(F)C(F)(F)Oc1cccc(Nc2nccc(n2)-c2ccc(Cl)cc2)c1
O=C(Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1)c1ccncc1
N(c1cccc(c1)-n1ccnc1)c1nccc(n1)-c1cccnc1
FC(F)C(F)(F)Oc1cccc(Nc2nccc(n2)-c2c[nH]c3ccccc23)c1
OC(=O)c1cccc(Nc2nccc(n2)-c2cccnc2)c1
N(c1ccccc1)c1nccc(n1)-c1cccnc1
O=C(Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1)c1ccc(cc1)C#N
COc1ccccc1C(=O)Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1
[O-][N+](=O)c1cccc(Nc2nccc(n2)-c2cccnc2)c1
FC(F)C(F)(F)Oc1cccc(Nc2nccc(n2)-c2ccncc2)c1
[O-][N+](=O)c1cccc(Nc2nccc(n2)-c2ccncc2)c1
Clc1cccc(Nc2nccc(n2)-c2cccnc2)c1
C(Cn1ccnc1)Oc1cccc(Nc2nccc(n2)-c2cccnc2)c1
O=C(Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1)c1ccccn1
NCCCn1ccc2c(cccc12)-c1ccnc(Nc2cccc(OC(F)(F)C(F)F)c2)n1
Nc1cccc(Nc2nccc(n2)-c2ccncc2)c1
CCCCCC(=O)Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1
Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1
Cc1ccc(cc1)C(=O)Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1
O=C(Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1)C1CCCCC1
O=C(Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1)c1cccnc1
OC(=O)c1ccccc1C(=O)Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1
[O-][N+](=O)c1cccc(Nc2nccc(n2)-c2ccccn2)c1
COC(=O)c1cccc(Nc2nccc(n2)-c2cccnc2)c1
O=C(Nc1cccc(Nc2nccc(n2)-c2cccnc2)c1)c1cccs1
COC(=O)C1=C(c2ccc(C)cc2C1=O)c1ccccc1 |t:4|
COc1ccc(cc1)C1=C(C(N)=O)C(=O)c2ccccc12 |c:9|
COC(=O)C1=C(c2ccncc2C1=O)c1ccccc1 |t:4|
COC(=O)C1=C(c2ccc(cc2C1=O)[N+]([O-])=O)c1ccccc1 |t:4|
COC(=O)C1=C(c2c(cccc2OC)C1=O)c1ccccc1 |t:4|
NC(=O)C1=C(c2ccccc2C1=O)c1ccc(Cl)cc1 |t:3|
COC(=O)C1=C(c2ccccc2C1=O)c1ccccc1 |t:4|
NC(=O)C1=C(c2ccccc2C1=O)c1ccccc1 |t:3|
COc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cc1OC
CC(=O)N1CCN(CC1)[C@H]1C[C@H](C1)n1cc(-c2cc(OC[C@@H]3CCCO3)ccc2F)c2c(N)ncnc12 |r,wU:21.22,wD:11.14,9.9,(4.28,-11.46,;5,-10.46,;6.22,-10.59,;4.36,-9.06,;2.83,-8.9,;2.2,-7.5,;3.1,-6.26,;4.64,-6.41,;5.27,-7.81,;2.74,-4.76,;3.54,-3.45,;2.24,-2.7,;1.42,-3.96,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;5.86,4.56,;6.43,5.99,;7.96,6.21,;9.01,5.1,;10.39,5.78,;10.17,7.31,;8.66,7.57,;3.38,5.55,;1.86,5.34,;1.29,3.91,;.07,3.74,;.3,.77,;-1.03,1.55,;-1.03,2.79,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,)|
[H][C@]1(CN2CCC2)C[C@]([H])(C1)n1cc(-c2cccc(OCc3ccccc3)c2)c2c(N)ncnc12 |wD:8.9,1.0,(6.47,-15.11,;5.71,-13.78,;4.93,-15.11,;5.69,-16.44,;5.68,-17.98,;7.22,-17.99,;7.23,-16.45,;5.31,-12.3,;6.81,-11.9,;6.02,-10.55,;7.2,-13.39,;7.59,-10.56,;6.61,-9.37,;7.45,-8.07,;7.04,-6.58,;5.56,-6.19,;5.15,-4.71,;6.24,-3.6,;7.73,-3.99,;8.81,-2.89,;10.15,-3.66,;11.48,-2.89,;12.81,-3.66,;14.12,-2.9,;14.13,-1.36,;12.8,-.59,;11.48,-1.36,;8.13,-5.47,;8.94,-8.47,;10.35,-7.7,;10.34,-6.15,;11.69,-8.46,;11.69,-10.01,;10.35,-10.79,;9.02,-10.01,)|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N(CCCC(O)=O)CCCc1ccccc1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(=O)N(CCCC(O)=O)CCCc1ccccc1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(N)=O
CCCC(NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N(CCCC(O)=O)CCCc1ccccc1
CCc1ccccc1CCNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)NCCCc1ccccc1
CCC[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)NCCCc1ccccc1
CN(CCCc1ccccc1)C(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O
C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N(CCCC(O)=O)CCCc1ccccc1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(N)=O)Cc1cccc2ccccc12
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCCCc1ccccc1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCc1ccccc1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCCCc1ccccc1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCCC1=CC=CC2CCCCC12 |c:34,t:32|
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCCCC(=O)NCCCc1ccccc1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCCc1ccccc1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCCc1cccc2ccccc12
CC(NC(=O)c1ccc2[nH]nc(-c3ccncc3)c2c1)c1cccc(Cl)c1
CC(NC(=O)c1ccc2[nH]nc(-c3ccnc(C)c3)c2c1)c1c(Cl)cncc1Cl
C[C@@H](N1c2cc(ccc2C(=O)NC1(C)C)-n1c2cccnc2[nH]c1=O)c1ccccc1 |r|
COC(=O)c1cc2cc(NCc3cc(NC(=O)c4cc(cc(c4)C(F)(F)F)-n4cnc(C)c4)ccc3C)cnc2[nH]1
CN1C(=O)COc2c1cnc1ccc(Sc3nnc4c(F)cc(cn34)-c3cnn(C)c3)cc21
CC(C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,wU:18.18,3.3,46.46,63.65,wD:7.14,27.26,39.39,59.62,(35.46,.19,;34.15,-.62,;32.79,.12,;34.19,-2.16,;32.87,-2.96,;31.52,-2.23,;31.48,-.69,;30.21,-3.03,;30.25,-4.57,;31.6,-5.31,;31.64,-6.85,;33,-7.58,;33.04,-9.12,;31.73,-9.93,;34.39,-9.85,;28.85,-2.3,;27.54,-3.1,;27.58,-4.64,;26.19,-2.37,;24.87,-3.17,;26.15,-.84,;27.46,-.03,;28.81,-.76,;27.42,1.51,;35.54,-2.89,;35.58,-4.43,;36.86,-2.08,;38.21,-2.82,;38.25,-4.36,;39.6,-5.1,;40.9,-4.3,;42.26,-5.02,;42.3,-6.56,;43.66,-7.3,;40.99,-7.36,;39.64,-6.64,;39.52,-2.02,;39.48,-.47,;40.88,-2.75,;42.19,-1.94,;43.54,-2.68,;44.85,-1.88,;43.58,-4.21,;42.14,-.41,;40.79,.33,;43.46,.4,;43.42,1.94,;42.06,2.68,;42.02,4.22,;40.76,5.08,;41.19,6.56,;42.73,6.61,;43.25,5.16,;44.73,2.75,;44.69,4.29,;46.08,2.01,;46.29,.48,;47.8,.21,;48.53,1.56,;47.47,2.67,;47.75,4.19,;46.59,5.19,;49.23,4.63,;49.59,6.13,;48.47,7.18,;48.83,8.69,;50.3,9.14,;50.67,10.63,;49.55,11.68,;48.07,11.26,;47.71,9.75,;51.07,6.57,;51.42,8.07,;52.19,5.51,)|
c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O |r|
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O |r|
c1nc2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)n5cnc6c5N=C(NC6=O)N)O)O)O)O)N=C(NC2=O)N
CCOC(Cn1nc(-c2cnc3[nH]ccc3c2)c2c(N)ncnc12)OCC
COc1cc(ccc1NC(=O)OC(C)(C)C)-c1nn(CCN2CCN(C)CC2)c2ncnc(N)c12
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)Oc1c(O)c2c(cc(O)cc2=O)oc1-c1ccc(O)c(O)c1 |r|
C[C@H](NC(=O)OC(C)(C)C)C(=O)Oc1c(O)c2c(cc(O)cc2=O)oc1-c1ccc(O)c(O)c1 |r|
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)Oc1c(O)c2c(cc(O)cc2=O)oc1-c1ccc(O)c(O)c1 |r|
CC(=O)N[C@@H](Cc1ccccc1)C(=O)Oc1c(O)c2c(cc(O)cc2=O)oc1-c1ccc(O)c(O)c1 |r|
CC(C)(C)OC(=O)NCC(=O)Oc1c(O)c2c(cc(O)cc2=O)oc1-c1ccc(O)c(O)c1
C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)Oc1c(O)c2c(cc(O)cc2=O)oc1-c1ccc(O)c(O)c1 |r|
C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)Oc1c(O)c2c(cc(O)cc2=O)oc1-c1ccc(O)c(O)c1 |r|
CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)Oc1c(O)c2c(cc(O)cc2=O)oc1-c1ccc(O)c(O)c1 |r|
c1cc(c(cc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O)O
Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nc3ccccc23)[nH]n1
CC(=O)Nc1ccc(Sc2nc(Nc3ccn[nH]3)c3ccccc3n2)cc1
CC(=O)Nc1ccc(Sc2nc(Nc3cc(n[nH]3)C3CC3)c3ccccc3n2)cc1
Cc1cc(Nc2nc(nc3ccccc23)-c2ccccc2)[nH]n1
Cc1cc(Nc2nc(Nc3ccccc3)nc3ccccc23)[nH]n1
CN(c1ccccc1)c1nc(Nc2cc(C)n[nH]2)c2ccccc2n1
Cc1cc(Nc2nc(Oc3ccccc3)nc3ccccc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccccc3)nc3ccccc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccc(Cl)cc3)nc3ccccc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccc(Cl)c(Cl)c3)nc3ccccc23)[nH]n1
COc1ccccc1Sc1nc(Nc2cc(C)n[nH]2)c2ccccc2n1
COc1ccc(Sc2nc(Nc3cc(C)n[nH]3)c3ccccc3n2)cc1OC
Cc1cc(Nc2nc(Sc3ccc4ccccc4c3)nc3ccccc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccc(NS(C)(=O)=O)cc3)nc3ccccc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)OC(C)(C)C)cc3)nc3ccccc23)[nH]n1
CC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)c3ccccc3n2)cc1
CN(C(C)=O)c1ccc(Sc2nc(Nc3cc(C)n[nH]3)c3ccccc3n2)cc1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)c3ccccc3n2)cc1
Cc1cc(Nc2nc(nc3ccccc23)-c2ccncc2)[nH]n1
Cc1ccc(cc1\C=C\n1cnc2cncnc12)C(=O)Nc1cc(ccn1)C(F)(F)F
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1\C=C\n1cnc2c(NC3CC3)ncnc12
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1\C=C\n1cnc2c(Nc3ccccn3)ncnc12
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1\C=C\n1cnc2c(Nc3cccnc3)ncnc12
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1\C=C\n1cnc2c(Nc3ccncc3)ncnc12
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1\C=C\n1cnc2c(Nc3ccncn3)ncnc12
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)ncnc12
CN(C)CCCNc1ncnc2n(\C=C\c3cc(NC(=O)c4cccc(c4)C(F)(F)F)ccc3C)cnc12
Cc1ccc(cc1\C=C\n1cnc2c(NC3CC3)ncnc12)C(=O)Nc1cccc(c1)C(F)(F)F
Cc1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1\C=C\n1cnc2c(NC3CC3)ncnc12
Cc1ccc(cc1\C=C\n1cnc2c(NC3CC3)ncnc12)C(=O)Nc1cc(ccc1F)C(F)(F)F
Cc1ccc(cc1\C=C\n1cnc2c(NC3CC3)ncnc12)C(=O)Nc1ccc(Cl)c(c1)C(F)(F)F
Cc1ccc(cc1\C=C\n1cnc2c(NC3CC3)ncnc12)C(=O)Nc1cccc(c1)C(C)(C)C
CC(C)c1cccc(NC(=O)c2ccc(C)c(\C=C\n3cnc4c(NC5CC5)ncnc34)c2)c1
Cc1ccc(cc1\C=C\n1cnc2c(NC3CC3)ncnc12)C(=O)Nc1ncc(s1)C(C)(C)C
Cc1ccc(cc1\C=C\n1cnc2c(NC3CC3)ncnc12)C(=O)Nc1cc(on1)C(C)(C)C
Cc1ccc(cc1\C=C\n1cnc2c(NC3CC3)ncnc12)C(=O)Nc1cc(nn1C)C(C)(C)C
Cc1ccc(cc1\C=C\n1cnc2c(NC3CC3)ncnc12)C(=O)Nc1cc(ccn1)C(F)(F)F
Cc1ccc(cc1\C=C\n1cnc2c(NC3CC3)ncnc12)C(=O)Nc1cc(cc(c1)C(F)(F)F)-n1ccnc1
Cc1ccc(cc1\C=C\n1cnc2c(NC3CC3)ncnc12)C(=O)Nc1cc(cc(c1)C(F)(F)F)N1CCOCC1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(\C=C\n3cnc4c(NC5CC5)ncnc34)c2)cc(c1)C(F)(F)F
CNc1ncnc2n(CCc3cc(NC(=O)c4cccc(c4)C(F)(F)F)ccc3C)cnc12
CNc1ncnc2n(\C=C\c3cc(NC(=O)c4cccc(c4)C(F)(F)F)ccc3C)cnc12
CCOC(=O)c1cnn2c(ccnc12)-c1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1
CC1(C)c2[nH]c3cc(ccc3c2C(=O)c2ccc(cc12)C1CCN(CC2CCOCC2)CC1)C#N
C[C@@H](Oc1ccc2[nH]nc(-c3nc4cc(ccc4[nH]3)N3CCN(C)CC3)c2c1)c1c(Cl)cncc1Cl |r|
Cc1ccc2C(N=O)C(=O)N(Cc3cc(F)cc4COCOc34)c2c1
COc1ccc(CNc2nc(SC)nc3n(CC(Cl)c4ccccc4)ncc23)cc1
CSc1nc(NCCc2ccc(Cl)cc2)c2cnn(CC(Cl)c3ccccc3)c2n1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
COc1cc2c(cc1NC(=O)/C=C/CN3CCCCC3)c(ncn2)Nc4ccc(c(c4)Cl)F
[H][C@@]1(CCc2c(C1)[nH]c1c(cc(F)c(-c3cccc(c3C)-n3c(=O)n(C)c4c(F)cccc4c3=O)c21)C(O)=N)C(C)(C)O |r,wU:1.0,(7.64,3.3,;7.24,1.81,;5.84,2.47,;4.58,1.59,;4.71,.05,;6.1,-.6,;7.37,.28,;4.84,-1.48,;3.3,-1.34,;2.9,-2.83,;1.41,-3.22,;.33,-2.13,;-1.16,-2.53,;.73,-.64,;-.36,.45,;.05,1.93,;-1.04,3.03,;-2.53,2.63,;-2.93,1.15,;-1.85,.05,;-2.25,-1.43,;-4.42,.75,;-4.82,-.73,;-3.74,-1.83,;-6.31,-1.13,;-6.71,-2.62,;-7.4,-.04,;-8.89,-.43,;-9.29,-1.92,;-9.97,.66,;-9.57,2.15,;-8.08,2.54,;-6.99,1.45,;-5.51,1.84,;-5.1,3.33,;2.22,-.25,;3.99,-3.92,;5.48,-3.53,;3.58,-5.41,;8.77,1.67,;8.91,3.21,;8.63,.14,;10.3,1.53,)|
COc1ccc(C(=O)CC(C)C)c(O)c1
COc1cc(OC)c(C(=O)CN2CCN(C)CC2)c(OC)c1
COc1cc(OC)c(CN[C@@H](CC(O)=O)C(O)=O)c(OC)c1 |r|
CC(C)CC(=O)c1c(O)cc(O)cc1OCC(O)CNC(C)(C)C
COc1cc(O)c(C(=O)CC(C)C)c(OC)c1
COc1cc(OC)c(C(=O)CC(C)C)c(OCC(O)CNC(C)C)c1
COc1cc(OC)c(C(=O)CC(C)C)c(OC)c1
COc1ccc(C(=O)CC(C)C)c(OC[C@H](O)CNC(C)C)c1
COc1ccc(C(=O)CC(C)C)c(OC[C@@H](O)CNC(C)(C)C)c1
CN(CCCC(=O)c1c(O)cc(O)cc1O)C1CCCCC1
CC(=O)c1c(cc(cc1O)O)O
CCCCNC(=O)c1c(O)cc(O)cc1O
COc1cc(OC)c(C(=O)CN2CCCCC2)c(OC)c1
CCN1CCN(CC(=O)c2c(OC)cc(OC)cc2OC)CC1
COc1cc(OC)c(CN[C@@H](C)C(O)=O)c(OC)c1 |r|
COc1cc(OC)c(CN[C@@H](CCC(O)=O)C(O)=O)c(OC)c1 |r|
COc1ccc(C(=O)CC(C)C)c(OCC(O)CNC(C)(C)C)c1
COc1cc(OC)c(C(=O)CC(C)C)c(OC[C@@H](O)CNC(C)(C)C)c1
COc1ccc(C(=O)CC(C)C)c(OC[C@@H](O)CNC(C)C)c1
COc1ccc(C(=O)CC(C)C)c(OC[C@H](O)CNC(C)(C)C)c1
CC(C)CC(=O)c1c(O)cc(O)cc1OC[C@@H](O)CNC(C)(C)C
COc1c(ccc(c1)/C=C/C(=O)CC(=O)/C=C/c2cc(c(cc2)O)OC)O
CC(C)CC(=O)c1c(O)cc(O)cc1OC[C@H](O)CNC(C)(C)C
COc1cc(OC)c(CN[C@@H](CO)C(O)=O)c(OC)c1 |r|
COc1cc(O)cc(O)c1C(=O)CC(C)C
CC(C)CC(=O)c1c(O)cc(O)cc1OCC(O)CNC(C)C
CC(C)NC(=O)c1c(O)cc(O)cc1O
Oc1cc(O)c(C(=O)CCCN2CCCCC2)c(O)c1
CC(C)CC(=O)c1c(O)cc(O)cc1OCc1c(no[n+]1[O-])-c1ccccc1
CC(C)CC(=O)c1ccc(O)cc1
COc1cc(OC)c(C(=O)CC(C)C)c(OC[C@H](O)CNC(C)C)c1
CC(C)CC(=O)c1c(O)cc(O)cc1O
CCCCC(=O)c1c(O)cc(O)cc1O
COc1cc(OC)c(C(=O)CN2CCOCC2)c(OC)c1
COc1cc(OC)c(C(=O)CC(C)C)c(OCC(O)CNC(C)(C)C)c1
COc1cc(OC)c(C(=O)CC(C)C)c(OC[C@@H](O)CNC(C)C)c1
Cc1nc2cc(ccc2[nH]1)-n1ncc(C(=O)c2cc3ccc(cc3[nH]2)-c2ccccc2)c1N
Nc1c(cnn1-c1ccc2[nH]c(=O)[nH]c2c1)C(=O)c1cc2ccccc2[nH]1
Cc1cccc(c1)C(=O)c1cnn(c1N)-c1cc(O)ccc1Cl
CCc1nc2cc(ccc2[nH]1)-n1ncc(C(=O)c2cc3ccccc3[nH]2)c1N
Cc1nc2cc(ccc2[nH]1)-n1ncc(C(=O)c2cc3ccc(Br)cc3[nH]2)c1N
Cc1nc2cc(ccc2[nH]1)-n1ncc(C(=O)c2cc3ccc(CN4CCC(F)(F)CC4)cc3[nH]2)c1N
Nc1c(cnn1-c1ccc2[nH]ccc2c1)C(=O)c1cc2ccccc2[nH]1
Nc1c(cnn1-c1ccc2nc[nH]c2c1)C(=O)c1cc2ccccc2[nH]1
Nc1c(cnn1-c1cc(O)ccc1Cl)C(=O)c1cc2ccccc2[nH]1
Cc1nc2cc(ccc2[nH]1)-n1ncc(C(=O)c2cc3ccc(cc3[nH]2)S(C)(=O)=O)c1N
Cc1cc2cc(ccc2[nH]1)-n1ncc(C(=O)c2cc3ccccc3[nH]2)c1N
Nc1c(cnn1-c1cc(O)ccc1Cl)C(=O)c1cc2ccccc2o1
Cc1nc2cc(ccc2[nH]1)-n1ncc(C(=O)c2cc3ccc(CN4CCOCC4)cc3[nH]2)c1N
Nc1c(cnn1-c1ccccc1Cl)C(=O)c1cc2ccccc2[nH]1
Cc1nc2ccc(cc2[nH]1)-n1ncc(C(=O)c2cc3ccc(C)cc3[nH]2)c1N
Cc1nc2ccc(cc2[nH]1)-n1ncc(C(=O)c2cc3cc(CN4CCOCC4)ccc3[nH]2)c1N
Cc1nc2ccc(cc2[nH]1)-n1ncc(C(=O)c2cc3ccccc3[nH]2)c1N
Nc1c(cnn1-c1cc(O)ccc1Cl)C(=O)c1ccc2ncccc2c1
Nc1c(cnn1-c1cc(O)ccc1Cl)C(=O)c1cc2cc(CN3CCOCC3)ccc2[nH]1
CCc1cc2C(=O)c3c([nH]c4cc(ccc34)C#N)C(C)(C)c2cc1N1CCN(CC2(O)CCOCC2)CC1
NC(=O)c1c(N)n(CC(F)(F)F)nc1-c1ccc2ccccc2c1
CC(C)n1nc(c(C(N)=O)c1N)-c1ccc2nc(OC3CCC3)ccc2c1
CC(C)(C)n1nc(c(C(N)=O)c1N)-c1ccc2ccccc2c1
CCOc1ccc2cc(ccc2c1)-c1nn(c(N)c1C(N)=O)C(C)(C)C
CCOc1ccc2cc(cnc2c1)-c1nn(c(N)c1C(N)=O)C(C)(C)C
CC(C)(CO)Cn1nc(c(C(N)=O)c1N)-c1ccc2nc(OC3CCC3)ccc2c1
CCOc1ccc2cc(ccc2n1)-c1nn(C2CCOC2)c(N)c1C(N)=O
CCOc1ccc2cc(cnc2c1)-c1nn(CC(F)(F)F)c(N)c1C(N)=O
COc1ccc2cc(ccc2c1)-c1nn(c(N)c1C(N)=O)C(C)(C)C
CCOc1ccc2cc(cnc2c1)-c1nn(C2CCOC2)c(N)c1C(N)=O
CCS(=O)(=O)c1cc(Nc2ncc(F)c(n2)N(Cc2ccccc2C#N)c2cc(CO)ccc2C)ccc1N1CCN(C)CC1
CC[S@](=O)c1ccc(cc1)-c1coc2ccc(cc12)-c1ccc(C)o1 |r|
Cc1ccc(o1)-c1ccc2occ(-c3ccc(cc3)[S@](C)=O)c2c1 |r|
COCCOc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1NC(=O)[C@@H]1CCCN1C(=O)C=C |r|
COc1cc(Nc2c(cnc3cc(ccc23)-c2ncccc2CN2CCOCC2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2cc(CN3CCOCC3)ccn2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCOCC3)cn2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2cccc(CN3CCOCC3)n2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2cncc(CN3CCOCC3)c2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCOCC3)nc2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCN(C)CC3)cn2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCSCC3)cn2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCS(=O)CC3)cn2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCS(=O)(=O)CC3)cn2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN(C)C)cn2)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(ccc23)-c2ccc(CN3CCN(C)CC3)cn2)C#N)cc(OC)c1OC
CN1CCN(Cc2ccc(nc2)-c2ccc3c(Nc4ccc(Cl)cc4Cl)c(cnc3c2)C#N)CC1
COc1cc(Nc2c(cnc3ccc(cc23)-c2ccc(CN3CCN(C)CC3)cn2)C#N)c(Cl)cc1Cl
COc1ccc(cc1)-c1nnc2n(-c3ccccc3)c(=O)c3cnn(-c4ccccc4)c3n12
COc1ccc(cc1)C(=O)NNc1nc2n(ncc2c(=O)n1-c1ccccc1)-c1ccccc1
O=C(NNc1nc2n(ncc2c(=O)n1-c1ccccc1)-c1ccccc1)c1ccccc1
Cc1cc(Nc2cc(C)c(C#N)c(NCCOc3ccc(C)nc3)n2)n[nH]1
Cn1c2nc(Nc3ccc(I)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(2.42,-5.46,;2.42,-3.92,;1.09,-3.15,;-.24,-3.92,;-1.56,-3.15,;-2.9,-3.92,;-4.23,-3.15,;-5.57,-3.93,;-6.9,-3.15,;-6.9,-1.61,;-8.24,-.84,;-5.57,-.84,;-4.24,-1.6,;-1.58,-1.61,;-.25,-.84,;1.09,-1.61,;2.42,-.84,;3.75,-1.6,;5.07,-.83,;5.07,.71,;3.73,1.47,;6.39,1.49,;7.74,.72,;7.74,-.82,;6.41,-1.59,;6.42,-3.13,;3.76,-3.15,;5.09,-3.91,)|
Cn1c2nc(Nc3ccc(OC4OC(CO)C(O)C(O)C4O)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(23.87,-44.74,;23.87,-43.2,;22.54,-42.43,;21.22,-43.2,;19.89,-42.43,;18.55,-43.21,;17.22,-42.44,;15.88,-43.21,;14.55,-42.44,;14.55,-40.9,;13.22,-40.13,;13.22,-38.59,;14.55,-37.82,;14.56,-36.29,;15.89,-35.52,;15.9,-33.98,;13.23,-35.51,;13.23,-33.97,;11.89,-36.28,;10.56,-35.5,;11.88,-37.82,;10.55,-38.59,;15.88,-40.12,;17.21,-40.89,;19.87,-40.9,;21.2,-40.12,;22.55,-40.89,;23.87,-40.12,;25.2,-40.88,;26.52,-40.11,;26.52,-38.58,;25.18,-37.82,;27.84,-37.8,;29.19,-38.56,;29.19,-40.11,;27.86,-40.88,;27.87,-42.42,;25.21,-42.43,;26.54,-43.2,)|
Cn1c2nc(Nc3ccc(CCO)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(25.94,-17.71,;25.94,-16.17,;24.6,-15.4,;23.28,-16.18,;21.95,-15.41,;20.62,-16.18,;19.28,-15.41,;17.94,-16.18,;16.61,-15.41,;16.61,-13.87,;15.28,-13.1,;15.28,-11.56,;13.94,-10.79,;17.94,-13.1,;19.27,-13.86,;21.94,-13.87,;23.26,-13.1,;24.61,-13.86,;25.93,-13.09,;27.26,-13.86,;28.59,-13.08,;28.58,-11.55,;27.24,-10.79,;29.9,-10.77,;31.25,-11.54,;31.25,-13.08,;29.92,-13.85,;29.93,-15.39,;27.27,-15.4,;28.6,-16.17,)|
Cn1c2nc(Nc3ccc(N)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(3.54,-27.86,;3.54,-26.32,;2.21,-25.55,;.88,-26.33,;-.44,-25.56,;-1.78,-26.33,;-3.11,-25.56,;-4.45,-26.33,;-5.78,-25.56,;-5.78,-24.02,;-7.12,-23.25,;-4.45,-23.25,;-3.12,-24.01,;-.46,-24.02,;.87,-23.25,;2.21,-24.01,;3.54,-23.24,;4.87,-24.01,;6.19,-23.23,;6.19,-21.7,;4.85,-20.94,;7.51,-20.92,;8.86,-21.69,;8.86,-23.23,;7.53,-24,;7.54,-25.54,;4.88,-25.55,;6.21,-26.32,)|
CC(=O)Nc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(12.66,-24.01,;14,-24.78,;14,-26.32,;15.33,-24.01,;16.67,-24.78,;16.66,-26.32,;18,-27.1,;19.33,-26.32,;20.67,-27.09,;22,-26.32,;21.99,-24.78,;23.32,-24.01,;24.66,-24.78,;25.99,-24.01,;27.32,-24.77,;28.64,-24,;28.63,-22.46,;27.29,-21.7,;29.96,-21.68,;31.3,-22.45,;31.31,-23.99,;29.98,-24.76,;29.98,-26.3,;27.32,-26.32,;28.66,-27.08,;25.99,-27.09,;25.99,-28.63,;24.66,-26.32,;23.33,-27.09,;19.33,-24.77,;17.99,-24.01,)|
Cn1c2nc(Nc3ccc(NC(=O)CCl)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(4.94,-40.11,;4.94,-38.57,;3.61,-37.8,;2.28,-38.57,;.96,-37.8,;-.38,-38.57,;-1.71,-37.8,;-3.05,-38.58,;-4.38,-37.8,;-4.38,-36.26,;-5.72,-35.49,;-7.05,-36.26,;-7.05,-37.8,;-8.38,-35.49,;-9.72,-36.26,;-3.05,-35.49,;-1.72,-36.25,;.94,-36.26,;2.27,-35.49,;3.61,-36.26,;4.94,-35.49,;6.27,-36.25,;7.59,-35.48,;7.59,-33.94,;6.25,-33.18,;8.91,-33.16,;10.26,-33.93,;10.26,-35.47,;8.93,-36.24,;8.94,-37.78,;6.28,-37.8,;7.61,-38.56,)|
CN1CCN(CC1)C(=O)c1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(19.66,-4.1,;20.99,-3.33,;21,-1.79,;22.32,-1.02,;23.66,-1.79,;23.67,-3.33,;22.33,-4.1,;24.99,-1.02,;24.99,.52,;26.33,-1.79,;26.32,-3.33,;27.66,-4.1,;28.99,-3.33,;30.33,-4.1,;31.66,-3.33,;31.65,-1.79,;32.98,-1.02,;34.32,-1.78,;35.65,-1.02,;36.98,-1.78,;38.3,-1,;38.29,.53,;36.95,1.29,;39.62,1.31,;40.96,.54,;40.97,-1,;39.64,-1.77,;39.64,-3.31,;36.98,-3.32,;38.32,-4.09,;35.65,-4.09,;35.65,-5.63,;34.32,-3.33,;32.99,-4.1,;28.99,-1.78,;27.65,-1.02,)|
Cn1c2nc(Nc3ccc(NC(=O)CCNC(=O)OC(C)(C)C)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(11.49,-5.91,;11.49,-4.37,;10.16,-3.6,;8.83,-4.37,;7.5,-3.6,;6.17,-4.37,;4.84,-3.6,;3.5,-4.38,;2.17,-3.61,;2.17,-2.06,;.83,-1.29,;-.5,-2.06,;-.5,-3.6,;-1.83,-1.29,;-3.17,-2.06,;-4.5,-1.29,;-5.83,-2.06,;-5.83,-3.6,;-7.17,-1.29,;-8.5,-2.06,;-9.84,-1.29,;-8.5,-3.6,;-9.85,-2.82,;3.5,-1.29,;4.83,-2.05,;7.49,-2.06,;8.82,-1.29,;10.16,-2.06,;11.49,-1.29,;12.82,-2.05,;14.14,-1.28,;14.13,.26,;12.8,1.02,;15.46,1.03,;16.8,.27,;16.81,-1.27,;15.48,-2.05,;15.48,-3.59,;12.83,-3.6,;14.16,-4.36,)|
Cn1c2nc(Nc3ccc(NCC(O)CO)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(15.19,-18.34,;15.19,-16.8,;13.86,-16.03,;12.53,-16.81,;11.2,-16.04,;9.87,-16.81,;8.53,-16.04,;7.19,-16.81,;5.86,-16.04,;5.86,-14.5,;4.53,-13.73,;3.19,-14.5,;1.86,-13.73,;1.86,-12.19,;.53,-14.5,;-.81,-13.73,;7.19,-13.73,;8.53,-14.49,;11.19,-14.5,;12.51,-13.73,;13.86,-14.49,;15.18,-13.72,;16.52,-14.49,;17.84,-13.71,;17.83,-12.18,;16.49,-11.42,;19.15,-11.4,;20.5,-12.17,;20.5,-13.71,;19.17,-14.48,;19.18,-16.02,;16.52,-16.03,;17.86,-16.8,)|
Cn1c2nc(Nc3ccc(NC(=O)CCN)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(28.74,-40.46,;28.74,-38.92,;27.41,-38.15,;26.08,-38.92,;24.76,-38.15,;23.42,-38.92,;22.09,-38.15,;20.75,-38.93,;19.42,-38.15,;19.42,-36.61,;18.08,-35.84,;16.75,-36.61,;16.75,-38.15,;15.42,-35.84,;14.08,-36.61,;12.75,-35.84,;20.75,-35.84,;22.08,-36.6,;24.74,-36.61,;26.07,-35.84,;27.41,-36.61,;28.74,-35.84,;30.07,-36.6,;31.39,-35.83,;31.39,-34.29,;30.05,-33.53,;32.71,-33.51,;34.06,-34.28,;34.06,-35.82,;32.73,-36.59,;32.74,-38.13,;30.08,-38.15,;31.41,-38.91,)|
CCc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 |(-9.87,-15.85,;-8.54,-16.62,;-7.21,-15.85,;-7.2,-14.3,;-5.88,-13.53,;-4.54,-14.3,;-4.54,-15.85,;-3.2,-16.61,;-1.87,-15.84,;-1.88,-14.31,;-.55,-13.53,;.79,-14.3,;2.12,-13.53,;3.45,-14.29,;4.77,-13.52,;4.76,-11.99,;3.42,-11.22,;6.09,-11.21,;7.43,-11.97,;7.44,-13.51,;6.11,-14.29,;6.11,-15.83,;3.45,-15.84,;4.79,-16.61,;2.12,-16.61,;2.12,-18.15,;.79,-15.84,;-.54,-16.61,;-5.87,-16.62,)|
Cn1c2nc(Nc3cccc(COCC(O)CO)c3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(27.07,-18.27,;27.07,-16.73,;25.74,-15.96,;24.41,-16.73,;23.08,-15.96,;21.75,-16.73,;20.42,-15.96,;20.41,-14.41,;19.08,-13.65,;17.75,-14.42,;17.74,-15.96,;16.41,-16.73,;15.08,-15.96,;13.74,-16.73,;12.41,-15.96,;12.41,-14.42,;11.08,-16.73,;9.74,-15.96,;19.08,-16.74,;23.07,-14.42,;24.4,-13.65,;25.74,-14.42,;27.07,-13.65,;28.4,-14.41,;29.72,-13.64,;29.71,-12.1,;28.37,-11.34,;31.04,-11.32,;32.38,-12.09,;32.39,-13.63,;31.06,-14.4,;31.06,-15.94,;28.41,-15.96,;29.74,-16.72,)|
Cn1c2nc(Nc3cccc(N)c3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(1.69,-30.93,;1.69,-29.39,;.36,-28.62,;-.97,-29.39,;-2.3,-28.62,;-3.63,-29.39,;-4.96,-28.63,;-4.97,-27.08,;-6.3,-26.31,;-7.63,-27.08,;-7.63,-28.63,;-8.97,-29.4,;-6.3,-29.4,;-2.31,-27.09,;-.98,-26.31,;.36,-27.08,;1.69,-26.31,;3.02,-27.07,;4.34,-26.3,;4.33,-24.76,;3,-24,;5.66,-23.99,;7,-24.75,;7.01,-26.29,;5.68,-27.07,;5.68,-28.61,;3.03,-28.62,;4.36,-29.39,)|
CC(=O)Nc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 |(11.58,-29.56,;12.91,-28.79,;12.92,-27.25,;14.25,-29.56,;15.58,-28.79,;15.58,-27.25,;16.91,-26.47,;18.25,-27.24,;18.25,-28.79,;19.59,-29.56,;20.92,-28.78,;20.91,-27.25,;22.24,-26.47,;23.58,-27.24,;24.91,-26.47,;26.24,-27.23,;27.56,-26.46,;27.55,-24.93,;26.21,-24.17,;28.88,-24.15,;30.22,-24.91,;30.23,-26.46,;28.9,-27.23,;28.9,-28.77,;26.24,-28.78,;27.58,-29.55,;24.91,-29.55,;24.91,-31.09,;23.58,-28.78,;22.25,-29.55,;16.92,-29.56,)|
NCCn1cc(-c2cc(-c3cc4ccccc4s3)c3[nH]ncc3c2)c2nc(N)ncc12
CN(C)CCOc1ccc2Nc3c(C(N)=O)c(nn3CCc2c1)-c1ccc(Oc2ccccc2)cc1
NC(=O)c1c(N)c([nH]c1-c1ccc(Oc2ccccc2)cc1)C(=O)c1c(F)cccc1F
CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3ccccc3)ncc12 |r|
CC(Oc1ccc2ncc(\C=C\C(=O)N(C)C)cc2c1)c1c(Cl)ccc(F)c1Cl
C[C@H](c1c(ccc(c1Cl)F)Cl)Oc2ccc3c(c2)cc(cn3)/C=C/C(=O)NC
C[C@@H](Oc1ccc2ncc(\C=C\C(N)=O)cc2c1)c1c(Cl)ccc(F)c1Cl |r|
C[C@@H](Oc1ccc2ncccc2c1)c1c(Cl)ccc(F)c1Cl |r|
CC(Oc1ccc2ncc(\C=C\C(O)=O)cc2c1)c1c(Cl)ccc(F)c1Cl
CC(Oc1ccc2ncc(\C=C\CN)cc2c1)c1c(Cl)ccc(F)c1Cl
CC(Oc1ccc2ncc(CCC(N)=O)cc2c1)c1c(Cl)ccc(F)c1Cl
COc1cc(\C=C2/SC(=N)NC2=O)ccc1OCCCOc1cc(C)cc(C)c1
COc1cc(ccc1OCC(O)=O)-c1nc2sc3ccc(C)cc3c2c(=O)[nH]1
COc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCCCCCC(=O)NO
Cc1ccc(NC(=O)c2ccncc2C(C)(C)C)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1
Cc1ccc(NC(=O)c2ccncc2Cl)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(NCCN)ncn1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(NCCCN)ncn1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1Nc1nc2ccccc2n1-c1cc(NCCCCN)ncn1
Cc1cccc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)c1
CC(C)c1cccc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)c1
Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(c1)C(C)(C)C
Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(OC(F)F)c1
Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(Br)c1
Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(c1)C(F)(F)F
Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(Cl)c1
COc1cccc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)c1
Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1ccccc1
Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc2cnccc12
Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(N)ncn1)C(=O)Nc1cccc(c1)C(N)=O
Cc1cc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)ccn1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)cc(c1)C(F)(F)F
CN(C)CCCCNc1cc(ncn1)-n1c(Nc2cc(ccc2C)C(=O)Nc2cccc(C)c2)nc2ccccc12
CCN(CC)CCCCNc1cc(ncn1)-n1c(Nc2cc(ccc2C)C(=O)Nc2cccc(C)c2)nc2ccccc12
CN1CCN(CCNc2cc(ncn2)-n2c(Nc3cc(ccc3C)C(=O)Nc3cccc(C)c3)nc3ccccc23)CC1
CN1CCN(CCCNc2cc(ncn2)-n2c(Nc3cc(ccc3C)C(=O)Nc3cccc(C)c3)nc3ccccc23)CC1
Cc1ccc(cc1Nc1nc2ccccc2n1-c1cc(NCCC#N)ncn1)C(=O)Nc1cccc(c1)C(F)(F)F
CN1CCN(CCCNc2ncnc(n2)-n2c(Nc3cc(ccc3C)C(=O)Nc3cccc(c3)C(F)(F)F)nc3ccccc23)CC1
CN1CCN(CC1)S(=O)(=O)c1cccc(\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1
CN1CCN(CC1)S(=O)(=O)c1cccc(\C=C\c2c(C)ncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1
CN1C[C@@H]2C[C@H]1CN2c1ccc(cc1)-c1ccnc2c(c(nn12)-c1ccncc1)-c1cccc(O)c1 |r|
CN(C)Cc1ccc(cc1)-c1cnn2c(ccnc12)-c1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1
FC(F)(F)c1cccc(NC(=O)Nc2cccc(c2)-c2cn3ccnc3c(NCc3ccncc3)n2)c1
Oc1ccc(NC(=O)c2cc3ccccc3oc2=N)cc1
Oc1cccc(NC(=O)c2cc3ccc(O)c(O)c3oc2=N)c1
COc1cccc2cc(C(=O)Nc3cccc(O)c3)c(=N)oc12
Oc1ccc2cc(C(=O)Nc3ccccc3O)c(=N)oc2c1O
COc1ccc2oc(=N)c(cc2c1)C(=O)Nc1ccc(O)cc1
OCc1ccccc1NC(=O)c1cc2ccc(O)c(O)c2oc1=N
Oc1ccc(NC(=O)c2cc3c(O)cc(O)cc3oc2=N)cc1
CC(=O)c1cccc(NC(=O)c2cc3ccc(O)c(O)c3oc2=N)c1
Oc1ccc2cc(C(=O)Nc3ccccc3O)c(=N)oc2c1
Oc1ccc(NC(=O)c2cc3cccc(O)c3oc2=N)cc1
Oc1cc(O)c2cc(C(=O)Nc3ccccc3O)c(=N)oc2c1
Oc1ccc(NC(=O)c2cc3cc(O)ccc3oc2=N)cc1
Oc1ccc(NC(=O)c2cc3ccc(O)c(O)c3oc2=N)cc1
OCc1ccccc1NC(=O)c1cc2cccc(O)c2oc1=N
Oc1ccccc1NC(=O)c1cc2cccc(O)c2oc1=N
OCc1cccc(NC(=O)c2cc3ccc(O)c(O)c3oc2=N)c1
Oc1ccc2cc(C(=O)Nc3ccccc3)c(=N)oc2c1O
Oc1cccc(NC(=O)c2cc3cc(O)ccc3oc2=N)c1
Oc1cccc(NC(=O)c2cc3cccc(O)c3oc2=N)c1
COc1ccc2cc(C(=O)Nc3ccc(O)cc3)c(=N)oc2c1
Oc1ccc(NC(=O)c2cc3ccc(O)cc3oc2=N)cc1
Oc1cccc(NC(=O)c2cc3ccccc3oc2=N)c1
Oc1ccccc1NC(=O)c1cc2ccccc2oc1=N
Oc1cccc(NC(=O)c2cc3c(O)cc(O)cc3oc2=N)c1
Oc1cccc(NC(=O)c2cc3ccc(O)cc3oc2=N)c1
OCc1cccc(NC(=O)c2cc3cccc(O)c3oc2=N)c1
CN1CCN(Cc2cccc(\C=C\c3cncc(C#N)c3Nc3ccc4[nH]ccc4c3C)n2)CC1
Nc1ncnc2n(nc(-c3cnc4[nH]ccc4c3)c12)C1CCCC1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ccnc2cc(nn12)-c1ccncc1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)NCCO
CC[C@@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ncnc2sc(cc12)-c1ccncc1
O=C(Cc1ccccc1)Nc1cccc(c1)-c1nc2sccn2c1-c1ccnc(Nc2cccc(c2)N2CCOCC2)n1
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
CCN1CCN(CC\C=C\c2cc3ncc(C#N)c(Nc4cc(OC)c(Cl)cc4Cl)c3cc2OC)CC1
COc1cc(Nc2c(cnc3cc(\C=C\c4cc(CN(C)C)ccn4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4ccc(CN(C)C)cn4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4cccc(CN(C)C)n4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4ccc(CN(C)C)cc4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\c4cccc(CN(C)C)c4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\CN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\CCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\CCCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\CCCCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\CCCCCCCCCN4CCOCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\CCN4CCOCC4)ccc23)C#N)c(Cl)cc1Cl
Clc1ccc(Nc2c(cnc3cc(\C=C\CCN4CCOCC4)ccc23)C#N)c(Cl)c1
COc1cc(Nc2c(cnc3ccc(\C=C\CCN4CCOCC4)cc23)C#N)c(Cl)cc1Cl
Clc1ccc(Nc2c(cnc3ccc(\C=C\CCN4CCOCC4)cc23)C#N)c(Cl)c1
COc1cc(Nc2c(cnc3cc(\C=C\CCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\CCN(C)C)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2c(cnc3cc(\C=C\CCN4CCCCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
Cc1nc(N)sc1-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
CC(C)COC(=O)Nc1ccc(cc1)-c1c(C)nc2c(cnn2c1N)-c1cccc(c1)N1CCN(C)CC1
CC(C)COC(=O)Nc1ccc(c(C)c1)-c1cnc2c(cnn2c1N)-c1cccc(c1)N1CCN(C)CC1
COc1cc(ccc1NC(=O)OCC(C)C)-c1cnc2c(cnn2c1N)-c1cccc(c1)N1CCN(C)CC1
CN1CCN(CC1)c1ccc(cc1)-c1cnn2c(N)c(cnc12)-c1cccc(O)c1
CN1CCN(CC1)c1ccc(cc1)-c1c(C)nn2c(N)c(cnc12)-c1cccc(O)c1
CC(C)COC(=O)Nc1ccc(cc1)-c1cnc2c(cnn2c1N)-c1cccc(c1)N1CCNCC1
CC(C)COC(=O)Nc1ccc(cc1)-c1cnc2c(cnn2c1N)-c1cccc(c1)N1CCN(CC1)S(C)(=O)=O
CC(C)COC(=O)Nc1ccc(cc1)-c1cnc2c(cnn2c1N)-c1cccc(c1)N1CCN(CC1)C(=O)CN
COCCN1CCN(CC1)c1ccc(cc1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)OCC(C)C)cc1
CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)Oc2ccccc2)cc1
CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)Nc2ccccc2Cl)cc1
CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)NCC2CCCCC2)cc1
CN(C1CCCCC1)C(=O)Nc1ccc(cc1)-c1cnc2c(cnn2c1N)-c1cccc(c1)N1CCN(C)CC1
CN1CCN(CC1)c1ccc(cc1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)CCC2CCCC2)cc1
CN1CCN(CC1)c1ccc(cc1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)c2ccc(cc2)C(F)(F)F)cc1
CC(C)COC(=O)Nc1ccc(cc1)-c1cnc2c(cnn2c1N)-c1ccc(cc1)N1CCN(C)CC1
CN1CCN(CC1)c1ccc(cc1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)Oc2ccccc2)cc1
CN1CCN(CC1)c1ccc(cc1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)Nc2ccccc2Cl)cc1
CN1CCN(CC1)c1ccc(cc1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)NCC2CCCCC2)cc1
CN(C1CCCCC1)C(=O)Nc1ccc(cc1)-c1cnc2c(cnn2c1N)-c1ccc(cc1)N1CCN(C)CC1
CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(O)cc1
CN1CCN(CC1)c1ccc(cc1)-c1cnn2c(N)c(cnc12)-c1ccc(O)cc1
CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NS(=O)(=O)c2cccc(Cl)c2Cl)cc1
CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)CCC2CCCC2)cc1
CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)c2ccc(cc2)C(F)(F)F)cc1
CC(C)COC(=O)Nc1ccc(cc1)-c1cnc2c(cnn2c1N)-c1cccc(c1)N1CCN(C)CC1
CC(C)COC(=O)Nc1ccc(cc1)-c1cnc2c(cnn2c1N)-c1cccc(c1)N1CCOCC1
Fc1ccc(cc1)C(Cl)Cn1ncc2c(Nc3cccc(F)c3)ncnc12
C=CC(=O)Nc1ccc2ncnc(Nc3cccc4ccccc34)c2c1
C=CC(=O)Nc1ccc2c(c1)c(ncn2)Nc3cccc(c3)Br
C=CC(=O)Nc1ccc2c(c1)c(ncn2)Nc3ccccc3
CC(C)(C)c1ccc(Nc2ncnc3ccc(NC(=O)C=C)cc23)cc1
Brc1ccc(Nc2ncnc3ccc(NC(=O)C=C)cc23)cc1
C=CC(=O)Nc1ccc2ncnc(Nc3ccc(cc3)-c3ccccc3)c2c1
CC(C)c1ccc(Nc2ncnc3ccc(NC(=O)C=C)cc23)cc1
C=CC(=O)Nc1ccc2ncnc(Nc3ccc4ccccc4c3)c2c1
C=CC(=O)Nc1ccc2ncnc(NCc3cccc4ccccc34)c2c1
C=CC(=O)Nc1ccc2ncnc(NCCc3ccccc3)c2c1
CCC(=O)Nc1ccc2ncnc(Nc3ccc(cc3)C(C)(C)C)c2c1
Oc1ccc(CNc2ccc3OCOc3c2)cc1O
Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3OCOc3c2)cc1O
CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl
CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n1c3ccccc3c3c4[C@H](O)NC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|
OC(=O)c1ccc(cc1)C(=O)C(\SCc1ccc(Br)cc1)=C/c1ccc(F)c(c1)[N+]([O-])=O
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C
Cn1ccc2c1c(ncn2)Oc3ccc(c(c3)F)NC(=O)Nc4cccc(c4)C(F)(F)F
Cc1n[nH]c2Nc3ccc(cc3C(=Nc12)c1ccccc1Cl)[N+]([O-])=O |c:13|
Fc1ccccc1C1=Nc2cn[nH]c2Nc2ccc(cc12)C#N |t:8|
Nc1ccc2Nc3[nH]ncc3N=C(c3ccccc3Cl)c2c1 |t:12|
CC(=O)Nc1ccc2Nc3[nH]ncc3N=C(c3ccccc3Cl)c2c1 |t:15|
c1cc(ccc1c2cnc3c(cnn3c2)c4ccncc4)OCCN5CCCCC5
C(CN1CCOCC1)Oc1ccc(cc1)-c1cnc2c(cnn2c1)-c1ccncc1
O=c1ccc(c[nH]1)-c1cnn2cc(cnc12)-c1ccc(OCCN2CCOCC2)cc1
C(CN1CCOCC1)Oc1ccc(cc1)-c1cnc2c(cnn2c1)-c1cn[nH]c1
Nc1cc(ccn1)-c1cnn2cc(cnc12)-c1ccc(OCCN2CCOCC2)cc1
Oc1ccc(cc1O)-c1cnn2cc(cnc12)-c1ccc(OCCN2CCOCC2)cc1
NS(=O)(=O)c1ccc(Nc2ncc(o2)-c2ccc(O)c(O)c2)cc1
NS(=O)(=O)c1ccc(Nc2ncc(o2)-c2ccc(=O)[nH]c2)cc1
COc1ccc2cc([nH]c2c1)-c1n[nH]c2cccnc12
O=C(Cn1cc(nn1)-c1ccccc1)c1ccccc1
Cc1ccc(cc1)-c1cn(CC(=O)c2ccccc2)nn1
Cc1cc(ccc1F)-c1cn(CC(=O)c2ccccc2)nn1
O=C(Cn1cc(nn1)-c1ccccc1)C=Cc1ccccc1 |w:14.15|
Cc1ccc(cc1)C(=O)Cn1cc(nn1)-c1ccc(C)cc1
Cc1ccc(cc1)C(=O)Cn1cc(nn1)-c1ccc(F)c(C)c1
COc1ccc(cc1)C(=O)Cn1cc(nn1)-c1ccccc1
COc1ccc(cc1)C(=O)Cn1cc(nn1)-c1cccc(C)c1
Clc1ccc(cc1)C(=O)Cn1cc(nn1)-c1ccccc1
Cc1ccc(cc1)-c1cn(CC(=O)c2ccc(Cl)cc2)nn1
Clc1ccc(cc1)C(=O)Cn1cc(nn1)-c1cccc(c1)-c1ccsc1
ClCCCCc1ccc(cc1)-c1cn(CC(=O)c2ccc(Br)cc2)nn1
O=C(Cn1cc(nn1)-c1ccccc1)c1ccc(cc1)-c1cc2ccccc2oc1=O
Cc1ccc(cc1)-c1cn(CC(=O)c2ccc(cc2)-c2cc3ccccc3oc2=O)nn1
O=C(Cn1cc(nn1)-c1ccccc1)c1ccc(cc1)-c1cccs1
CC(=O)Cn1cc(nn1)-c1ccccc1
CC(=O)Cn1cc(nn1)-c1ccc(C)cc1
COC(=O)Cn1cc(nn1)-c1ccccc1
CCNC(=O)Cn1cc(nn1)-c1ccccc1
CN[C@@H]1CC2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
O=C1CCCC1n1cc(nn1)-c1ccccc1
Cc1ccc(cc1)-c1cn(nn1)C1CCCC1=O
O=C1CCCCC1n1cc(nn1)-c1ccccc1
Cc1ccc(cc1)-c1cn(nn1)C1CCCCC1=O
Cc1ccc(cc1)-c1cn(nn1)C1CCCCCC1=O
CCOC(=O)Cn1cc(Cn2nc(-c3ccccc3)c3c(N)ncnc23)nn1
Nc1ncnc2n(Cc3cn(CC(=O)CCCO)nn3)nc(-c3ccccc3)c12
Nc1ncnc2n(Cc3cn(CC(=O)Nc4ccc(Cl)cc4)nn3)nc(-c3ccccc3)c12
Nc1ncnc2n(Cc3cn(CC(=O)Nc4ccc(F)cc4)nn3)nc(-c3ccccc3)c12
Nc1ncnc2n(Cc3cn(CC(=O)Nc4ccccc4)nn3)nc(-c3ccccc3)c12
Nc1ncnc2n(Cc3cn(CC(=O)c4cccs4)nn3)nc(-c3ccccc3)c12
Cc1ccc(cc1)C(=O)Cn1cc(Cn2nc(-c3ccccc3)c3c(N)ncnc23)nn1
Nc1ncnc2n(Cc3cn(CC(=O)c4ccccc4)nn3)nc(-c3ccccc3)c12
Nc1ncnc2n(Cc3cn(CC(=O)c4ccc(Cl)cc4)nn3)nc(-c3ccccc3)c12
CC(=O)c1ccc(cc1)-c1cn(CCn2nc(-c3ccccc3)c3c(N)ncnc23)nn1
Nc1ncnc2n(CCn3cc(nn3)-c3ccc(F)cc3)nc(-c3ccccc3)c12
COc1ccc(cc1)-c1cn(CCn2nc(-c3ccccc3)c3c(N)ncnc23)nn1
CCCCCCCCCCc1cn(CCn2nc(-c3ccccc3)c3c(N)ncnc23)nn1
CCCCCCCc1cn(CCn2nc(-c3ccccc3)c3c(N)ncnc23)nn1
CCCCCCc1cn(CCn2nc(-c3ccccc3)c3c(N)ncnc23)nn1
CCCCc1cn(CCn2nc(-c3ccccc3)c3c(N)ncnc23)nn1
Nc1ncnc2n(CCN=[N+]=[N-])nc(-c3ccccc3)c12
CN(C)C(=O)N1CCC(CC1)c1nc(-c2cc3ccccc3[nH]2)c2c(N)nccn12
CC(=O)NC[C@H]1CC[C@@H](CC1)c1nc(-c2cc3ccccc3[nH]2)c2c(N)nccn12 |r,wU:8.11,wD:5.4,(30.4,-52.78,;31.44,-51.63,;32.94,-51.96,;30.97,-50.17,;32,-49.03,;31.53,-47.56,;32.56,-46.41,;32.09,-44.94,;30.58,-44.63,;29.54,-45.77,;30.01,-47.24,;30.1,-43.16,;31.01,-41.9,;30.1,-40.65,;30.58,-39.19,;29.67,-37.94,;30.58,-36.7,;30.27,-35.2,;31.41,-34.17,;32.87,-34.65,;33.19,-36.15,;32.04,-37.18,;32.04,-38.72,;28.62,-41.13,;27.29,-40.37,;27.29,-38.83,;25.96,-41.14,;25.96,-42.68,;27.29,-43.45,;28.63,-42.68,)|
c1cc(ccc1C(=O)NC2=CC(=CNC2=O)c3ccncc3)N4CCCCC4
CNc1cc(ccn1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCCCC2)c1
CNc1nccc(n1)C2=CNC(=O)C(=C2)NC(=O)c3ccc(cc3)N4CCCCC4
CNc1cc(ncn1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCCCC2)c1
CNc1cccc(c1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCCCC2)c1
CNc1cccc(n1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCCCC2)c1
O=C(Nc1cc(c[nH]c1=O)-c1cccc(NC2CC2)n1)c1ccc(cc1)N1CCCCC1
CNc1cncc(n1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCCCC2)c1
CNc1cncc(c1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCCCC2)c1
CNc1cncc(c1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCC[C@H]2CN2CCCC2)c1 |r|
CNc1cc(F)cc(c1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCC[C@H]2CN2CCCC2)c1 |r|
CNc1cc(cc(c1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCC[C@H]2CN2CCCC2)c1)C#N |r|
CC(C)(C)c1ccc(cc1)C(=O)Nc1cc(c[nH]c1=O)-c1ccncc1
CN(C)c1ccc(cc1)C(=O)Nc1cc(c[nH]c1=O)-c1ccncc1
CC(=O)N1CCN(CC1)c1cnc2cc(cc(NCc3cccc(c3)[N+]([O-])=O)c2c1)C(F)(F)F
OC1CCCC[C@H]1O |r|
Cc1cc(C)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccc2ccccc12
Nc1c(sc2ncccc12)C(=O)N\N=C\c1cccc2ccccc12
Cc1cc(C)c2c(N)c(sc2n1)C(=O)N\N=C\c1cncn1C
Cn1cncc1\C=N\NC(=O)c1sc2ncccc2c1N
CN(C)CCn1cccc1\C=N\NC(=O)c1sc2nc(C)cc(C)c2c1N
Cc1cc(C)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccn1C
Cc1cc(nc2sc(C(=O)N\N=C\c3cccc4ccccc34)c(N)c12)C(F)(F)F
Cc1cc(nc2sc(C(=O)N\N=C\c3cncn3C)c(N)c12)C(F)(F)F
CN(C)CCNc1cc(C)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccc2ccccc12
CN(C)CCNc1cc(C)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccn1C
CN(C)CCNc1cc(-c2ccccc2)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccc2ccccc12
CN(C)CCNc1cc(-c2ccccc2)c2c(N)c(sc2n1)C(=O)N\N=C\c1cncn1C
CN(C)CCNc1cc(-c2ccccc2)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccn1C
CN(C)CCNc1cc(Cc2ccccc2)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccn1C
CCCc1cc(NCCN(C)C)nc2sc(C(=O)N\N=C\c3cccn3C)c(N)c12
CN(C)CCNc1nc2sc(C(=O)N\N=C\c3cccn3C)c(N)c2cc1Cc1ccccc1
CCCc1cc2c(N)c(sc2nc1NCCN(C)C)C(=O)N\N=C\c1cccn1C
ClC(Cn1ncc2c(NCc3ccncc3)ncnc12)c1ccc(Cl)cc1
ClC(Cn1ncc2c(NCc3ccccn3)ncnc12)c1ccc(Cl)cc1
CS(=O)(=O)c1nc(NCc2ccccc2)c2cnn(CC(Cl)c3ccccc3)c2n1
CCCNc1nc(nc2n(\C=C/c3ccccc3)ncc12)S(C)(=O)=O
OCCNc1nc(NCCc2ccccc2)c2cnn(\C=C/c3ccccc3)c2n1
Fc1ccc(cc1)C(Cl)Cn1ncc2c(NCc3ccncc3)ncnc12
Fc1ccc(cc1)C(Cl)Cn1ncc2c(NCc3ccccn3)ncnc12
Fc1ccc(CNc2ncnc3n(CC(Cl)c4ccc(Cl)cc4)ncc23)cc1 |w:14.14|
ClC(Cn1ncc2c(Nc3cccc(Cl)c3)nc(nc12)N1CCOCC1)c1ccccc1
CCCNc1nc(SCCN2CCOCC2)nc2n(CC(Cl)c3ccccc3)ncc12
ClC(Cn1ncc2c(NCc3ccccc3)nc(SCCN3CCOCC3)nc12)c1ccccc1
Fc1ccc(CNc2nc(SCCN3CCOCC3)nc3n(CC(Cl)c4ccccc4)ncc23)cc1
CC(CCCC(C)(C)O)Nc1nc(Nc2cc(C)n[nH]2)cc(C)c1C#N
CC1(C)c2[nH]c3cc(ccc3c2C(=O)c2ccc(cc12)C1CCN(CC1)C1COC1)C#N
Cc1c2CCCN3CCC[C@@H]3CNc3cc(ccc3C(N)=O)-n2c2CC(C)(C)CC(=O)c12 |r|
CN(C(c1c[nH]c2ccccc12)c1ccc(Cl)cc1)c1ccccc1
CN(C(c1c[nH]c2ccccc12)c1ccc(C)cc1)c1ccccc1
COc1ccc(cc1)C(N(C)c1ccccc1)c1c[nH]c2ccccc12
CN(C(c1c[nH]c2ccccc12)c1ccccc1)c1ccccc1
CN(C(c1c[nH]c2ccccc12)c1ccc(O)cc1)c1ccccc1
CN(C(c1c[nH]c2ccccc12)c1ccc(O)c(Br)c1)c1ccccc1
COc1cccc(c1)C(N(C)c1ccccc1)c1c[nH]c2ccccc12
COc1ccc(C(N(C)c2ccccc2)c2c[nH]c3ccccc23)c(OC)c1
CN(C(c1cn(C)c2ccccc12)c1ccccc1)c1ccccc1
CN(C(c1cn(C)c2ccccc12)c1ccc(Cl)cc1)c1ccccc1
CN(C(c1cn(C)c2ccccc12)c1ccc(C)cc1)c1ccccc1
CN(C(c1c[nH]c2ccccc12)c1cccc(c1)[N+]([O-])=O)c1ccccc1
CN(C(c1c[nH]c2ccc(Br)cc12)c1ccccc1)c1ccccc1
COc1ccc(cc1)C(N(C)c1ccccc1)c1c[nH]c2ccc(OC)cc12
COc1ccc2[nH]cc(C(N(C)c3ccccc3)c3ccc(C)cc3)c2c1
CN(C(c1c[nH]c2ccc(Br)cc12)c1ccc(C)cc1)c1ccccc1
COc1ccc(cc1)C(N(C)c1ccccc1)c1c[nH]c2ccc(Br)cc12
COc1ccc2[nH]cc(C(N(C)c3ccccc3)c3ccc(Cl)cc3)c2c1
CCOC(=O)c1c2c3cccc4cccc(c2nc1=O)c34
CNC(=O)c1ncc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(CCO)CC3)c(c2)C(F)(F)F)n1C
CC(C)(C)c1ccc(cc1)C(=O)NNC(=O)C(=O)c1c[nH]c2ccccc12
FC(F)(F)c1ccc(cc1)C(=O)NNC(=O)C(=O)c1c[nH]c2ccccc12
Ic1ccc(cc1)C(=O)NNC(=O)C(=O)c1c[nH]c2ccccc12
Fc1ccccc1C(=O)NNC(=O)C(=O)c1c[nH]c2ccccc12
Cc1ccc(C)n1-c1ccc(cc1)C(=O)NNC(=O)C(=O)c1c[nH]c2ccccc12
Cc1cncc(Oc2ccc(cc2)C(=O)NNC(=O)C(=O)c2c[nH]c3ccccc23)n1
Fc1ccc(COc2ccccc2-c2ccc(cc2)C(=O)NNC(=O)C(=O)c2c[nH]c3ccccc23)cc1
FC(F)(F)c1cccc(OCc2ccccc2-c2ccc(cc2)C(=O)NNC(=O)C(=O)c2c[nH]c3ccccc23)c1
FC(F)(F)c1cccc(OCc2cccc(c2)-c2ccc(cc2)C(=O)NNC(=O)C(=O)c2c[nH]c3ccccc23)c1
Cc1cc(ccc1OCc1cccc(c1)-c1ccc(cc1)C(=O)NNC(=O)C(=O)c1c[nH]c2ccccc12)C(C)(C)C
COCCc1ccc(OCc2cccc(c2)-c2ccc(cc2)C(=O)NNC(=O)C(=O)c2c[nH]c3ccccc23)cc1
CS(=O)(=O)NCc1cccc(c1)-c1ccc(cc1)C(=O)NNC(=O)C(=O)c1c[nH]c2ccccc12
Cc1nc(no1)-c1ccc(cc1)C(=O)NNC(=O)C(=O)c1c[nH]c2ccccc12
CN1CCN(CC1)c1ccc(cc1)-c1cc2n(C)nc(N)c2c(=O)[nH]1
Nc1n(nc2cc([nH]c(=O)c12)-c1ccccc1)-c1ccccc1
Fc1ccc(cc1)-n1cccc(C(=O)Nc2ccc(Oc3ncnc4scc(-c5ccccc5)c34)c(F)c2)c1=O
Cc1cc(O)cc2oc3cc(O)cc(O)c3c(=O)c12
Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
CCc1cc2C(=O)c3c([nH]c4cc(ccc34)C#N)C(C)(C)c2cc1N1CCN(CC1)C1COC1
CSc1nc(Nc2cccc(Cl)c2)c2cnn(CCc3ccccc3)c2n1
CSc1nc(NCc2ccccc2F)c2cnn(CC(C)c3ccccc3)c2n1
CSc1nc(NCc2ccc(F)cc2)c2cnn(CC(C)c3ccccc3)c2n1
CSc1nc(NCc2ccccc2Cl)c2cnn(CC(C)c3ccccc3)c2n1
CSc1nc(Nc2ccccc2)c2cnn(CC(C)c3ccccc3)c2n1
CSc1nc(Nc2cccc(Cl)c2)c2cnn(CC(C)c3ccccc3)c2n1
Fc1cccc(CNc2ncnc3n(CCc4ccccc4)ncc23)c1
CC(Cn1ncc2c(Nc3cccc(Cl)c3)ncnc12)c1ccccc1
CSc1nc(NCc2cccc(Br)c2)c2cnn(CC(Cl)c3ccccc3)c2n1
Fc1cccc(CNc2ncnc3n(CC(Cl)c4ccccc4)ncc23)c1 |w:15.15|
ClC(Cn1ncc2c(NCc3ccccc3)ncnc12)c1ccccc1
Fc1ccccc1CNc1ncnc2n(CC(Cl)c3ccccc3)ncc12 |w:16.17|
Fc1ccc(CNc2ncnc3n(CC(Cl)c4ccccc4)ncc23)cc1 |w:14.14|
CSc1nc(Nc2cccc(Br)c2)c2cnn(CC(C)c3ccccc3)c2n1
Clc1cccc(Nc2ncnc3n(CCc4ccccc4)ncc23)c1
Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)OCCN4CCCC4
O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1
Cc1ccc(cc1Nc2nc(cs2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C
C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
CCN(CCCOc1ccc2c(c1)ncnc2Nc3cc(n[nH]3)CC(=O)Nc4cccc(c4)F)CCO
CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C
Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|
c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4
C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|
Cn1cnc2c1cc(c(c2F)Nc3ccc(cc3Cl)Br)C(=O)NOCCO
Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
CSc1nc(NCCc2ccccc2)c2ccn(Cc3ccc(F)cc3)c2n1
CSc1nc(NCCc2ccc(Cl)cc2)c2ccn(Cc3ccc(F)cc3)c2n1
CSc1nc(Nc2ccccc2)c2ccn(CC(Cl)c3ccccc3)c2n1
CSc1nc(NCc2ccccc2)c2ccn(CC(Cl)c3ccccc3)c2n1
CCCCNc1nc(SC)nc2n(Cc3ccc(F)cc3)ccc12
CSc1nc(N2CCCC2)c2ccn(Cc3ccc(F)cc3)c2n1
CSc1nc(N2CCOCC2)c2ccn(Cc3ccc(F)cc3)c2n1
CSc1nc(NCc2ccccc2)c2ccn(Cc3ccc(F)cc3)c2n1
CSc1nc(Nc2cccc(Cl)c2)c2ccn(CC(Cl)c3ccccc3)c2n1
CSc1nc(N2CCCCC2)c2ccn(Cc3ccc(F)cc3)c2n1
C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|
CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3
Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F
Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1
CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|
Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
CNC(=O)c1ccccc1Sc2ccc3c(c2)[nH]nc3/C=C/c4ccccn4
CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|
CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1
CN(C)C/C=C/C(=O)Nc1cc2c(cc1O[C@H]3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F
CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
COc1ccc(cc1)COc2ccc(cc2OC)Cc3cnc(nc3N)N
Cc1cnc2c(NCCN)nc3ccc(C)cc3n12
CN(C)C\C=C\C(=O)N(C)c1cc2c(cc1F)nc(Nc1ccccc1C)c1cncn21
CN(C)C\C=C\C(=O)N(C)c1cc2c(cc1Cl)nc(Nc1cc(F)ccc1C)c1cncn21
[O-][n+]1ccc2c(ccnc2c1-c1c(Cl)cccc1Cl)-c1ccc(F)cc1Cl |(12.75,-22.82,;14.08,-22.05,;14.08,-20.51,;15.41,-19.74,;16.75,-20.5,;18.08,-19.73,;19.42,-20.51,;19.42,-22.05,;18.08,-22.82,;16.74,-22.05,;15.42,-22.83,;15.42,-24.36,;14.08,-25.13,;12.75,-24.36,;14.09,-26.67,;15.42,-27.44,;16.76,-26.66,;16.75,-25.12,;18.08,-24.34,;18.08,-18.2,;19.42,-17.43,;19.42,-15.89,;18.08,-15.12,;18.08,-13.58,;16.75,-15.89,;16.75,-17.43,;15.42,-18.2,)|
CC(C)C\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)[C@@H](O)CC[C@]12C |r|
CC(C)C\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)[C@H](O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1[C@@H](O)C[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)[C@H](O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1[C@@H](O)C[C@H]2[C@H](CCc3cc(O)ccc3C)[C@H](O)CC[C@]12C |r|
CC(C)(CC(=O)NCCn1ccc2c1c(ncn2)Nc3ccc(c(c3)Cl)Oc4cccc(c4)C(F)(F)F)O
CC(C)(C)c1cc(c(s1)NC(=O)Nc2cccc(c2Cl)Cl)C(=O)N3CCC(=O)N(CC3)CCN(C)C
Fc1ccc2[nH]c(cc2c1)C(=O)N1C[C@]2(CCN(C2)C2CCCNC2)c2ccccc12 |r|
Fc1ccc2cc([nH]c2c1)C(=O)N1C[C@]2(CCN(C2)C2CCNC2)c2ccccc12 |r|
C[C@@H]1CCC(CN1)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccccc3[nH]1)c1ccccc21 |r|
C[C@@H]1CCC(CN1)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccc(F)cc3[nH]1)c1ccccc21 |r|
CC1(C)Cc2nn(c(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1)-c1ccc(Cl)cc1
CC1(C)Cc2nn(c(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1)-c1ccc(cc1)[N+]([O-])=O
CC1(C)Cc2nn(-c3cccs3)c(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1
Cc1ccc(cc1)-n1nc2CC(C)(C)CC(=O)c2c1-c1ccc(Cl)c(Cl)c1
COc1ccc(cc1O)-n1nc2CC(C)(C)CC(=O)c2c1-c1ccc(Cl)c(Cl)c1
CC1(C)Cc2nn(c(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1)-c1ccc(O)cc1
CC1(C)Cc2nn(-c3ccc[nH]3)c(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1
COc1ccc(cc1)-n1nc2CC(C)(C)CC(=O)c2c1-c1ccc(Cl)c(Cl)c1
CC1(C)Cc2nn(c(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1)-c1ccccc1
CC1(C)Cc2nn(c(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1)-c1cccc(Cl)c1
Clc1ccc(cc1)-n1nc2CCCC(=O)c2c1-c1ccc(Cl)c(Cl)c1
Clc1ccc(cc1Cl)-c1c2c(CCCC2=O)nn1-c1cccs1
Cc1ccc(cc1)-n1nc2CCCC(=O)c2c1-c1ccc(Cl)c(Cl)c1
Fc1ccccc1-n1nc2CCCC(=O)c2c1-c1ccc(Cl)c(Cl)c1
COc1ccc(cc1)-n1nc2CCCC(=O)c2c1-c1ccc(Cl)c(Cl)c1
Clc1ccc(cc1Cl)-c1c2c(CCCC2=O)nn1-c1ccccc1
Oc1ccc(cc1)-n1nc2CCCC(=O)c2c1-c1ccc(Cl)c(Cl)c1
COc1ccc(cc1O)-n1nc2CCCC(=O)c2c1-c1ccc(Cl)c(Cl)c1
[O-][N+](=O)c1ccc(cc1)-n1nc2CCCC(=O)c2c1-c1ccc(Cl)c(Cl)c1
COc1cccc(c1)-n1nc2CCCC(=O)c2c1-c1ccc(C)c(Cl)c1
Cc1ccc(cc1Cl)-c1c2c(CC(C)(C)CC2=O)nn1-c1ccc(Cl)cc1
Cc1ccc(cc1Cl)-c1c2c(CC(C)(C)CC2=O)nn1-c1ccncc1
Cc1ccc(cc1Cl)-c1c2c(CC(C)(C)CC2=O)nn1-c1ccc[nH]1
CC1(C)Cc2nn(-c3cccs3)c(C3CCCCC3)c2C(=O)C1
CC1(C)Cc2nn(c(C3CCCCC3)c2C(=O)C1)-c1ccc(cc1)[N+]([O-])=O
CC1(C)Oc2nn(c(C3CCCCC3)c2C(=O)O1)-c1ccc(Cl)cc1
Clc1cccc(c1)-n1nc2CCCC(=O)c2c1C1CCCCC1
Cc1ccc(cc1)-n1nc2CCCC(=O)c2c1C1CCCCC1
COc1ccc(cc1)-n1nc2CC(C)(C)CC(=O)c2c1-c1ccc(cc1)C(C)(C)C
COc1ccc(cc1OC)-n1nc2CC(C)(C)CC(=O)c2c1-c1ccc(cc1)C(C)(C)C
CC(C)(C)c1ccc(cc1)-c1c2c(CC(C)(C)CC2=O)nn1-c1ccc(Cl)cc1
CC(C)(C)c1ccc(cc1)-c1c2c(OC(C)(C)OC2=O)nn1-c1ccc(Cl)cc1
Cc1ccc(cc1)-n1nc2CC(C)(C)CC(=O)c2c1-c1ccc(cc1)C(C)(C)C
CN1CCN(Cc2ccc(NC(=O)c3ccc(Cl)c(c3)C#Cc3cncc(c3)N3CCOCC3)cc2C(F)(F)F)CC1
Cn1c2c(C(C#N)C3(CCNCC3)NC2=O)c2ccc(Cl)c(Cl)c12
COc1ccc(cc1\C=C\c1ccc(Cl)cc1)C(=O)NC[C@@H](O)CO |r|
COc1ccc(cc1\C=C\c1ccc(Cl)cc1)C(=O)NC[C@H](O)CO |r|
CN1CCN(CC1)c1ccc(Nc2nc(N)c(s2)C(=O)c2ccc3OCCOc3c2)cc1
COc1cccc(c1)C(=O)c1sc(Nc2ccc(cc2)N2CCN(CC2)C(C)C)nc1N
Nc1nc(Nc2ccc(cc2)[C@H]2CC[C@@H](CC2)N2CCOCC2)nn1-c1ccccn1 |r,wU:11.11,wD:14.18,(-9.05,.18,;-7.58,.64,;-7.09,2.1,;-5.55,2.08,;-4.8,3.43,;-3.26,3.44,;-2.48,2.12,;-.94,2.14,;-.18,3.48,;-.98,4.81,;-2.52,4.79,;1.35,3.5,;2.1,4.85,;3.65,4.86,;4.44,3.53,;3.68,2.19,;2.14,2.18,;5.97,3.55,;6.75,2.22,;8.29,2.23,;9.05,3.57,;8.27,4.9,;6.73,4.89,;-5.09,.62,;-6.35,-.28,;-6.36,-1.81,;-5.04,-2.59,;-5.05,-4.13,;-6.39,-4.89,;-7.72,-4.11,;-7.71,-2.57,)|
CC(C)n1c2CCCC(=O)c2c2C(=O)c3ccccc3-c12
COc1cc2ncccc2cc1NC(=O)c1csc2cncnc12
CC1(C)OCC(=O)Nc2cc(Nc3nc(NCC(F)(F)F)c4occc4n3)ccc12
CC[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1cccc(CC2CCCCC2)c1
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCc1cccc(CC2CCCCC2)c1
CC(=O)c1cc(CNC(=O)c2ccc(OP([O-])([O-])=O)cc2)ccc1OCC1CCCCC1
NC(=O)c1cc(CNC(=O)c2ccc(OP([O-])([O-])=O)cc2)ccc1OCC1CCCCC1
[O-]P([O-])(=O)Oc1ccc(cc1)C(=O)NCc1ccc(OCC2CCCCC2)cc1
CNC(=O)c1cc(CNC(=O)c2ccc(OP([O-])([O-])=O)cc2)ccc1OCC1CCCCC1
CN1CCN(CCOC(=O)N(c2cccc(Br)c2)c2nc(SCCN3CCOCC3)nc3n(CC(Cl)c4ccccc4)ncc23)CC1
CSc1nc(N(C(=O)OC(C)CN2CCN(C)CC2)c2cccc(Br)c2)c2cnn(CC(C)c3ccccc3)c2n1
CSc1nc(N(C(=O)OC(CN2CCN(C)CC2)Cc2ccccc2)c2cccc(Br)c2)c2cnn(CC(C)c3ccccc3)c2n1
ClC(Cn1ncc2c(Nc3ccccc3)ncnc12)c1ccc(Br)cc1
CSc1nc(N(C(=O)OCCN2CCN(C)CC2)c2cccc(Br)c2)c2cnn(CC(C)c3ccccc3)c2n1
Cc1n[nH]c2ccc(cc12)-c1cc(N[C@@H](CO)c2ccccc2)cnc1-c1cc(Cl)ccc1O |r|
OC[C@H](Nc1cnc(-c2cc(Cl)ccc2O)c(c1)-c1ccc2cnccc2c1)c1ccccc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(N[C@@H](CO)c2ccccc2)cnc1-c1ccc(F)cc1O |r|
Cc1n[nH]c2ccc(cc12)-c1cc(N[C@@H](CO)c2ccccc2)cnc1-c1cc(F)ccc1O |r|
CC(c1cc2cc(cnc2cc1F)-c1cnn(C)c1)n1nnc2ncc(nc12)-c1cnn(CCO)c1
CN(C)CC(=C)C(=O)c1ccc(OCc2ccccc2)c(O)c1
C=C(CN1CCNCC1)C(=O)c1ccc(OCc2ccccc2)cc1
CN(C)CC(CSc1ccc(C)c(C)c1)C(=O)c1ccc(OCc2ccccc2)cc1
CN(C)CCC(=O)c1ccc(OCc2ccccc2)c(O)c1
CN(C)CCC(=O)c1ccc(OCc2ccccc2)cc1
CN(C)CC(=C)C(=O)c1ccc(OS(=O)(=O)c2ccc(cc2)C(O)=O)cc1
COC(=O)c1ccccc1SCC(CN(C)C)C(=O)c1ccc(OCc2ccccc2)cc1
O=C(CCN1CCOCC1)c1ccc(OCc2ccccc2)cc1
C=C(CN1CCOCC1)C(=O)c1ccc(OCc2ccccc2)cc1
O=C(CCN1CCCCC1)c1ccc(OCc2ccccc2)cc1
C=C(CN1CCCCC1)C(=O)c1ccc(OCc2ccccc2)cc1
NC(=S)C(Cc1ccc(O)c(O)c1)C#N
CN(C)CC(=C)C(=O)c1ccccc1
CN(C)CC(CNNC(N)=O)C(=O)c1ccc(OCc2ccccc2)cc1
CN(C)CC(=C)C(=O)c1ccc(OS(=O)(=O)c2ccc(C(O)=O)c(O)c2)cc1
CN(C)CC(=C)C(=O)c1ccc(OS(=O)(=O)c2ccc(cc2)C(=O)N(C)C)cc1
CCOC(=O)C1CCN(CCC(=O)c2ccc(OCc3ccccc3)cc2)CC1
CN(C)CC(CSCCN)C(=O)c1ccc(OCc2ccccc2)cc1
CN(C)CC(CSc1ccccc1)C(=O)c1ccc(OCc2ccccc2)cc1
CN(C)CC(=C)C(=O)c1ccc(OCc2ccccc2)cc1
Nc1ncnc2n(CC3CCNCC3(F)F)nc(Sc3cccc(Cl)c3)c12
Nc1ncnc2n(CC3CCNCC3)cc(Sc3cccc(Cl)c3)c12
Nc1ncnc2n(CC3CCNCC3)nc(Sc3cccc(Cl)c3)c12
CC(=O)N[C@@H](Cc1ccc(cc1)C(F)(F)P([O-])([O-])=O)C(=O)N[C@H]1CCCCN(CCCC2CCCCC2)C1=O
CC(=O)N[C@@H](Cc1ccc(c(c1)P(O)(O)=O)P(O)(O)=O)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccccc2)C1=O |r|
CC(C)(C)c1ccc(CN2CCCC[C@H](NC(=O)c3ccc(OP([O-])([O-])=O)cc3)C2=O)cc1
[O-]P([O-])(=O)Oc1ccc(cc1)C(=O)N[C@H]1CSCCN(CCCc2ccccc2)C1=O
CC(=O)N[C@@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(=O)N[C@H]1CCCCN(Cc2ccc(cc2)-c2ccccc2)C1=O |r|
COc1cc2c(ncnc2cc1OCCCN1CCOCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccccc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccc4OCOc4c3)c2cc1OC
O=C(Nc1cccc(c1)-c1cncc2ccccc12)c1ccccc1NCc1ccncc1
c1ccc(c(c1)C(=O)Nc2cccc(c2)C(F)(F)F)NCc3ccncc3
CC(=O)NC(Cc1ccc(c(c1)P(O)(O)=O)P(O)(O)=O)C(=O)N[C@H]1CCCCc2cc(OCC3CCCCC3)c(cc12)C(N)=O
CC(=O)NC(Cc1ccc(C(O)=O)c(C=O)c1)C(=O)N[C@H]1CCCCc2cc(OCC3CCCCC3)c(cc12)C(N)=O
O=C1C(Nc2ccccc12)=C1Nc2ccccc2C1=O |w:2.2|
CC[C@@H](C)[C@H](NC(=O)C[C@@H]1NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC1=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1ccc(OP(O)(O)=O)cc1)C(O)=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)CC[C@@H]1NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC1=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(O)=O)C(O)=O
CC(C)[C@H](NC(=O)C[C@@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)Cc1ccc(OP(O)(O)=O)cc1)C(O)=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(OP(O)(O)=O)cc1)C(O)=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)C[C@@H]1NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC1=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CC[C@@H]1NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC1=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(O)=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)Cc1ccc(OP(O)(O)=O)cc1)C(O)=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H]1CCC(=O)N[C@@H](Cc2ccc(OP(O)(O)=O)cc2)C(=O)N1)C(O)=O
CC(C)[C@H](NC(=O)C[C@@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)Cc1ccc(OP(O)(O)=O)cc1)C(O)=O
CC(C)[C@H](NC(=O)C[C@@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(O)=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)[C@@H]1CCC(=O)N[C@@H](Cc2ccc(OP(O)(O)=O)cc2)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(O)=O
CC[C@@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(O)=O)C(O)=O
CC[C@@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(O)=O)C(O)=O
CC(C)[C@H](NC(=O)C[C@@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(OP(O)(O)=O)cc1)C(O)=O)C(O)=O
CCn1c2ccccc2c2cc(\C=N/OCCO\N=C\c3ccc(O)c(O)c3)ccc12
CCn1c2ccccc2c2cc(\C=N/OC)ccc12
CO\N=C\c1ccc(O)c(O)c1
CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO
Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCNCC1
Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1
OCCOCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1
Brc1cccc2C(C(=O)Nc12)=C1Nc2ccccc2C1=N/OCCN1CCNCC1
COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1
c1ccc2c(c1)nc(s2)C(C#N)c3ccnc(n3)NCCc4cccnc4
COc1cc2c(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)ncnc2cc1OCCCN1CCC(CO)CC1
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCCCNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)C1NC(=O)[C@H](CS)NC(=O)CCC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3ccc(O)cc3)NC1=O)C(O)=O)cc2
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(NS(C)(=O)=O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)N=[N+]=[N-])C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@@H](C)[C@@H]1NC(=O)[C@@H](CS)NC(=O)CCC(=O)Nc2ccc(cc2)[C@H](NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@@H]1NC(=O)[C@H](CS)NC(=O)CCC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3ccc(O)cc3)NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)cc2
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)P(O)(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)C#N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@@H]1NC(=O)[C@H](CS)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O
CC[C@H](C)[C@@H]1NC(=O)[C@H](CS)NC(=O)CCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
[#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#16])-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(cc1)\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](-[#8])=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(N)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@H]1Cc2ccc(NC(=O)CCC(=O)NCCCC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)cc2
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(N)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@@H]1NC(=O)[C@H](CS)NC(=O)CCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(N)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCCCNC(=O)CCC(=O)Nc2ccc(C[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)cc2
CC[C@H](C)[C@H](NC(=O)[C@@H](CS)NC(C)=O)C(=O)N[C@H]1Cc2ccc(NC(=O)CCCCCCC(=O)NCCCC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)cc2
CC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(cc1)P(O)(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@H]1Cc2ccc(NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](CCCCN)NC1=O)cc2
CN1CCCC(COc2ccc(cc2)-c2cnc(Nc3c(C)cccc3C)c3cncn23)C1
COc1ccc(cc1OC)-c1cnc(Nc2c(C)cccc2C)c2cncn12
Cc1cccc(C)c1Nc1ncc(-c2ccncc2)n2cncc12
Cc1cccc(C)c1Nc1ncc(-c2ccc(cc2)C(O)=O)n2cncc12
Cc1cccc(C)c1Nc1ncc(C2=CCC(CN3CCCC3)=[S+]2)n2cncc12 |c:24,t:14|
CN(c1ccccc1)c1ncc(-c2ccccc2)n2cncc12
COc1cccc(c1)-c1cnc(Nc2c(C)cccc2C)c2cncn12
Fc1cccc(F)c1Nc1ncc(-c2ccccc2)n2cncc12
Cc1cccc(C)c1Nc1ncc(-c2ccc(OCCN3CCCC3)cc2)n2cncc12
Cc1cccc(Cl)c1Nc1ncc(-c2ccc(F)cc2)n2cncc12
COc1cccc(C)c1Nc1ncc(-c2ccccc2)n2cncc12
Clc1cccc(Cl)c1Nc1ncc(-c2ccccc2)n2cncc12
CN(C)c1ccc(cc1)-c1cnc(Nc2c(C)cccc2C)c2cncn12
COc1ccc(cc1)-c1cnc(Nc2ccccc2C)c2cncn12
Cc1cc(C)c(Nc2ncc(-c3ccccc3)n3cncc23)c(C)c1
Cc1cccc(C)c1Nc1ncc(-c2ccccc2)n2cncc12
Cc1cccc(C)c1Nc1ncc(-c2ccc(cc2)C#N)n2cncc12
Cc1cccc(C)c1Nc1ncc(-c2cccc(OCCN3CCCC3)c2)n2cncc12
CN1CCCC(COc2cccc(c2)-c2cnc(Nc3c(C)cccc3C)c3cncn23)C1
CN(C)C(=O)c1ccc(cc1)-c1cnc(Nc2c(C)cccc2C)c2cncn12
N(c1ccccc1)c1ncc(-c2ccccc2)n2cncc12
Cc1cccc(C)c1Nc1ncc(-c2cccs2)n2cncc12
CN1CCN(CC2=[S+]C(=CC2)c2cnc(Nc3c(C)cccc3C)c3cncn23)CC1 |c:8,t:6|
COc1ccc(cc1)-c1cnc(Nc2c(C)cccc2C)c2cncn12
Cc1cccc(C)c1Nc1ncc(-c2ccc(OCCN3CCOCC3)cc2)n2cncc12
COc1cccc(c1)-c1cnc(Nc2c(C)cccc2Cl)c2cncn12
COc1ccc(cc1)-c1cnc(Nc2ccccc2)c2cncn12
Cc1cccc(C)c1Nc1ncc(-c2ccc(cc2)C(F)(F)F)n2cncc12
Cc1cccc(C)c1Nc1nccn2cncc12
Cc1cccc(C)c1Nc1ncc(-c2ccc(F)cc2)n2cncc12
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1N
CC(COc1cccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)c1)N1CCN(C)CC1 |w:1.0|
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(cc3)N(CCN3CCCC3)C(=O)c3ccccc3)nnc2c1
Cc1ccc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2c1
COc1cc2c(CCN[C@]22CS[C@@H]3[C@H]4[C@@H]5N(C)[C@@H](Cc6cc(C)c(OC)c(O)c56)[C@H](O)N4[C@H](COC2=O)c2c4OCOc4c(C)c(OC(C)=O)c32)cc1O |r|
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1ccncn1
C(CN1CCCC1)Oc1ccc(Nc2nnc3ccccc3n2)cc1
CC(COc1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1)N1CCN(C)CC1 |w:1.0|
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(OCCN4CCOCC4)c3)nnc2c1
Cc1ccc(CN)cc1-c1cc(C)c2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(c3)N(CCN3CCCC3)C(=O)c3ccccc3)nnc2c1
Cc1cnc(F)cc1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(cc3)C(=O)NN3CCNCC3)nnc2c1
CN1CCN(CC1)NC(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2c(C)cccc2C)cc1
Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1NCc1cncs1)n3
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2cncc3n(C)nc(N)c23)c1
CCCCOc1ccc(cc1)-n1c2nc3ccccc3n2c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2c1=O
COc1ccc(Cl)cc1-n1c2nc3ccccc3n2c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2c1=O |(29.7,-42.87,;29.7,-44.41,;31.04,-45.18,;32.37,-44.41,;33.71,-45.18,;33.7,-46.72,;35.03,-47.5,;32.37,-47.49,;31.04,-46.72,;29.71,-47.48,;29.7,-49.03,;30.85,-50.07,;30.21,-51.47,;30.83,-52.87,;29.93,-54.11,;28.39,-53.94,;27.78,-52.53,;28.69,-51.3,;28.37,-49.8,;27.03,-49.03,;25.69,-49.8,;24.36,-49.03,;23.03,-49.8,;21.7,-49.03,;21.71,-47.49,;20.38,-46.72,;19.04,-47.48,;19.04,-49.03,;20.38,-49.8,;17.71,-46.71,;17.71,-45.18,;16.39,-44.41,;15.05,-45.17,;13.72,-44.4,;15.04,-46.71,;16.38,-47.49,;24.37,-47.49,;25.69,-46.72,;27.03,-47.48,;28.37,-46.7,;28.36,-45.16,)|
COc1cccc(c1)-n1c2nc3ccccc3n2c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2c1=O
CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n2c(nc4ccccc24)n(-c2cccc(C)c2)c3=O)cc1
CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n2c(nc4ccccc24)n(-c2ccc(C)cc2)c3=O)cc1
CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n2c4ccccc4nc2n(-c2c(Cl)cc(Cl)cc2Cl)c3=O)cc1 |(13.38,-19.23,;14.71,-20,;16.05,-19.24,;17.38,-20.01,;17.37,-21.55,;16.04,-22.32,;14.71,-21.55,;18.7,-22.32,;20.04,-21.55,;21.37,-22.32,;21.36,-23.86,;22.69,-24.63,;24.03,-23.87,;24.03,-22.32,;25.35,-21.55,;26.7,-22.31,;26.69,-23.86,;25.36,-24.64,;28.03,-24.63,;28.35,-26.13,;27.44,-27.37,;28.06,-28.77,;29.59,-28.94,;30.49,-27.7,;29.88,-26.3,;30.51,-24.9,;29.37,-23.86,;29.37,-22.32,;30.7,-21.55,;30.7,-20.01,;29.36,-19.25,;32.03,-19.24,;33.37,-20.02,;34.7,-19.25,;33.37,-21.56,;32.03,-22.32,;32.03,-23.86,;28.03,-21.54,;28.03,-20,;20.04,-24.63,;18.71,-23.87,)|
CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n2c4ccccc4nc2n(-c2c(Cl)cccc2Cl)c3=O)cc1 |(-12.03,-20.12,;-10.7,-20.89,;-9.36,-20.13,;-8.03,-20.9,;-8.04,-22.44,;-9.37,-23.21,;-10.7,-22.44,;-6.71,-23.21,;-5.37,-22.44,;-4.04,-23.21,;-4.05,-24.75,;-2.72,-25.52,;-1.38,-24.76,;-1.38,-23.21,;-.06,-22.44,;1.29,-23.2,;1.28,-24.75,;-.05,-25.53,;2.62,-25.52,;2.94,-27.02,;2.03,-28.26,;2.65,-29.66,;4.18,-29.83,;5.08,-28.59,;4.47,-27.19,;5.1,-25.79,;3.96,-24.75,;3.96,-23.21,;5.29,-22.44,;5.29,-20.9,;3.95,-20.14,;6.62,-20.13,;7.96,-20.91,;7.96,-22.45,;6.62,-23.21,;6.62,-24.75,;2.62,-22.43,;2.62,-20.89,;-5.37,-25.52,;-6.7,-24.76,)|
COc1cc(Nc2ncc3c(n2)n2c4ccccc4nc2n(-c2c(C)cccc2C)c3=O)cc(OC)c1OCCCN1CCN(C)CC1 |(22.25,-6.46,;20.92,-7.23,;20.91,-8.77,;22.24,-9.54,;22.23,-11.08,;23.56,-11.85,;24.9,-11.08,;24.9,-9.54,;26.23,-8.77,;27.57,-9.53,;27.57,-11.08,;26.23,-11.85,;28.9,-11.85,;29.22,-13.35,;28.31,-14.58,;28.93,-15.99,;30.46,-16.16,;31.37,-14.92,;30.75,-13.52,;31.38,-12.12,;30.24,-11.08,;30.24,-9.53,;31.58,-8.77,;31.57,-7.23,;30.24,-6.47,;32.9,-6.46,;34.24,-7.23,;34.24,-8.78,;32.9,-9.54,;32.9,-11.08,;28.9,-8.76,;28.9,-7.22,;20.91,-11.85,;19.58,-11.08,;18.25,-11.86,;18.25,-13.4,;19.58,-9.54,;18.24,-8.77,;16.91,-9.54,;15.58,-8.77,;15.58,-7.23,;16.91,-6.46,;18.24,-7.24,;19.57,-6.47,;19.58,-4.93,;20.92,-4.17,;18.25,-4.16,;16.91,-4.92,)|
COc1cc(Nc2ncc3c(n2)n2c4ccccc4nc2n(-c2c(C)cccc2C)c3=O)ccc1OCCCN1CCN(C)CC1 |(-3.89,-6.67,;-5.23,-7.43,;-5.23,-8.97,;-3.9,-9.74,;-3.91,-11.29,;-2.58,-12.06,;-1.25,-11.29,;-1.24,-9.74,;.08,-8.97,;1.42,-9.74,;1.42,-11.28,;.08,-12.06,;2.76,-12.05,;3.08,-13.56,;2.17,-14.79,;2.79,-16.2,;4.32,-16.36,;5.22,-15.13,;4.6,-13.73,;5.24,-12.32,;4.09,-11.29,;4.1,-9.74,;5.43,-8.97,;5.43,-7.44,;4.09,-6.67,;6.75,-6.67,;8.1,-7.44,;8.09,-8.98,;6.76,-9.75,;6.75,-11.29,;2.76,-8.96,;2.76,-7.42,;-5.23,-12.05,;-6.57,-11.29,;-6.57,-9.74,;-7.9,-8.97,;-9.24,-9.74,;-10.57,-8.97,;-10.57,-7.43,;-9.24,-6.66,;-7.9,-7.44,;-6.57,-6.68,;-6.56,-5.14,;-5.23,-4.37,;-7.9,-4.36,;-9.24,-5.13,)|
Cc1cccc(C)c1-n1c2nc3ccccc3n2c2nc(Nc3ccc(OCCCN4CCCCC4)cc3)ncc2c1=O |(29.92,5.51,;31.26,4.75,;32.58,5.52,;33.93,4.74,;33.92,3.2,;32.59,2.44,;32.58,.9,;31.26,3.21,;29.93,2.44,;29.92,.9,;31.06,-.14,;30.43,-1.54,;31.05,-2.94,;30.15,-4.18,;28.61,-4.01,;28,-2.61,;28.91,-1.37,;28.59,.13,;27.25,.9,;25.91,.12,;24.58,.89,;23.25,.13,;21.92,.9,;21.93,2.44,;20.6,3.21,;19.26,2.44,;17.93,3.21,;16.59,2.44,;15.26,3.21,;15.26,4.75,;16.59,5.52,;17.93,4.74,;19.26,5.51,;19.27,7.05,;17.93,7.82,;16.59,7.05,;19.26,.89,;20.6,.13,;24.59,2.44,;25.91,3.21,;27.25,2.45,;28.58,3.22,;28.58,4.76,)|
COc1cc(Nc2ncc3c(n2)n2c4ccccc4nc2n(-c2c(C)cccc2C)c3=O)cc(OC)c1OCCN1CCOCC1 |(-1.93,5.11,;-3.27,4.34,;-3.27,2.8,;-1.94,2.03,;-1.95,.49,;-.62,-.29,;.71,.48,;.72,2.03,;2.04,2.8,;3.38,2.04,;3.38,.49,;2.04,-.29,;4.72,-.28,;5.04,-1.78,;4.13,-3.02,;4.74,-4.42,;6.28,-4.59,;7.18,-3.35,;6.56,-1.95,;7.19,-.55,;6.05,.48,;6.06,2.03,;7.39,2.8,;7.39,4.34,;6.05,5.1,;8.71,5.11,;10.06,4.33,;10.05,2.79,;8.72,2.03,;8.71,.49,;4.71,2.81,;4.71,4.35,;-3.27,-.28,;-4.61,.48,;-5.94,-.29,;-7.27,.48,;-4.61,2.03,;-5.94,2.8,;-7.28,2.03,;-8.61,2.8,;-8.62,4.35,;-7.29,5.12,;-7.3,6.65,;-8.63,7.42,;-9.96,6.64,;-9.95,5.1,)|
CN1CCN(CCOc2ccc(Nc3ncc4c(n3)n3c5ccccc5nc3n(-c3c(C)cccc3C)c4=O)cc2F)CC1 |(15.66,-43.08,;15.65,-44.62,;16.98,-45.4,;16.98,-46.93,;15.64,-47.69,;15.64,-49.23,;16.98,-50,;18.31,-49.23,;19.65,-50,;19.65,-51.55,;20.98,-52.32,;22.3,-51.55,;23.63,-52.32,;24.97,-51.55,;24.97,-50.01,;26.3,-49.24,;27.64,-50,;27.63,-51.55,;26.3,-52.32,;28.97,-52.32,;29.29,-53.82,;28.38,-55.05,;29,-56.46,;30.53,-56.62,;31.43,-55.39,;30.82,-53.99,;31.45,-52.58,;30.31,-51.55,;30.31,-50,;31.65,-49.24,;31.64,-47.7,;30.3,-46.93,;32.97,-46.93,;34.31,-47.7,;34.31,-49.24,;32.97,-50.01,;32.97,-51.55,;28.97,-49.22,;28.97,-47.68,;22.31,-50.01,;20.98,-49.24,;20.99,-47.7,;14.31,-46.93,;14.32,-45.39,)|
COc1cc(Nc2ncc3c(n2)n2c4ccccc4nc2n(-c2c(C)cccc2C)c3=O)cc(OC)c1OCCN1CCN(C)CC1 |(-2.05,-47.19,;-3.39,-47.96,;-3.39,-49.5,;-2.06,-50.27,;-2.07,-51.81,;-.74,-52.59,;.59,-51.82,;.6,-50.27,;1.92,-49.5,;3.26,-50.27,;3.26,-51.81,;1.92,-52.59,;4.6,-52.58,;4.92,-54.08,;4.01,-55.32,;4.62,-56.73,;6.16,-56.89,;7.06,-55.66,;6.44,-54.26,;7.08,-52.85,;5.93,-51.82,;5.94,-50.27,;7.27,-49.5,;7.27,-47.97,;5.93,-47.2,;8.59,-47.2,;9.94,-47.97,;9.93,-49.51,;8.6,-50.28,;8.59,-51.82,;4.59,-49.49,;4.59,-47.95,;-3.39,-52.58,;-4.73,-51.82,;-6.06,-52.59,;-7.39,-51.82,;-4.73,-50.27,;-6.06,-49.5,;-7.4,-50.27,;-8.73,-49.5,;-8.74,-47.96,;-7.41,-47.18,;-7.42,-45.65,;-8.75,-44.88,;-8.76,-43.34,;-10.08,-45.66,;-10.07,-47.2,)|
COc1cc(Nc2ncc3c(n2)n2c4ccccc4nc2n(-c2c(C)cccc2C)c3=O)ccc1OCCN1CCN(C)CC1 |(21.28,-33.67,;19.94,-34.43,;19.94,-35.97,;21.27,-36.75,;21.26,-38.29,;22.59,-39.06,;23.92,-38.29,;23.93,-36.75,;25.25,-35.98,;26.59,-36.74,;26.59,-38.29,;25.26,-39.06,;27.93,-39.06,;28.25,-40.56,;27.34,-41.79,;27.96,-43.2,;29.49,-43.36,;30.39,-42.13,;29.78,-40.73,;30.41,-39.32,;29.27,-38.29,;29.27,-36.74,;30.6,-35.97,;30.6,-34.44,;29.26,-33.67,;31.93,-33.67,;33.27,-34.44,;33.26,-35.98,;31.93,-36.75,;31.92,-38.29,;27.93,-35.96,;27.93,-34.42,;19.94,-39.06,;18.6,-38.29,;18.6,-36.74,;17.27,-35.97,;15.93,-36.74,;14.6,-35.97,;14.6,-34.43,;15.92,-33.65,;15.91,-32.12,;14.58,-31.36,;14.57,-29.82,;13.25,-32.14,;13.26,-33.68,)|
CN(C)CCCOc1ccc(Nc2ncc3c(n2)n2c4ccccc4nc2n(-c2c(C)cccc2C)c3=O)cc1 |(-10.01,-30.27,;-10.01,-31.81,;-11.34,-32.58,;-8.68,-32.58,;-8.68,-34.12,;-7.35,-34.89,;-7.35,-36.43,;-6.01,-37.2,;-4.68,-36.43,;-3.34,-37.2,;-3.36,-38.74,;-2.02,-39.51,;-.69,-38.74,;-.69,-37.2,;.64,-36.43,;1.98,-37.19,;1.98,-38.74,;.64,-39.52,;3.31,-39.51,;3.63,-41.01,;2.73,-42.24,;3.34,-43.65,;4.87,-43.82,;5.78,-42.58,;5.16,-41.18,;5.79,-39.78,;4.65,-38.74,;4.65,-37.19,;5.99,-36.43,;5.98,-34.89,;4.65,-34.13,;7.31,-34.12,;8.65,-34.89,;8.65,-36.44,;7.31,-37.2,;7.31,-38.74,;3.31,-36.42,;3.31,-34.88,;-4.68,-39.51,;-6.01,-38.74,)|
CN(C)CCOc1ccc(Nc2ncc3c(n2)n2c4ccccc4nc2n(-c2c(C)cccc2C)c3=O)cc1 |(11.02,-18.02,;12.35,-18.79,;13.68,-18.02,;12.35,-20.33,;13.68,-21.1,;15.02,-20.33,;16.35,-21.1,;17.69,-20.33,;19.02,-21.11,;19.01,-22.65,;20.34,-23.42,;21.67,-22.65,;21.68,-21.11,;23,-20.34,;24.34,-21.1,;24.34,-22.65,;23.01,-23.42,;25.68,-23.42,;26,-24.92,;25.09,-26.15,;25.71,-27.56,;27.24,-27.72,;28.14,-26.49,;27.52,-25.09,;28.16,-23.68,;27.01,-22.65,;27.02,-21.1,;28.35,-20.33,;28.35,-18.8,;27.01,-18.03,;29.68,-18.03,;31.02,-18.8,;31.01,-20.34,;29.68,-21.11,;29.67,-22.65,;25.68,-20.32,;25.68,-18.78,;17.69,-23.42,;16.35,-22.65,)|
COc1cc(Nc2ncc3c(n2)n2c4ccccc4nc2n(-c2c(C)cccc2C)c3=O)ccc1N1CCN(C)CC1 |(-2.95,-19.43,;-4.29,-20.2,;-4.29,-21.74,;-2.96,-22.51,;-2.97,-24.05,;-1.64,-24.82,;-.3,-24.05,;-.3,-22.51,;1.02,-21.74,;2.36,-22.5,;2.36,-24.05,;1.03,-24.83,;3.7,-24.82,;4.02,-26.32,;3.11,-27.55,;3.73,-28.96,;5.26,-29.13,;6.16,-27.89,;5.55,-26.49,;6.18,-25.09,;5.04,-24.05,;5.04,-22.5,;6.37,-21.74,;6.37,-20.2,;5.03,-19.44,;7.7,-19.43,;9.04,-20.2,;9.03,-21.75,;7.7,-22.51,;7.69,-24.05,;3.7,-21.73,;3.7,-20.19,;-4.29,-24.82,;-5.62,-24.05,;-5.63,-22.51,;-6.96,-21.74,;-6.95,-20.2,;-8.28,-19.43,;-9.62,-20.19,;-10.95,-19.42,;-9.62,-21.73,;-8.29,-22.51,)|
Cc1cccc(c1N2c3nc4ccccc4n3-c5c(cnc(n5)Nc6ccc(cc6)N7CCN(CC7)C)C2=O)C
COc1cc(Nc2ncc3c(n2)n2c(nc4ccccc24)n(-c2c(C)cccc2C)c3=O)cc(OC)c1OC |(-10.47,-11.17,;-9.13,-11.93,;-7.8,-11.16,;-6.47,-11.93,;-5.15,-11.16,;-3.81,-11.93,;-2.48,-11.16,;-2.48,-9.62,;-1.15,-8.85,;.19,-9.61,;.19,-11.16,;-1.15,-11.93,;1.53,-11.93,;2.86,-11.16,;4,-12.19,;3.37,-13.6,;3.99,-15,;3.09,-16.23,;1.55,-16.07,;.94,-14.66,;1.85,-13.43,;2.86,-9.61,;4.2,-8.84,;4.19,-7.31,;2.86,-6.54,;5.52,-6.54,;6.86,-7.31,;6.86,-8.85,;5.53,-9.62,;5.52,-11.16,;1.52,-8.83,;1.52,-7.29,;-5.13,-9.62,;-6.46,-8.84,;-6.46,-7.3,;-5.13,-6.54,;-7.8,-9.61,;-9.13,-8.84,;-10.47,-9.61,)|
CN1CCN(Cc2ccc(Nc3ncc4c(n3)n(cc(C(N)=O)c4=O)-c3ccc4CCCc4c3)cc2)CC1
CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)-c2ccc3CCCc3c2)cc1
Nc1nccn2c(nc(-c3ccc4ccc(nc4c3)-c3ccccc3)c12)[C@@H]1C[C@H](CN2CCC2)C1 |wU:26.30,28.33,(7.04,-25.52,;7.05,-27.06,;5.72,-27.83,;5.72,-29.37,;7.05,-30.15,;8.39,-29.37,;9.86,-29.85,;10.77,-28.6,;9.86,-27.34,;10.64,-26.02,;9.88,-24.69,;10.64,-23.36,;12.19,-23.36,;12.96,-22.02,;14.5,-22.04,;15.28,-23.37,;14.5,-24.71,;12.96,-24.7,;12.18,-26.03,;16.82,-23.38,;17.59,-24.72,;19.13,-24.72,;19.9,-23.38,;19.12,-22.05,;17.59,-22.05,;8.39,-27.82,;10.34,-31.32,;9.65,-32.69,;11.02,-33.38,;11.5,-34.85,;10.47,-35.99,;8.93,-36.07,;9.01,-37.61,;10.55,-37.53,;11.72,-32.01,)|
Cc1cc(n2c(n1)c(c(n2)Nc3cc(cc(c3)OC)OC)C(=O)N)NCC(C)(C)N
COc1cc(Nc2nn3c(NC[C@H](C)N)cc(C)nc3c2C(N)=O)cc(OC)c1
COc1cc(Nc2nn3c(NC[C@@H](C)N)cc(C)nc3c2C(N)=O)cc(OC)c1
COc1cc(Nc2nn3c(NC[C@@H](C)O)cc(C)nc3c2C(N)=O)cc(OC)c1
COc1cc(Nc2nn3c(N[C@H](CO)Cc4cccnc4)cc(nc3c2C(N)=O)C2CC2)cc(OC)c1
COc1cc(Nc2nn3c(N[C@H](CO)Cc4c[nH]c5ccccc45)cc(nc3c2C(N)=O)C2CC2)cc(OC)c1
COc1cc(Nc2nn3c(N[C@@H](CO)Cc4ccccc4)cc(nc3c2C(N)=O)C2CC2)cc(OC)c1
COc1cc(Nc2nn3c(N[C@H](CO)Cc4ccccc4)cc(nc3c2C(N)=O)C2CC2)cc(OC)c1
COc1cc(Nc2nn3c(cc(nc3c2C(N)=O)C2CC2)N2CCC[C@H]2CO)cc(OC)c1
COc1cc(Nc2nn3c(cc(nc3c2C(N)=O)C2CC2)N2CCC[C@@H]2CO)cc(OC)c1
NC(=O)c1c(Nc2ccccc2)nn2c(N)cc(nc12)C1CC1
COc1cc(Nc2nn3c(N[C@@H](CO)C(C)C)cc(nc3c2C(N)=O)C2CC2)cc(OC)c1
COc1cc(Nc2nn3c(N[C@@H](CO)C(C)C)cc(nc3c2C(N)=O)C(C)C)cc(OC)c1
COc1cc(Nc2nn3c(N[C@@H](CO)C(C)C)cc(nc3c2C(N)=O)-c2ccccc2)cc(OC)c1
COc1cc(Nc2nn3c(N[C@@H](CO)C(C)C)cc(C)nc3c2C(N)=O)cc(OC)c1
COc1cc(Nc2nn3c(N[C@H](CO)C(C)C)cc(C)nc3c2C(N)=O)cc(OC)c1
COc1cc(Nc2nn3c(N[C@@H](C)CO)cc(C)nc3c2C(N)=O)cc(OC)c1
COc1cc(Nc2nn3c(NC[C@H](C)O)cc(C)nc3c2C(N)=O)cc(OC)c1
Cc1cc(cc2nnc(Nc3ccc(CCCN4CCCC4)cc3)nc12)-c1cc(O)ccc1Cl
Brc1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1
[#6]-c1cc(\[#6]=[#6]-2\[#6](=O)-[#6]=[#6]-[#6]-2=O)cc(-[#6])c1-[#8] |c:8|
CN(c1cccnc1)c1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cn1)C#N
[#6]C([#6])([#6])c1cc(\[#6]=[#6]-2/[#6](=O)-[#6]=[#6]-[#6]-2=O)cc(c1-[#8])C([#6])([#6])[#6] |c:11|
Cc1cc(cc2nnc(Nc3ccc(OCC[N+]4([O-])CCCC4)cc3)nc12)-c1c(Cl)cccc1Cl
CN1C(=O)N(Cc2cnc(N)nc12)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C
CN1CCN(CCCOc2cc3ncc(C#N)c(Nc4ccccn4)c3cc2C)CC1
COc1cc2c(Nc3nc4ccccc4[nH]3)c(cnc2cc1OCCCN1CCN(C)CC1)C#N
COc1cc2c(Nc3nc4ccccc4s3)c(cnc2cc1OCCN1CCN(C)CC1)C#N
Oc1cc2c(Nc3nc4ccccc4s3)c(cnc2cc1OCCN1CCOCC1)C#N
COc1cc2c(Nc3nc4ccccc4s3)c(cnc2cc1OCCN1CCCCC1)C#N
COc1cc2c(Nc3nc4ccc(OCC(F)(F)F)cc4s3)c(cnc2cc1OCCCN1CCN(C)CC1)C#N
COc1cc2c(Nc3nc4ccccc4s3)c(cnc2cc1OCCCN1CCN(C)CC1)C#N
CN1CCN(CCCOc2cc3ncc(C#N)c(Nc4nc5ccccc5[nH]4)c3cc2C)CC1
CN1CCN(CCCOc2cc3ncc(C#N)c(Nc4nc5ccc(OCC(F)(F)F)cc5s4)c3cc2C)CC1
CN1CCN(CCCOc2cc3ncc(C#N)c(Nc4nc5ccc(C)cc5s4)c3cc2C)CC1
Cc1cc2c(Nc3nc4ccccc4s3)c(cnc2cc1OCCCN1CCCCC1)C#N
Cc1cc2c(Nc3nc4ccccc4s3)c(cnc2cc1OCCCN1CCOCC1)C#N
CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(C=Cc2ccccc2)n1 |w:19.20|
Cc1ccc(cc1)-c1c(C(=O)CF)n(CCCO)c2ncnc(N)c12
COc1cc2c(cc1OC)ncnc2Nc3ccc(cc3)Oc4ccccc4
CC(C)C(=O)N1CCC[C@H](C1)c1nc(-c2ccc(cc2F)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
COCC(=O)N1CCC[C@H](C1)c1nc(-c2ccc(cc2F)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
COCC(=O)N1CCO[C@H](C1)c1nc(-c2ccc(cc2F)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
CC(C)C(=O)N1CCO[C@H](C1)c1nc(-c2ccc(cc2F)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3F)C(=O)Nc3cc(ccn3)C(F)(F)F)c12)[C@H]1CN(CCO1)C1CCOCC1 |r|
Nc1nccn2c(nc(-c3ccc(cc3F)C(=O)Nc3cc(ccn3)C(F)(F)F)c12)[C@@H]1CCCN(C1)C1CCOCC1 |r|
Nc1ncnc2n(C[C@H]3CCCN3S(=O)(=O)C=C)cc(-c3ccc4OCOc4c3)c12 |r|
COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1
c1cc(c(c(c1)F)C(=O)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F
CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|
Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1
CC1(C)CC(CC(C)(C)N1[O])NC(=O)c1cccc(c1)-c1cc2nccc(Nc3cccc(O)c3)n2n1 |^1:10|
COc1ccc(cc1)-c1[nH][nH]c(=O)c1N=Nc1cccc(OC)c1 |w:14.15|
COc1ccc(cc1)-c1[nH][nH]c(=O)c1N=Nc1cccnc1 |w:14.15|
COc1ccncc1-c1[nH][nH]c(=O)c1N=Nc1ccccc1 |w:14.15|
COc1cccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)c1
Clc1ccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)cc1
Brc1ccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)cc1
[O-][N+](=O)c1ccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)cc1
[O-][N+](=O)c1cccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)c1
NS(=O)(=O)c1ccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)cc1
NS(=O)(=O)c1cccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)c1
NC(=O)c1ccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)cc1
CC(=O)Nc1ccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)cc1
C1CN(CCO1)c1nc(Nc2ccccc2)c2[nH]cnc2n1
COc1ccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)cc1
COc1cccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)c1
Cc1cccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)c1
Clc1ccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)cc1
Brc1ccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)cc1
[O-][N+](=O)c1ccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)cc1
[O-][N+](=O)c1cccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)c1
NS(=O)(=O)c1ccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)cc1
NS(=O)(=O)c1cccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)c1
NC(=O)c1ccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)cc1
CC(=O)Nc1ccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)cc1
OCCN1CCN(CC1)c1nc(Nc2ccccc2)c2[nH]cnc2n1
COc1ccc(Nc2nc(nc3nc[nH]c23)N2CCN(CCO)CC2)cc1
COc1cccc(Nc2nc(nc3nc[nH]c23)N2CCN(CCO)CC2)c1
Cc1cccc(Nc2nc(nc3nc[nH]c23)N2CCN(CCO)CC2)c1
OCCN1CCN(CC1)c1nc(Nc2ccc(Cl)cc2)c2[nH]cnc2n1
OCCN1CCN(CC1)c1nc(Nc2ccc(cc2)[N+]([O-])=O)c2[nH]cnc2n1
OCCN1CCN(CC1)c1nc(Nc2cccc(c2)[N+]([O-])=O)c2[nH]cnc2n1
NS(=O)(=O)c1ccc(Nc2nc(nc3nc[nH]c23)N2CCN(CCO)CC2)cc1
NS(=O)(=O)c1cccc(Nc2nc(nc3nc[nH]c23)N2CCN(CCO)CC2)c1
NC(=O)c1ccc(Nc2nc(nc3nc[nH]c23)N2CCN(CCO)CC2)cc1
CC(=O)Nc1ccc(Nc2nc(nc3nc[nH]c23)N2CCN(CCO)CC2)cc1
C(c1ccccc1)n1cnc2c(ncnc12)N1CCOCC1
Brc1ccc(Nc2ncnc3n(Cc4ccccc4)cnc23)cc1
C(c1ccccc1)n1cnc2c(Nc3ccccc3)ncnc12
C(c1ccccc1)n1cnc2c(nc(nc12)N1CCOCC1)N1CCOCC1
Brc1ccc(Nc2nc(nc3n(Cc4ccccc4)cnc23)N2CCOCC2)cc1
C(c1ccccc1)n1cnc2c(Nc3ccccc3)nc(nc12)N1CCOCC1
C(c1ccccc1)n1cnc2c(Nc3ccccc3)nc(nc12)N1CCNCC1
COc1ccc(Nc2nc(nc3n(Cc4ccccc4)cnc23)N2CCOCC2)cc1
COc1ccc(Nc2nc(nc3n(Cc4ccccc4)cnc23)N2CCNCC2)cc1
Cc1cccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)c1
COc1ccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)cc1
COc1ccc(Cn2ncc(NC(=O)c3cc(NC(=O)Nc4ccc(Cl)c(c4)C(F)(F)F)ccc3C)c2N)cc1
CC(C)Cn1c2ccc(Nc3ncccn3)cc2c2c3CNC(=O)c3c3-c4cn(C)nc4CCc3c12
Fc1ccc(cc1)-c1cn(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl
NC(=O)[C@@H]1CCCNC(=O)[C@H](Cc2ccc(cc2)[N+]([O-])=O)NC(=O)[C@H](Cc2ccco2)NC(=O)[C@H](CC2CC2)NC(=O)\C=C\C(=O)N1 |r,t:45|
CSc1ccccc1Nc2c3c(c(ncn3)NCC4CC4)nc(n2)N5CCNCC5
COc1ccc2c(Oc3ccc(NC(=O)c4c(C)n(CC(C)(C)O)n(-c5ccccc5)c4=O)nc3)ccnc2c1
CC1=C(C(=O)N(N1C)c2ccccc2)C(=O)Nc3ccc(c(c3)F)Oc4ccnc5c4cc(c(c5)OC)OC
COc1ccc(cc1C)-c1nn(C(C)C)c2ncnc(N)c12
COC(=O)Nc1[nH]c2cc(ccc2n1)C(=O)c3ccccc3
c1ccc(cc1)C(=O)c2ccc3c(c2)n(c(n3)N)CC4CCNCC4
Nc1ncnc2n(CC3CCNCC3)nc(-c3ccc4ccccc4c3)c12
Nc1ncnc2n(CC3CCNCC3)nc(-c3cc4c(Cl)cccc4[nH]3)c12
CCCP(=O)(CCC)c1ccc(Nc2nc(nc3n(CC)cnc23)C(C)C)cc1
CCCCP(=O)(CCCC)c1ccc(Nc2nc(nc3n(CC)cnc23)C(C)C)cc1
CCn1cnc2c(Nc3ccc(cc3)P(C)(C)=O)nc(nc12)C(C)C
CCn1cnc2c(Nc3ccc(cc3)P(C)(C)=O)nc(NC3CCOCC3)nc12
Cc1cccc(C)c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)nc(nc12)-c1ccccn1
CP(C)(=O)c1ccc(Nc2nc(nc3n(C=C)cnc23)N2CCC(CO)CC2)cc1
CP(C)(=O)c1ccc(Nc2nc(OC3CCOC3)nc3n(C=C)cnc23)cc1
CCn1cnc2c(Nc3ccc(cc3)C(C)C)nc(nc12)C(C)C
CP(C)(=O)c1ccc(Nc2ncnc3n(C=C)cnc23)cc1
FC(F)(F)c1cccc(NC(=O)Nc2cccc(Nc3ccc4\C(=C\c5ccc[nH]5)C(=O)Nc4c3)c2)c1
CN1CCN(CC1)c1cc(cc(c1)C(F)(F)F)C(=O)Nc1cccc(Nc2ccc3\C(=C\c4cc(c[nH]4)C(O)=O)C(=O)Nc3c2)c1
Cc1cn(cn1)-c1cc(cc(c1)C(F)(F)F)C(=O)Nc1cccc(Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1
CN1CCN(CC1)c1cc(cc(c1)C(F)(F)F)C(=O)Nc1cccc(Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1
Cc1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
C[C@@H](Oc1cc(ccc1C(N)=O)-c1cc(cnc1N)-c1cc(CN(C)C)cs1)\C=C/C(F)(F)F |r|
CC(C)(N)C(=O)NCCn1ccc2ncnc(Nc3ccc(Oc4cccc5sncc45)c(Cl)c3)c12
Nc1nc2ccc(cc2n1CCC1CCNCC1)C(=O)c1ccccc1
CN1CCC(CCn2c(N)nc3ccc(cc23)C(=O)c2ccccc2)CC1
Nc1nc2ccc(cc2n1CC[C@@H]1CCCN1)C(=O)c1ccccc1 |r|
CN1CCN(CCn2c(N)nc3ccc(cc23)C(=O)c2ccccc2)CC1
NCCC(=O)Nc1nc2ccc(cc2n1CC1CCNCC1)C(=O)c1ccccc1
Nc1ncnn2ccc(C(=O)Nc3ccc(NC(=O)Nc4cccc(F)c4)cc3)c12
CCOC(=O)c1ccc(Nc2ncnc3cc4oc(=O)n(CCCN5CCOCC5)c4cc23)cc1
Oc1ccc(Nc2ncnc3cc4oc(=O)n(CCCN5CCOCC5)c4cc23)cc1
Cc1ccc(Nc2ncnc3cc4oc(=O)n(CCCN5CCOCC5)c4cc23)cc1
Nc1ncnc2n(CC3CCNCC3)nc(-c3ccc4ncccc4c3)c12
CCOc1ccc2cc(ccc2n1)-c1nn(CC2CCNCC2)c2ncnc(N)c12
CC(C)COc1ccc2cc(ccc2c1)-c1nn(c2ncnc(N)c12)C(C)(C)C
CC(C)n1nc(-c2ccc3cc(OCc4ccccc4Cl)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3cc(OCc4cccc(Cl)c4)ccc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3cc(OCc4ccc(Cl)cc4)ccc3c2)c2c(N)ncnc12
CCOc1ccc2cc(ccc2c1)-c1nn(C[C@H](C(C)C)N(C)C)c2ncnc(N)c12 |r|
CCOc1ccc2cc(ccc2c1)-c1nn(C[C@H]2CCCN2)c2ncnc(N)c12 |r|
CCOc1ccc2cc(ccc2c1)-c1nn(C[C@H]2CCCN2C)c2ncnc(N)c12 |r|
CCCN1CCC(CC1)n1nc(-c2ccc3cc(OCC)ccc3c2)c2c(N)ncnc12
CCOc1ccc2cc(ccc2c1)-c1nn(C2CCN(CCCN)CC2)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(C2CCN(CC2)C(C)=O)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(C2CCN(CC2)S(C)(=O)=O)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(CC2CCN(CC)CC2)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(CC2CCN(CC2)C(C)=O)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(CC2CCN(CC2)S(C)(=O)=O)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(CCC2CCNCC2)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(CCC2CCN(C)CC2)c2ncnc(N)c12
CCOc1ccc2cc(ccc2c1)-c1nn(CCC2CCN(CC)CC2)c2ncnc(N)c12
CCCN1CCC(CCn2nc(-c3ccc4cc(OCC)ccc4c3)c3c(N)ncnc23)CC1
COc1ccc(cc1)-c1nn(C(C)C)c2ncnc(N)c12
Nc1ncnc2n(CC3CCNCC3)nc(-c3cc4ccccc4[nH]3)c12
Cn1ncc2cc(ccc12)-c1nn(CC2CCNCC2)c2ncnc(N)c12
CC(C)n1nc(-c2cccc(C)c2)c2c(N)ncnc12
CCOc1ccc2cc(ccc2c1)-c1nn(C[C@@H](N)C(C)C)c2ncnc(N)c12 |r|
CCOc1ccc2cc(ccc2c1)-c1nn(CCC2CCN(CCCN)CC2)c2ncnc(N)c12
CC(C)(C(=O)NCCn1ccc2ncnc(Nc3ccc(Oc4cccc(Cl)c4)c(Cl)c3)c12)S(C)(=O)=O
CC(C)Oc1cc(n[nH]1)-n1cnc2ccc(N[C@@H](C)c3ccc(F)cn3)nc12 |r|
Cc1ccc(cc1N2c3c(c(ncn3)N)C4=C(C2=O)CCCC4)O
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1F
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1C
CN1CCN(CC1)c2ccc(cc2)Nc3ncc4c(n3)n(c(n4)Nc5ccccc5)C6CCCC6
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
CC(C)(C#N)Oc1cccc(c1Cl)C(=O)Nc2cc(ccc2F)N(C)c3ccc4c(n3)sc(n4)NC(=O)C5CC5
OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H]1O |r|
COc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |r|
COc1cccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1 |r|
Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |r|
Cc1cccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1 |r|
OC[C@H]1O[C@@H](Oc2ccc(cc2)-c2ccccc2)[C@H](O)[C@@H]1O |r|
OC[C@H]1O[C@H](Oc2ccc3ccccc3c2)[C@H](O)[C@@H]1O |r|
OC[C@H]1O[C@@H](Oc2ccc3ccccc3c2)[C@H](O)[C@@H]1O |r|
OC[C@H]1O[C@H](Oc2cccc3ccccc23)[C@H](O)[C@@H]1O |r|
OC[C@H]1O[C@@H](Oc2cccc3ccccc23)[C@H](O)[C@@H]1O |r|
CC(C)(C)Nc1c(Nc2ccnc(Nc3ccc(cc3)-c3ccncc3)n2)c(=O)c1=O
CC#CC(=O)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1
Brc1cccc(Nc2ncnc3ccc(NC(=O)[C@@H]4O[C@H]4CN4CCCCC4)cc23)c1 |r|
CN(C)CC=CC(=O)Nc1ccc2c(c1)c(ncn2)Nc3cccc(c3)Br
CC(C)n1nc(Cc2cccc(NS(=O)(=O)C=C)c2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3ccccc3)c12)[C@H](CO)c1ccccc1 |r|
N#Cc1ccc(cc1)-c1nc(Nc2cc([nH]n2)C2CC2)c2ccccc2n1
Clc1ccc2nc(nc(Nc3cc([nH]n3)C3CC3)c2c1)-c1cccc(c1)C#N
Clc1ccc2nc(nc(Nc3cc([nH]n3)C3CC3)c2c1)-c1ccc(cc1)C#N
N#Cc1cccc(c1)-c1nc(Nc2cc([nH]n2)C2CC2)c2ccccc2n1
CN(CCN(C)Cc1ccc(cc1)C(=O)Nc1ccc2ncnc(Nc3cccc(Cl)c3)c2c1)CCn1nc(-c2ccc(Cl)cc2)c2c(N)ncnc12
Cc1nc2NC(=O)Cc2c(C)c1O
CN1CCC(CC1)n1nc(C#Cc2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)c2c(N)ncnc12
NC1=NC(=O)\C(N1)=C1/CCNC(=O)c2[nH]c(Br)cc12 |t:1|
O=C(Nc1sc2N(CCCc2c1C#N)C(=O)C1CC1)c1cccc2ccccc12
O=C(Nc1sc2CCCCc2c1C#N)c1cccc2ccccc12
Nc1ncnc2n(cc(-c3ccccc3)c12)C1CC1
ClC(Cn1ncc2c(NCCc3ccccc3)ncnc12)c1ccccc1
CCN(CC)c1ncnc2n(CC(Cl)c3ccccc3)ncc12
CCCCNc1ncnc2n(CC(Cl)c3ccccc3)ncc12
ClC(Cn1ncc2c(ncnc12)N1CCCCC1)c1ccccc1
ClC(Cn1ncc2c(ncnc12)N1CCCCCC1)c1ccccc1
CNC(=O)CNCCOc1ccc(cc1)-n1cc(-c2cccc(OC)c2)c2c(N)ncnc12
COc1cccc(c1)-c1cn(-c2ccc(OCCn3ccnc3)cc2)c2ncnc(N)c12
OCCNCCOc1ccc(cc1)-n1cc(-c2cccc(O)c2)c2cncnc12
CCOC(=O)C[C@@H]1C[C@@H](CN1C(=O)OC(C)(C)C)n1cc(-c2ccccc2)c2c(N)ncnc12 |r|
CCOC(=O)C[C@@H]1C[C@@H](CN1C(=O)OC(C)(C)C)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12 |r|
CCOC(=O)C[C@@H]1C[C@@H](CN1)n1cc(-c2ccccc2)c2c(N)ncnc12 |r|
CCOC(=O)C[C@@H]1C[C@@H](CN1)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12 |r|
CC(C)(C)OC(=O)N1C[C@H](C[C@H]1CO)n1cc(-c2ccccc2)c2c(N)ncnc12 |r|
CC(C)(C)OC(=O)N1C[C@H](C[C@H]1CO)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12 |r|
Nc1ncnc2n(cc(-c3ccccc3)c12)[C@@H]1CN[C@H](CO)C1 |r|
Nc1ncnc2n(cc(-c3ccc(O)cc3)c12)[C@@H]1CN[C@H](CO)C1 |r|
CCOC(=O)C[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)n1cc(-c2ccccc2)c2c(N)ncnc12 |r|
CCOC(=O)C[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12 |r|
CCOC(=O)C[C@@H]1C[C@H](CN1)n1cc(-c2ccccc2)c2c(N)ncnc12 |r|
CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1CO)n1cc(-c2ccccc2)c2c(N)ncnc12 |r|
CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1CO)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12 |r|
Nc1ncnc2n(cc(-c3ccccc3)c12)[C@H]1CN[C@H](CO)C1 |r|
Nc1ncnc2n(cc(-c3ccc(O)cc3)c12)[C@H]1CN[C@H](CO)C1 |r|
Nc1ncnc2n(CC(CO)CO)cc(-c3ccccc3)c12
Nc1ncnc2n(CC(CO)CO)cc(-c3ccc(O)cc3)c12
COc1cccc(c1)-c1cn(CC(CO)CO)c2ncnc(N)c12
COc1ccccc1-c1cn(-c2ccccc2)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2ccc(CC(O)=O)cc2)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2ccc(CCN(C)C)cc2)c2ncnc(N)c12
COc1cccc(c1)-c1cn(-c2ccc(CCNCCO)cc2)c2ncnc(N)c12
COCCN(C)CCc1ccc(cc1)-n1cc(-c2cccc(OC)c2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)-c1ccc(OCCNCCO)cc1
CN(C)CCc1ccccc1-n1cc(-c2cccc(O)c2)c2c(N)ncnc12
Nc1ncnc2n(cc(-c3cccc(F)c3)c12)-c1ccc(OCCNCCO)cc1
Nc1ncnc2n(cc(-c3cccc(Cl)c3)c12)-c1ccc(OCCNCCO)cc1
COCCNCCOc1cccc(c1)-n1cc(-c2cccc(OC)c2)c2c(N)ncnc12
CCCNc1ncnc2n(CC(O)c3ccccc3)ncc12
OC(Cn1ncc2c(NCc3ccc(F)cc3)ncnc12)c1ccccc1
Nc1ncnc2n(cc(-c3ccc(O)cc3)c12)-c1ccc(OCCNCCO)cc1
COc1cccc(c1)-c1cn(-c2ccc(OCCNCCO)cc2)c2ncnc(N)c12
COCCNCCOc1cccc(c1)-n1cc(-c2cccc(O)c2)c2c(N)ncnc12
Nc1ncnc2n(CCC(CO)CO)cc(-c3ccccc3)c12
CCCNc1ncnc2n(CC(Cl)c3ccccc3)ncc12
ClC(Cn1ncc2c(NC3CCCCC3)ncnc12)c1ccccc1
CSc1nc(NC2CC2)c2cnn(CC(Cl)c3ccccc3)c2n1
OC(=O)c1cnc2n(\C=C\c3ccccc3)ncc2c1NCc1ccccc1
ClC(Cn1ncc2c(NC3CC3)ncnc12)c1ccccc1
CCOC(=O)C[C@@H]1C[C@H](CN1)n1cc(-c2ccc(O)cc2)c2c(N)ncnc12 |r|
c1cc(c(cc1C[C@H](C(=O)O)OC(=O)/C=C/c2ccc(c(c2)O)O)O)O
OC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)\C=C\c1ccc(O)c(O)c1\C=C\c1ccc(O)c(O)c1 |r|
OC(OC(Cc1ccc(O)c(O)c1)C(O)=O)C1C(Oc2cc(O)cc(\C=C\C(=O)OC(Cc3ccc(O)c(O)c3)C(O)=O)c12)c1ccc(O)c(O)c1
OC(C(OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O)C(O)=O
CCN1CCC(CC1)Nc1ccc2NC(=O)C(=C(c3ncc[nH]3)c3ccc(Cl)cc3)c2c1
COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)c(F)c3)ccnc2cc1OCCCN1CCCC1
c1cc(c(cc1Cl)CNc2ncc(c(n2)NC3CCCC3)C(=O)NCCCN4CCOC4=O)Cl
Clc1ccc(Cl)c(CNc2ncc(C(=O)NCCCN3CCCC3=O)c(NC3CCCC3)n2)c1
COc1ccccc1CNc2ncc(c(n2)NC3CCCC3)C(=O)NCCCN4CCCC4=O
COc1ccc(CCNc2ncc(C(=O)NCCCN3CCCC3=O)c(NC3CCCC3)n2)cc1OC
Oc1ccc(CCNC(=O)C(Cc2cc(Br)c(O)c(Oc3ccc(CCNC(=O)C(Cc4cc(Br)c(O)c(c4)-c4cc(CC(N=O)C(=O)NCCc5ccc(O)c(Br)c5)cc(Br)c4O)N=O)cc3Br)c2)N=O)cc1Br
Oc1ccc(CCNC(=O)C(Cc2cc(Br)c(O)c(c2)-c2cc(CC(N=O)C(=O)NCCc3ccc(O)c(Br)c3)cc(Br)c2O)N=O)cc1Br
Oc1c(Br)cc2CCNC(=O)C(Cc3ccc(Oc4cc(CC(N=O)C(=O)NC=Cc5ccc(Oc1c2)c(Br)c5)cc(Br)c4O)c(Br)c3)N=O |w:29.29|
CCCCn1c(cn2c1nc1n(C)c(=O)[nH]c(=O)c21)-c1cc(ccc1C)-c1cccc2[nH]ncc12
CCCCn1c(cn2c1nc1n(C)c(=O)[nH]c(=O)c21)-c1ccc(F)cc1C
CCCCn1c(cn2c1nc3c2C(=O)NC(=O)N3C)c4ccccc4C
COc1ccccc1-n1c(cn2c1nc1n(C)c(=O)[nH]c(=O)c21)-c1cc(O)ccc1C |(16.89,-42.99,;16.89,-41.45,;18.23,-40.68,;19.55,-41.45,;20.88,-40.68,;20.88,-39.14,;19.55,-38.38,;18.23,-39.15,;16.9,-38.38,;16.91,-36.84,;15.44,-36.35,;14.53,-37.6,;15.43,-38.85,;14.53,-40.09,;13.06,-39.61,;11.74,-40.37,;11.73,-41.91,;10.41,-39.61,;9.07,-40.38,;10.41,-38.07,;11.74,-37.29,;11.74,-35.75,;13.06,-38.07,;18.24,-36.06,;19.58,-36.83,;20.9,-36.05,;22.24,-36.81,;20.9,-34.51,;19.55,-33.75,;18.23,-34.53,;16.89,-33.77,)|
Cc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc(N)nc1)S(C)(=O)=O
CN1c2ccc(NCc3ccc(cc3)C(C)(C)C)cc2-c2c(cnn2C)S1(=O)=O
CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3cnn(C)c3-c2c1
CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3c[nH]nc3-c2c1
CNc1nc(C)c(s1)-c1nc(Nc2cccc(c2)N2CCCNCC2)ncc1C#N
[O-][N+](=O)c1ccccc1-c1n[nH]cc1C=C1C(=O)Nc2ccccc12 |w:14.15|
Nc1ccc2ncnc(Nc3ccc(NC(=O)Nc4ccc(Cl)c(c4)C(F)(F)F)cc3)c2c1
CC(C)(C)c1cc(NC(=O)Nc2cccc(Nc3ncnc4ccccc34)c2)n(n1)-c1cccc(N)c1
CC(C)(C)c1cc(NC(=O)Nc2cccc(Nc3ncnc4ccccc34)c2)n(n1)-c1cccc(c1)[N+]([O-])=O
CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4ccc(NC(=O)CCN5CCOCC5)cc34)cc2)n(n1)-c1cccc(N)c1
CN1CCN(CCC(=O)Nc2ccc3ncnc(Nc4ccc(NC(=O)Nc5cc(nn5-c5cccc(N)c5)C(C)(C)C)cc4)c3c2)CC1
CN(C)CCCC(=O)Nc1ccc2ncnc(Nc3ccc(NC(=O)Nc4cc(nn4-c4cccc(N)c4)C(C)(C)C)cc3)c2c1
CCC(=O)Nc1ccc2ncnc(Nc3ccc(NC(=O)Nc4cc(nn4-c4cccc(N)c4)C(C)(C)C)cc3)c2c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4ccc(N)cc34)cc2)n(n1)-c1cccc(NC(=O)OCC2c3ccccc3-c3ccccc23)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4ccccc34)cc2)n(n1)-c1cccc(N)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4ccc(N)cc34)cc2)n(n1)-c1cccc(N)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4ccccc34)cc2)n(n1)-c1cccc(c1)[N+]([O-])=O
CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4ccc(cc34)[N+]([O-])=O)cc2)n(n1)-c1cccc(c1)[N+]([O-])=O
CCN1CCN(CC1)c1ccc(cn1)-c1nn(CC2CCCC2)c2nc(NC)ncc12
CCN1CCN(CC1)c1ccc(cn1)-c1nn(Cc2cn(Cc3ccccc3)nn2)c2nc(NC)ncc12
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(nc1)N1CCN(C)CC1
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(cc1)N1CCN(C)CC1
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(nc1)N1CCN(CC1)C(=O)C(C)(C)C
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(nc1)N1CCN(C)CC1
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(nc1)N1CCNCC1
CNc1ncc2c(nn(CC3OCCO3)c2n1)-c1ccc(OC)cc1
CNc1ncc2c(nn(CC3OCCO3)c2n1)-c1ccc(nc1)N1CCNCC1
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(nc1)N1CCN(CC1)C(=O)C(C)(C)C
Nc1nc(Nc2ccc3CC[C@@H](CCc3c2)N2CCCC2)nn1-c1cc2CCCc3ccccc3-c2nn1 |r|
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(cc1)N1CCNCC1
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(nc1)N1CCNCC1
CNc1ncc2c(nn(Cc3cn(nn3)-c3ccsc3C(=O)OC)c2n1)-c1ccc(nc1)N1CCNCC1
O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
CN1CCN(CCCOc2cccc(CC(=O)Nc3nc(cs3)-c3c[nH]c4ncccc34)c2)CC1
CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1
O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12
CCn1cc(-c2ccc3N(CCc3c2)C(=O)Cc2cccc(OC(F)(F)F)c2)c2c(N)ncnc12
CC(Cn1ncc2c(Nc3cc(O)ccc3Cl)nc(SCCN3CCOCC3)nc12)c1ccccc1
CC(Cn1ncc2c(Nc3cc(O)ccc3Cl)nc(NCCO)nc12)c1ccccc1
OCCNc1nc(Nc2cc(O)ccc2Cl)c2cnn(CC(Cl)c3ccccc3)c2n1
CC(Cn1ncc2c(Nc3cc(O)ccc3Cl)nc(NCCN)nc12)c1ccccc1
CSc1nc(Nc2cc(O)ccc2Cl)c2cnn(CC(Cl)c3ccccc3)c2n1
Oc1ccc(Cl)c(Nc2ncnc3n(CC(Cl)c4ccccc4)ncc23)c1
CSc1nc(Nc2cc(O)ccc2Cl)c2cnn(CC(C)c3ccccc3)c2n1
Oc1ccc(Cl)c(Nc2nc(SCCN3CCOCC3)nc3n(CC(Cl)c4ccccc4)ncc23)c1
CC(Cn1ncc2c(Nc3cccc(O)c3)nc(NCCO)nc12)c1ccccc1
Oc1cccc(Nc2nc(SCCN3CCOCC3)nc3n(CC(Cl)c4ccccc4)ncc23)c1
CC(Cn1ncc2c(Nc3cc(O)ccc3Cl)ncnc12)c1ccccc1
CSc1nc(Nc2cccc(O)c2)c2cnn(CC(C)c3ccccc3)c2n1
CNC(=O)c1cccc2cc(Oc3ccnc(NC(=O)c4ccc(cc4)N4CCN(C)CC4)c3)ccc12
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCCc2cc(OCC3CCCCC3)c(cc12)C(N)=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCCOc2cc(OCC3CCCCC3)c(cc12)C(N)=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H]1CCCOc2cc(OCC3CCCCC3)c(cc12)C(N)=O
CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H]1CCCCc2cc(OCC3CCCCC3)c(cc12)C(N)=O
C[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)c1ccc(OCC2CCCCC2)c(c1)C(N)=O
Cc1cc(O)cc2oc(=O)c3c(O)cc(O)cc3c12
COc1cc2c(C(=O)OC22C(C)CC(=O)C2=O)c(O)c1
COc1cc(O)c2c(c1)-c1cc(O)c(O)cc1COC2=O
Cc1cc(O)c(O)cc1-c1cc(O)cc(O)c1C(O)=O
COc1cc(O)c2c(c1)c1c(C)cc(O)cc1oc2=O
COc1cc(O)c2c(c1)c1c(C)cc(O)c(O)c1oc2=O
COc1cc(O)c(C(O)=O)c(c1)C1=C(C)C[C@@H](O)C1=O |r,wD:16.17,c:13,(10.48,-22.79,;11.26,-21.46,;10.49,-20.12,;11.26,-18.8,;10.49,-17.47,;11.26,-16.14,;8.97,-17.47,;8.2,-16.14,;8.96,-14.8,;6.65,-16.13,;8.21,-18.79,;8.97,-20.12,;6.66,-18.79,;5.76,-17.54,;4.98,-16.2,;4.29,-18.01,;4.29,-19.55,;3.04,-20.45,;5.75,-20.03,;6.22,-21.5,)|
Cc1cc(O)cc2oc(=O)c3c(O)cc(OS(O)(=O)=O)cc3c12
[H][C@]12[C@@H](O)CC(=O)c3c(O)ccc(-c4ccc(O)c5C(=O)CC[C@]1(O)c45)c23 |r|
COc1cc(O)c(C(O)=O)c(c1)-c1cc(O)c(O)cc1C
COc1cc(O)c2C(=O)C3=C([C@@H](O)[C@](C)(O)[C@H](O)[C@H]3O)C(=O)c2c1-c1c(O)c2C(=O)c3cc(O)c(C)cc3C(=O)c2cc1OC |r,wU:18.19,11.11,13.13,wD:16.16,t:9,(-6.62,-6.52,;-5.29,-5.75,;-3.96,-6.52,;-3.96,-8.06,;-2.63,-8.83,;-2.63,-10.37,;-1.3,-8.07,;.04,-8.83,;.05,-10.37,;1.38,-8.06,;1.38,-6.5,;2.72,-5.72,;2.71,-4.19,;4.06,-6.5,;4.82,-5.16,;5.38,-7.27,;4.07,-8.06,;5.4,-8.82,;2.72,-8.83,;2.72,-10.37,;.03,-5.73,;.02,-4.19,;-1.3,-6.52,;-2.63,-5.75,;-2.6,-3.5,;-1.27,-2.73,;.06,-3.5,;-1.26,-1.19,;.06,-.41,;1.4,-1.16,;.05,1.13,;1.37,1.91,;1.36,3.45,;2.68,4.23,;.01,4.21,;-.01,5.74,;-1.31,3.42,;-1.29,1.89,;-2.62,1.11,;-3.96,1.87,;-2.6,-.43,;-3.93,-1.19,;-3.93,-2.74,;-5.26,-3.5,;-6.59,-2.73,)|
COc1cc(O)c2C(=O)c3cc(O)c(C)cc3C(=O)c2c1
COc1cc(O)c2C(=O)c3c(O)c(O)c(C)cc3C(=O)c2c1
COc1cc(O)c2C(=O)C3=C([C@@H](O)[C@](C)(O)[C@H](O)[C@H]3O)C(=O)c2c1 |r,t:9|
CC(C)N(Cc1cn2cccc(C)c2n1)Cc1nc2ccccc2c(=O)[nH]1
Cc1nc[nH]c1[C@@H]1N(Cc2nc3ccccc3[nH]2)CCc2[nH]cnc12 |r|
Cc1nc[nH]c1[C@H]1N(Cc2nc3ccccc3[nH]2)CCc2[nH]cnc12 |r|
OC(=O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
CC(C)n1c(C)nc2c(F)cc(cc12)-c1nc(Nc2ccc3CN(CCN(C)C)CCc3n2)ncc1F
Cc1c(oc2ccc(C)cc12)-c1n(nc2c1c(N)n[nH]c2=O)-c1ccc(NC(=O)C=C)cc1 |(12.65,-38.72,;11.4,-37.83,;9.94,-38.31,;9.03,-37.07,;9.93,-35.82,;9.6,-34.32,;10.73,-33.29,;12.2,-33.76,;13.34,-32.72,;12.53,-35.26,;11.39,-36.29,;9.47,-39.77,;10.38,-41.01,;9.48,-42.26,;8.02,-41.79,;8.01,-40.26,;6.68,-39.48,;6.68,-37.94,;5.35,-40.26,;5.35,-41.8,;6.68,-42.56,;6.68,-44.1,;11.92,-41,;12.69,-42.33,;14.23,-42.32,;15,-40.98,;16.54,-40.97,;17.3,-39.63,;16.52,-38.3,;18.84,-39.62,;19.6,-38.28,;14.21,-39.65,;12.67,-39.66,)|
Cc1c(oc2ccc(C)cc12)-c1n(nc2c1c(N)n[nH]c2=O)-c1ccc(CNC(=O)C=C)cc1 |(28.79,-8.39,;27.54,-7.5,;26.08,-7.98,;25.16,-6.74,;26.06,-5.49,;25.74,-3.99,;26.87,-2.96,;28.34,-3.43,;29.48,-2.39,;28.66,-4.93,;27.53,-5.96,;25.61,-9.44,;26.52,-10.68,;25.62,-11.92,;24.16,-11.46,;24.15,-9.93,;22.82,-9.15,;22.82,-7.61,;21.49,-9.93,;21.49,-11.47,;22.82,-12.23,;22.82,-13.77,;28.05,-10.67,;28.83,-12,;30.37,-11.99,;31.13,-10.65,;32.67,-10.64,;33.45,-11.97,;34.99,-11.96,;35.75,-10.62,;35.77,-13.29,;37.31,-13.28,;30.35,-9.32,;28.81,-9.33,)|
[H][C@]12C[C@@H](NCCOCCOCCOCCNC(=O)CCC3=[N+]4C(C=C3)=Cc3c(C)cc(C)n3[B-]4(F)F)[C@@H](OC)[C@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r,c:24,26,t:21|
[H][C@]12C[C@H]([C@@H](OC)[C@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)CCOCCOCCOCCNC(=O)CCC1=[N+]2C(C=C1)=Cc1c(C)cc(C)n1[B-]2(F)F |r,c:63,65,t:60|
CCN1CCN(CCCOc2cc3nccc(Oc4c(F)cc(NC(=O)NN5C(SCC5=O)c5c(F)cccc5F)cc4F)c3cc2OC)CC1
CN1CCC(CC1)Nc1ccc(cc1)C(=O)Nc1cc(n[nH]1)-c1cc(cs1)C#N
COc1cc2cn[nH]c2cc1-c1ccc(F)c2c(N)c(cnc12)C(N)=O
CN(CCc1ccc(cc1)-c1ccccc1)Cc1cn(C)c2ccc(cc12)C(=O)Nc1ccc(F)cc1
Cc1nc2cc3nc(cnc3cc2n1C)-c1cccs1
COc1cc2ncnc3Nc4cc(Br)ccc4CN(C)CCCCCOc1cc23
Nc1ncnc2n(C[C@H]3CCCN3C[C@@H]3CO3)cc(-c3ccc(Oc4ccccc4)cc3)c12 |r|
Cc1nc(Nc2ncc(s2)-c2ccccc2)cc(n1)N1CCN(CCO)CC1
CN1CCN(CC1)c1ccccc1Nc1ncc(C(=O)Nc2c(C)cccc2Cl)c(Nc2ccccc2NC(=O)C=C)n1
CN1CCN(CC1)C1CCN(CC1)c1ccc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)c(Nc3ccccc3NC(=O)C=C)n2)cc1
COc1cc(ccc1Nc1ncc(C(=O)Nc2c(C)cccc2Cl)c(Nc2ccccc2NC(=O)C=C)n1)N1CCOCC1
COc1cc(ccc1Nc1ncc(C(=O)Nc2c(C)cccc2Cl)c(Nc2ccccc2NC(=O)C=C)n1)N1CCN(C)CC1
Nc1n[nH]c2cc(ccc12)-c1ccc(cc1)C(=O)NCCNC(=O)c1ccc(Cl)c(c1)C(F)(F)F
Fc1cccc(CNC(=O)Cc2ccc(cn2)-c2ccccc2)c1
Fc1cccc(CNC(=O)Cc2ccc(cn2)-c2ccc(OCCN3CCOCC3)cc2)c1
Fc1cccc(CNC(=O)Cc2ccc(cn2)-c2ccc(cc2)N2CCOCC2)c1
Fc1cccc(CNC(=O)Cc2ccc(cc2)-c2ccccc2)c1
COc1cc2c(Oc3ccc(NS(=O)(=O)c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Oc3ccc(NS(=O)(=O)c4cc(F)ccc4F)cc3F)ccnc2cc1OCCCN1CCCC(C)C1
COc1cc2c(Oc3ccc(NS(=O)(=O)c4cc(F)ccc4F)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Oc3ccc(NS(=O)(=O)c4ccccc4OC(F)(F)F)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Oc3ccc(NS(=O)(=O)c4c(F)cccc4F)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Oc3ccc(NS(=O)(=O)c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCOCC1
COc1cc2c(Oc3ccc(NS(=O)(=O)c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCC(C)CC1
C[C@H]1Oc2cc(Cc3c(CN(C)C(=O)c4ccc(F)cc14)nn(C)c3C#N)cnc2N |r|
CN(C)c1ccc(cc1)C(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)occc3=O)c1
CCN1CCN(CC1)c1cc(Nc2ncc(s2)-c2ccncc2)nc(C)n1
COc1cc(C)cc2cc(sc12)-c1cn([C@H]2CCN(C2)C(=O)C=C)c2ncnc(N)c12 |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ccc(Cl)cc2)cc1)[C@@H]1CCCN(C1)C(=O)C=C |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ccc(F)cc2F)cc1)[C@@H]1CCCN(C1)C(=O)\C=C\CF |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2cccc(n2)C(F)(F)F)cc1)[C@@H]1CCCN(C1)C#N |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ccc(Cl)cn2)cc1)[C@@H]1CCCN(C1)C#N |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ccc(Cl)cc2)cc1)[C@@H]1CCCN(C1)C#N |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ccc(F)cc2F)cc1)[C@@H]1CCCN(C1)C(=O)\C=C\C(F)F |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ccc(F)cc2F)cc1)[C@@H]1CCCN(C1)C(=O)\C=C\CO |r|
C\C=C\C(=O)N1CCC[C@H](C1)n1nc(c(C(N)=O)c1N)-c1ccc(Oc2ccc(F)cc2F)cc1 |r|
CC(=C)C(=O)N1CCC[C@H](C1)n1nc(c(C(N)=O)c1N)-c1ccc(Oc2ccc(F)cc2F)cc1 |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ccc(F)cc2F)cc1)[C@@H]1CCCN(C1)C(=O)C=C |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ncc(Cl)cc2F)cc1)[C@@H]1CCCN(C1)C#N |r|
CN(C)C\C=C\C(=O)N1CCC[C@H](C1)n1nc(c(C(N)=O)c1N)-c1ccc(Oc2ccc(F)cc2F)cc1 |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ccc(F)cc2F)cc1)[C@@H]1CCCN(C1)C(=O)C(F)=C |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ccc(F)cc2F)cc1)[C@@H]1CCCN(C1)C#N |r|
NC(=O)c1c(N)n(nc1-c1ccc(Oc2ccccc2)cc1)[C@@H]1CCCN(C1)C#N |r|
COc1cc2c(Oc3ccc(cc3F)C3SCC(=O)N3NC(=O)Nc3ccc(F)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
COc1ccccc1\C=C\c1nc(Nc2ccc3OCOc3c2)c2ccccc2n1
Oc1cccc(Nc2nc(\C=C\c3cc4OCOc4cc3Br)nc3ccccc23)c1
Oc1cccc(Nc2nc(\C=C\c3cccc(c3)[N+]([O-])=O)nc3ccccc23)c1
COc1ccccc1\C=C\c1nc2ccccc2c(=O)[nH]1
COc1cc(ccc1OCc2ccc(cc2)C3CC3)C4CN(C4)C(=O)c5cc(ccn5)COC[C@H](CO)O
c1ccc(cc1)C[C@H]2C(=O)N[C@H](C(=O)NCC[C@H](NC(=O)C=CC(=O)N[C@H](C(=O)N2)CC3CCCCC3)C(=O)O)CCCNC(=O)c4cnccn4
Cc1c(cccc1-n1cnc2ccccc2c1=O)-c1ccc(C(O)=N)c2[nH]c3cc(ccc3c12)C(C)(C)O
CCOc1ccc2cc(ccc2c1)-c1nn(CC2CN(C)C2)c2ncnc(N)c12
CN1CCC(Cn2nc(-c3ccc4cc(OCC(C)(C)O)ccc4c3)c3c(N)ncnc23)CC1
Nc1ncnc2n(CC3CCOCC3)nc(-c3ccc4cc(OC5CC5)ccc4c3)c12
CCOc1ccc2cc(ccc2c1)-c1nn(CC2CN(C2)C(C)=O)c2ncnc(N)c12
CC(C)(CO)Cn1nc(-c2ccc3cc(OC4CC4)ccc3c2)c2c(N)ncnc12
CCOc1ccc2cc(ccc2c1)-c1nn(CC2CNC2)c2ncnc(N)c12
CN1CCC(Cn2nc(-c3ccc4cc(OC5CCC5)ccc4c3)c3c(N)ncnc23)CC1
CN1CCC(Cn2nc(-c3ccc4cc(OC5CC5)ccc4c3)c3c(N)ncnc23)CC1
COCCOc1ccc2cc(ccc2c1)-c1nn(CC2CCN(C)CC2)c2ncnc(N)c12
CCOc1ccc2cc(ccc2n1)-c1nn(CC2CCN(C)CC2)c2ncnc(N)c12
CN(C)CC(C)(C)Cn1nc(-c2ccc3nc(OC4CC4)ccc3c2)c2c(N)ncnc12
CCOc1ccc2cc(ccc2c1)-c1nn(CC(C)C)c2ncnc(N)c12
CC1(Cn2nc(-c3ccc4cc(OC5CC5)ccc4c3)c3c(N)ncnc23)COC1
CC1(Cn2nc(-c3ccc4nc(OC5CC5)ccc4c3)c3c(N)ncnc23)COC1
Nc1ncnc2n(CC3CCOCC3)nc(-c3ccc4nc(OC5CC5)ccc4c3)c12
CCOc1ccc2cc(ccc2c1)-c1nn(CC(C)(C)O)c2ncnc(N)c12
CCOc1ccc2cc(ccc2n1)-c1nn(CC(C)(C)O)c2ncnc(N)c12
CC(C)(O)Cn1nc(-c2ccc3nc(OC4CC4)ccc3c2)c2c(N)ncnc12
CC(C)(CO)Cn1nc(-c2ccc3nc(OC4CC4)ccc3c2)c2c(N)ncnc12
CN1CCC(Cn2nc(-c3ccc4cc(OCC5CC5)ccc4c3)c3c(N)ncnc23)CC1
CN1CCC(Cn2nc(-c3ccc4cc(OC5COC5)ccc4c3)c3c(N)ncnc23)CC1
CC(C)Cn1nc(-c2ccc3nc(OC4CC4)ccc3c2)c2c(N)ncnc12
CCOc1ccc2cc(ccc2c1)-c1nn(CC2CCOCC2)c2ncnc(N)c12
CC(C)(O)Cn1nc(-c2ccc3cc(OC4CC4)ccc3c2)c2c(N)ncnc12
Nc1ncnc2n(CC(O)(C(F)(F)F)C(F)(F)F)nc(-c3ccc4cc(OC5CC5)ccc4c3)c12
CCOc1ccc2cc(ccc2c1)-c1nn(CC2CCN(CC2)C(C)C)c2ncnc(N)c12
CC(C)Cn1nc(-c2ccc3cc(OC4CC4)ccc3c2)c2c(N)ncnc12
CC(C)(CO)Cn1nc(-c2ccc3nc(OCC(F)(F)F)ccc3c2)c2c(N)ncnc12
CN1CCC(Cn2nc(-c3ccc4nc(OC5CC5)ccc4c3)c3c(N)ncnc23)CC1
CCOc1ccc2cc(ccc2n1)-c1nn(CC2CCOCC2)c2ncnc(N)c12
C[C@@H](c1cc2cccnc2cc1F)n1cnc2ncc(nc12)-c1cnn(C)c1 |r|
Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)N[C@@H]1CCCC[C@@H]1N |r|
Cc1sc(cc1-c1cnn2cc(Cl)cnc12)C(=O)N[C@@H]1[C@H](N)CCCC1(F)F |r|
FC(F)(F)CNC(=O)c1cc(cs1)-c1cnn2cc(cnc12)-c1ccc(OCCN2CCCCC2)cc1
Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)NCC(F)(F)F
C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|
Cc1ccc(cc1C#Cc1cnc2cccnn12)C(=O)Nc1ccc(CN2CCC3C=NNC3C2)c(Cl)c1 |c:33|
Cc1ccc(cc1C#Cc1cnc2cccnn12)C(=O)Nc1ccc(CN2Cc3cn[nH]c3C2)c(Cl)c1
COc1ccc(cc1OC)-c1cnn2c(N)c(-c3ccccc3)c(OC3CCN(C)CC3)nc12
COC(=O)Nc1ccc(cc1)-c1c(OC2CCN(C)CC2)nc2c(cnn2c1N)-c1ccc(OC)c(OC)c1
COc1ccc(cc1OC)-c1cnn2c(N)c(-c3nccs3)c(OC3CCN(C)CC3)nc12
Nc1ncnc2n(nc(Oc3cc(ccn3)C(F)(F)F)c12)C1CC1
Nc1ncnc2n(nc(Oc3cc(ccn3)C(F)(F)F)c12)[C@@H]1CCCC[C@H]1O |r|
Nc1ncnc2n(nc(Oc3cc(ccn3)C#N)c12)[C@H]1C[C@H](F)C1 |r,wU:19.21,wD:21.24,(4.07,-26.23,;4.07,-27.77,;2.74,-28.54,;2.74,-30.08,;4.08,-30.85,;5.42,-30.07,;6.89,-30.54,;7.79,-29.29,;6.87,-28.04,;7.34,-26.58,;8.84,-26.25,;9.3,-24.78,;10.8,-24.45,;11.85,-25.59,;11.38,-27.06,;9.87,-27.39,;11.25,-22.99,;11.72,-21.52,;5.41,-28.53,;7.38,-32,;8.75,-32.69,;8.06,-34.07,;8.55,-35.53,;6.68,-33.38,)|
Cc1ccc(cc1C#Cc1cnc2cccnn12)C(=O)Nc1ccc(CN2CCN(CC2)C(=O)CCCc2cn(CCOCCOCCOCCNc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)nn2)c(c1)C(F)(F)F
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3c(C)ccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
CN1CCN(CC1)c1cccc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)c1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)cc(c1)-c1cc(C)no1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)cc(c1)N1CCOCC1
Cc1cn(cn1)-c1cc(CN2CCCC[C@H]2C(N)=O)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)c1 |r|
Cc1cn(cn1)-c1cc(CN2CCCC[C@H]2C(O)=O)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)c1 |r|
Cc1cn(cn1)-c1cc(CN2CCC[C@H](N)C2)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)c1 |r|
CCCCc1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)cc(c1)-n1cnc(C)c1
Cc1cn(cn1)-c1cc(CCS(N)(=O)=O)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)c1
Cc1cn(cn1)-c1cc(CCC(O)=O)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)c1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)cc(\C=C\C(O)=O)c1
CN1CCN(Cc2cc(NC(=O)c3ccc(C)c(Nc4nccc(n4)-c4ccccc4)c3)cc(c2)-n2cnc(C)c2)CC1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)cc(c1)-n1cnc(C)c1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)cc(c1)N1CCNCC1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)cc(c1)C(F)(F)F
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)cc(c1)C(F)(F)F
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)cc2)cc(c1)-n1cnc(C)c1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)cc(c1)-n1cnc(C)c1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(Oc3cccc4ccncc34)c2)cc(c1)-n1cnc(C)c1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(c2)C(=O)c2cccc(c2)C#N)cc(c1)-n1cnc(C)c1
Cc1cn(cn1)-c1cc(CN2CCC[C@H](N)C2)cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)c1 |r|
CCn1c2ccccc2c2cc(\C=N\OC)ccc12
CCn1c2ccccc2c2cc(\C=N\OCCO\N=C\c3ccc(O)c(O)c3)ccc12
CCOc1ccc2cc(ccc2c1)-c1nn(CC2CC2)c(N)c1C(N)=O
CC(C)(C)n1nc(c(C(N)=O)c1N)-c1ccc2cc(OCC#C)ccc2c1
CC(C)(C)n1nc(c(C(N)=O)c1N)-c1ccc2cc(OC3CC3)ccc2c1
CC(C)(CO)n1nc(c(C(N)=O)c1N)-c1ccc2cc(OC3CC3)ccc2c1
CC(C)(CO)n1nc(c(C(N)=O)c1N)-c1ccc2nc(OC3CC3)ccc2c1
CC(C)(CO)n1nc(c(C(N)=O)c1N)-c1cnc2cc(OC3CC3)ccc2c1
CCOc1ccc2cc(ccc2c1)-c1nn(c(N)c1C(N)=O)C(C)(C)CO
CCOc1ccc2cc(ccc2n1)-c1nn(c(N)c1C(N)=O)C(C)(C)CO
CCOc1ccc2cc(cnc2c1)-c1nn(c(N)c1C(N)=O)C(C)(C)CO
CC(C)(CCO)n1nc(c(C(N)=O)c1N)-c1ccc2cc(OC3CC3)ccc2c1
CC(C)(CCO)n1nc(c(C(N)=O)c1N)-c1ccc2nc(OC3CC3)ccc2c1
CC(C)(CCO)n1nc(c(C(N)=O)c1N)-c1cnc2cc(OC3CC3)ccc2c1
CCOc1ccc2cc(ccc2c1)-c1nn(c(N)c1C(N)=O)C(C)(C)CCO
CCOc1ccc2cc(ccc2n1)-c1nn(c(N)c1C(N)=O)C(C)(C)CCO
CCOc1ccc2cc(cnc2c1)-c1nn(c(N)c1C(N)=O)C(C)(C)CCO
CC(CCO)n1nc(c(C(N)=O)c1N)-c1ccc2cc(OC3CC3)ccc2c1
CC(CCO)n1nc(c(C(N)=O)c1N)-c1ccc2nc(OC3CC3)ccc2c1
CC(CCO)n1nc(c(C(N)=O)c1N)-c1cnc2cc(OC3CC3)ccc2c1
CCOc1ccc2cc(ccc2c1)-c1nn(C(C)CCO)c(N)c1C(N)=O
CCOc1ccc2cc(ccc2n1)-c1nn(C(C)CCO)c(N)c1C(N)=O
CCOc1ccc2cc(cnc2c1)-c1nn(C(C)CCO)c(N)c1C(N)=O
CC(C)(CO)Cn1nc(c(C(N)=O)c1N)-c1ccc2cc(OC3CC3)ccc2c1
CC(C)(CO)Cn1nc(c(C(N)=O)c1N)-c1ccc2nc(OC3CC3)ccc2c1
CC(C)(CO)Cn1nc(c(C(N)=O)c1N)-c1cnc2cc(OC3CC3)ccc2c1
CCOc1ccc2cc(ccc2c1)-c1nn(CC(C)(C)CO)c(N)c1C(N)=O
Cc1nc(NC(=O)NCCc2cn(CC(F)F)cn2)sc1C#Cc1cccnc1
COc1cc(cnc1OC)C#Cc1sc(NC(=O)NCCOCC2CC2)nc1C
Cc1nc(NC(=O)NCCOCC2CC2)sc1C#Cc1ccc2cncn2c1
C[C@@H](CNC(=O)Nc1nc(C)c(s1)C#Cc1cncc(C)c1)OCC1CC1 |r|
C[C@@H](CNC(=O)Nc1nc(C)c(s1)C#Cc1cnc(C)c(C)c1)OCC1CC1 |r|
C#Cc1nc(Nc2ccccc2)nc2[nH]cnc12
COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)cc3)ccnc2cc1OC1CCN(CC1)C(=O)NC(C)C
C[C@H](c1nnc2sc(nn12)-c1cnn(C)c1)c1ccc2ncccc2c1 |r|
C[C@H]1CC[C@H](CN1C(=O)C1CC1)c1nc(-c2ccc(cc2F)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
CC1(COC1)C(=O)N1CCC[C@H](C1)c1nc(-c2ccc(cc2F)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
Nc1ncnc2n(CC3CCN(CC3)C(=O)C=C)cc(-c3ccc4OCOc4c3)c12
[H][C@]12COC(=O)N1C[C@@H](CC2)c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
Nc1nccn2c(nc(-c3ccc(cc3)C(=O)Nc3cc(ccn3)C(F)(F)F)c12)[C@@H]1CC[C@H]2CCC(=O)N2C1 |r|
CC1(C)OC(=O)N2C[C@@H](CC[C@@H]12)c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r|
COc1cc(ccc1-c1nc([C@@H]2CC[C@H]3CCC(=O)N3C2)n2ccnc(N)c12)C(=O)Nc1cc(ccn1)C(F)(F)F |r|
Nc1nccn2c(nc(-c3ccc(cc3OC3CC3)C(=O)Nc3cc(ccn3)C(F)(F)F)c12)[C@@H]1CC[C@H]2CCC(=O)N2C1 |r|
Cc1ccc(NC(=O)c2ccc(C)c(c2)C(F)(F)F)cc1C#Cc1nn([C@H]2CC[C@H](O)CC2)c2ncnc(N)c12 |r,wU:26.27,wD:29.31,(-5.46,5.4,;-3.98,5.8,;-3.58,7.29,;-2.09,7.69,;-1,6.6,;.49,7,;1.57,5.91,;1.18,4.42,;3.06,6.31,;3.46,7.79,;4.95,8.19,;6.04,7.1,;7.53,7.5,;5.64,5.62,;4.15,5.22,;6.73,4.53,;8.22,4.93,;6.33,3.04,;7.82,3.44,;-1.4,5.11,;-2.89,4.71,;-3.29,3.22,;-3.68,1.74,;-4.08,.25,;-3.18,-1,;-4.08,-2.24,;-3.68,-3.73,;-2.2,-4.13,;-1.8,-5.62,;-2.89,-6.7,;-2.49,-8.19,;-4.38,-6.31,;-4.77,-4.82,;-5.55,-1.77,;-6.88,-2.54,;-8.22,-1.77,;-8.22,-.23,;-6.88,.54,;-6.88,2.08,;-5.55,-.23,)|
Fc1ccc2NC(=O)C(=C3/Nc4ccccc4/C/3=NOCCN3CCNCC3)c2c1
C=CC(=O)Nc1cccc(Nc2ncnc(Nc3ccc(cc3)C(=O)N3CCCCC3)n2)c1
Nc1n[nH]c2cccc(C#Cc3cccc(NC(=O)c4ccc(N5CCOCC5)c(c4)C(F)(F)F)c3)c12
Cc1cc(Oc2ccccc2)ccc1-n1c2ccnc3sc(C(=O)N[C@@H]4CCN(C4)C(=O)C=C)c([nH]c1=O)c23 |r,wD:25.26,(-1,4.5,;-2.28,3.77,;-3.62,4.54,;-4.95,3.77,;-6.28,4.54,;-7.62,3.77,;-8.95,4.54,;-10.28,3.77,;-10.28,2.23,;-8.95,1.46,;-7.62,2.23,;-4.95,2.23,;-3.62,1.46,;-2.28,2.23,;-.95,1.46,;-.95,-.08,;-2.28,-.85,;-2.28,-2.39,;-.95,-3.16,;.39,-2.39,;1.85,-2.87,;2.76,-1.62,;4.29,-1.65,;5.09,-.33,;5.04,-3,;6.58,-3,;7.49,-1.75,;8.95,-2.23,;8.95,-3.77,;7.49,-4.24,;10.28,-4.54,;10.28,-6.08,;11.62,-3.77,;11.62,-2.23,;1.72,-.08,;1.72,1.46,;.39,2.23,;.39,3.77,;.39,-.85,)|
COc1cc(Nc2nc(NCc3cccc(NC(=O)CCl)c3)n3ccnc3c2C(N)=O)cc(OC)c1
CC(C)n1nc(C)c(c1C)-c1nc2c(ccnc2[nH]1)-c1ccc2[C@@H](CCCCc2c1)NC(=O)c1nc(no1)C(C)(C)C |r|
CC(C)n1cc(C(=O)Nc2ccc(Oc3ccnc(NC(=O)C4CC4)c3)c(F)c2)c(=O)n(-c2ccc(F)cc2)c1=O
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)[C@@H]1C[C@H](CO)C1 |r,wU:17.19,19.22,(11.65,-9.07,;11.66,-10.61,;12.99,-11.37,;13,-12.92,;11.66,-13.69,;10.32,-12.92,;8.86,-13.4,;7.95,-12.16,;8.85,-10.91,;8.37,-9.46,;6.87,-9.15,;6.38,-7.69,;7.41,-6.53,;8.92,-6.85,;9.95,-5.7,;9.4,-8.31,;10.32,-11.38,;8.4,-14.88,;7.03,-15.58,;7.73,-16.95,;7.26,-18.42,;8.3,-19.56,;9.1,-16.25,)|
CC(=O)N1CCN(CC1)[C@H]1C[C@H](C1)n1cc(-c2cc(O)ccc2F)c2c(N)ncnc12 |r,wU:11.14,9.9,(5.38,-23.19,;6.89,-22.87,;7.92,-24.01,;7.36,-21.4,;6.33,-20.26,;6.8,-18.8,;8.31,-18.48,;9.35,-19.61,;8.87,-21.08,;8.78,-17.01,;8.08,-15.64,;9.45,-14.94,;10.15,-16.31,;9.91,-13.47,;9,-12.23,;9.9,-10.98,;9.42,-9.52,;10.45,-8.37,;9.97,-6.91,;11,-5.76,;8.46,-6.59,;7.43,-7.75,;7.92,-9.21,;6.9,-10.36,;11.37,-11.45,;12.7,-10.67,;12.7,-9.13,;14.04,-11.43,;14.05,-12.98,;12.71,-13.76,;11.37,-12.99,)|
CC(C)n1cc(C(=O)Nc2cc(F)c(cc2F)-c2c[nH]c3ncnc(N)c23)c(=O)c(c1)-c1ccc(F)cc1
CCN1CCN(CC1)c1ccc(Nc2ncc3scc(-c4cccc(NS(C)(=O)=O)c4)c3n2)cc1
Cc1ccc(cc1C#Cc1cc(cnc1N)-c1cnn(C)c1)C(=O)Nc1ccc(Cl)cc1Cl
Cc1ccc(cc1C#Cc1cc(cnc1N)-c1cnn(C)c1)C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
Cc1n[nH]c2ccc(cc12)-c1cc(N[C@@H](CO)c2ccccc2)cnc1Cl |r|
Fc1ccc(cc1)C(N(C1CC1)C(=O)CCl)C(=O)NC1CCCC1
C=CC(=O)N1CC[C@@H](C1)Oc1nc(cc2ccccc12)-c1n[nH]c(=O)[nH]1 |r|
CCc1cccc(CC)c1N1CCn2cc(cc2C1=O)-c1nc(Nc2ccc(cc2OC)N2CCC(CC2)C(=O)N2CC3(CN(C)C3)C2)nc2[nH]ccc12
CN1CCN(CC1)[C@H]1CC(F)(F)c2cc(NC(=O)c3ccc(C)c(c3)C#Cc3cnc4cccnn34)ccc12 |r|
Cn1cc(Nc2nccc(n2)-c2ccc3[C@@H](CCN(Cc3c2)C2COC2)NC(=O)c2cn(nn2)C(C)(C)C)cn1 |r|
Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1=CCN(CC1)C1COC1 |t:39|
CCC(C)[C@@H](NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(C)=O)C(=O)N[C@H](Cc1ccc(NC(=O)CCCCCn2cc(nn2)-c2ccc(cc2)-n2nc(-c3ccc(Cl)cc3)c3c(N)ncnc23)cc1)C(=O)NCC(=O)N[C@H](CCC(O)=O)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](CCC(O)=O)C(=O)N[C@H](C)C(N)=O |r|
Cc1nc(Nc2cc([nH]n2)C2CC2)cc(n1)N1CCN(CC1)C(=O)CCC#C
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(cc1)P(O)(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)COCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCn1cc(CCC(=O)N2CCN(CC2)c2cc(Nc3cc([nH]n3)C3CC3)nc(C)n2)nn1)C(N)=O |r|
COc1ccc(cc1)-c1noc(n1)-c1cnc(Oc2ccc3cc(C(=O)N4CCN(Cc5ccc(OCC(F)(F)F)cc5)CC4)n(C)c3c2)cn1
FC(F)(F)COc1ccc(CN2CCN(CC2)C(=O)c2ccc(cc2)-c2noc(n2)-c2ccc(cc2)C(F)(F)F)cc1
CC1(C)c2oc3cc(ccc3c2C(=O)c2ccc(OCCN3CCOCC3)cc12)C#Cc1cc(OCC2CC2)ccn1
Cc1cc(cc(n1)C#Cc2ccc3c(c2)oc4c3C(=O)c5ccc(cc5C4(C)C)NS(=O)(=O)C)C(=O)NC(C)(C)C
COc1cc2c(cc1OCC1CCN(C)CC1)[nH]cn\c2=N/c1ccc(Br)cc1F
Cc1ccc(-c2cn([C@@H]3CC[C@H](N)CC3)c3ncnc(N)c23)c(F)c1 |r,wU:8.7,11.11,(2.17,7.19,;1.77,5.71,;.28,5.31,;-.11,3.82,;.97,2.74,;.58,1.25,;1.48,0,;.58,-1.24,;.97,-2.73,;-.11,-3.82,;.28,-5.31,;1.77,-5.71,;2.17,-7.19,;2.86,-4.62,;2.46,-3.13,;-.89,-.77,;-2.22,-1.54,;-3.56,-.77,;-3.56,.77,;-2.22,1.54,;-2.22,3.08,;-.89,.77,;2.47,3.14,;3.56,2.05,;2.86,4.62,)|
O=C(OCCN1CCCCC1)c1cc2ccccc2n1Cc1ccccc1
Clc1ccc(cc1)\N=C1/C(=O)N(Cc2ccccc2)c2ccccc12
COc1ccc2NC(=O)\C(=C3/Nc4ccccc4/C/3=N\OCC(O)CO)c2c1
Brc1c[nH]c2ccc(Nc3ncnc4ccc(NC(=O)C=C)cc34)cc12
ClCCC(=O)Nc1ccc2ncnc(Nc3ccc4[nH]cc(Br)c4c3)c2c1
Cc1cc(cc(c1)OCc2ccc(cc2)CN3CCC[C@@H]3CO)CS(=O)(=O)c4ccccc4
Cc1cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)cc(CS(=O)(=O)c2ccccc2)c1Br |r|
COc1ccc(NC(=O)N2CCc3c(C2)sc(NC(=O)c2cnn(C)c2)c3C#N)cc1
CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3c(N)ncc4ccc(Cl)cc34)cc2C(F)(F)F)CC1
Cc1cccc(C)c1-c1cc2cnc(Nc3ccccc3)nc2n(C)c1=O |(5.28,-1.15,;5.26,.4,;6.59,1.18,;6.59,2.72,;5.23,3.48,;3.93,2.7,;2.57,3.45,;3.93,1.16,;2.61,.39,;1.27,1.16,;-.06,.37,;-1.39,1.14,;-2.72,.37,;-2.72,-1.17,;-4.05,-1.94,;-5.38,-1.17,;-5.38,.37,;-6.71,1.14,;-8.04,.34,;-8.03,-1.2,;-6.71,-1.97,;-1.39,-1.94,;-.06,-1.17,;1.29,-1.94,;1.29,-3.48,;2.62,-1.15,;3.95,-1.92,)|
Cn1c2nc(Nc3ccc(CC(N)=O)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(2.5,-3.81,;2.5,-2.27,;1.17,-1.5,;-.18,-2.29,;-1.51,-1.52,;-2.84,-2.29,;-4.17,-1.52,;-5.5,-2.29,;-6.83,-1.55,;-6.83,.02,;-8.17,.79,;-8.18,2.33,;-6.84,3.1,;-9.51,3.07,;-5.5,.79,;-4.17,.02,;-1.51,.02,;-.18,.81,;1.17,.04,;2.48,.81,;3.83,.04,;5.14,.83,;5.14,2.36,;3.79,3.12,;6.46,3.14,;7.8,2.37,;7.82,.83,;6.49,.06,;6.49,-1.48,;3.83,-1.5,;5.16,-2.27,)|
Cn1c2nc(Nc3ccc(OCCCC(O)=O)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(3.58,-4.36,;3.58,-2.82,;2.22,-2.05,;.89,-2.83,;-.44,-2.06,;-1.77,-2.83,;-3.1,-2.06,;-4.43,-2.85,;-5.76,-2.08,;-5.76,-.54,;-7.11,.23,;-7.11,1.77,;-8.44,2.54,;-8.44,4.08,;-9.79,4.85,;-11.12,4.08,;-9.79,6.39,;-4.43,.25,;-3.1,-.52,;-.44,-.52,;.89,.26,;2.22,-.52,;3.55,.27,;4.88,-.5,;6.21,.28,;7.54,-.49,;7.57,-2.03,;8.87,.3,;8.87,1.84,;7.52,2.59,;6.21,1.81,;4.86,2.57,;4.91,-2.04,;6.24,-2.81,)|
Cn1c2nc(Nc3ccc(OCCCC(O)=O)cc3)ncc2cc(-c2c(Cl)ccc(O)c2Cl)c1=O |(3.36,-4.48,;3.36,-2.95,;2.01,-2.17,;.68,-2.95,;-.65,-2.17,;-1.98,-2.95,;-3.31,-2.19,;-3.31,-.64,;-4.64,.12,;-5.97,-.66,;-7.32,.12,;-7.32,1.65,;-8.67,2.43,;-8.67,3.96,;-9.99,4.74,;-9.99,6.28,;-11.3,3.96,;-5.97,-2.2,;-4.64,-2.96,;-.65,-.63,;.68,.14,;2.01,-.63,;3.34,.16,;4.67,-.61,;6,.16,;7.35,-.61,;7.35,-2.15,;8.68,.16,;8.66,1.72,;7.31,2.47,;7.31,4.01,;6,1.7,;4.65,2.45,;4.7,-2.15,;6.03,-2.92,)|
CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4c(C)cccc4C)c(=O)n(C)c3n2)cc1 |(-5.69,4.01,;-7.02,4.78,;-8.35,4.01,;-9.7,4.78,;-11.03,4.01,;-8.35,2.47,;-7.02,1.7,;-7.02,.16,;-5.67,-.61,;-5.66,-2.15,;-4.33,-2.92,;-3.01,-2.13,;-1.67,-2.9,;-.34,-2.13,;-.34,-.59,;.99,.19,;2.32,-.59,;3.65,.2,;4.98,-.57,;6.31,.2,;6.31,1.74,;4.95,2.5,;7.61,2.51,;8.97,1.77,;8.97,.23,;7.64,-.56,;7.65,-2.1,;5,-2.11,;6.33,-2.88,;3.66,-2.9,;3.66,-4.44,;2.32,-2.12,;.99,-2.9,;-3,-.59,;-4.33,.18,)|
CCN(CC)CCOc1ccc(Nc2ncc3c(C)c(-c4c(C)cccc4C)c(=O)n(C)c3n2)cc1 |(-9.79,6.13,;-9.79,4.6,;-8.46,3.83,;-7.13,4.6,;-7.13,6.15,;-8.44,2.28,;-7.11,1.53,;-7.11,-.01,;-5.78,-.78,;-4.45,,;-3.1,-.78,;-3.12,-2.31,;-1.77,-3.08,;-.44,-2.31,;-.44,-.75,;.89,,;2.22,-.75,;3.55,.02,;3.53,1.56,;4.88,-.75,;6.21,.04,;6.19,1.56,;4.85,2.33,;7.52,2.35,;8.87,1.59,;8.87,.04,;7.54,-.75,;7.54,-2.27,;4.88,-2.29,;6.23,-3.06,;3.55,-3.06,;3.55,-4.6,;2.22,-2.31,;.89,-3.08,;-4.43,-3.09,;-5.76,-2.33,)|
CCN(CC)CCOc1ccc(Nc2ncc3c(C)c(-c4ccccc4Cl)c(=O)n(C)c3n2)cc1 |(-10.91,3.89,;-9.58,4.67,;-8.25,3.89,;-6.91,4.67,;-5.57,3.91,;-8.23,2.36,;-6.9,1.6,;-6.9,.06,;-5.57,-.71,;-5.54,-2.27,;-4.21,-3.02,;-2.91,-2.24,;-1.56,-3.02,;-.23,-2.24,;-.23,-.68,;1.1,.09,;2.43,-.68,;3.76,.09,;3.74,1.63,;5.09,-.68,;6.42,.11,;7.75,-.66,;9.08,.12,;9.08,1.65,;7.73,2.42,;6.4,1.63,;5.07,2.28,;5.09,-2.22,;6.45,-2.99,;3.76,-2.99,;3.76,-4.55,;2.43,-2.24,;1.1,-3.02,;-2.89,-.71,;-4.24,.07,)|
OC(=O)c1cc(ccc1Cl)-c1ccc(\C=N\Nc2nc3nonc3nc2Nc2ccccc2)o1
CN(CCOC(=O)c1ccc(nc1)C(=O)Nc1ncnc2n(nc(-c3ccc(Cl)cc3)c12)C(C)(C)C)Cc1ccc(cc1)C(=O)Nc1ccc2ncnc(Nc3cccc(Cl)c3)c2c1
C[C@@H]1[C@@H](COS(=O)(=O)C=C)O[C@H]([C@@H]1OCC#C)n1nc(-c2ccc(C)cc2)c2c(N)ncnc12 |r|
C[C@@H]1[C@@H](COC(=O)c2ccc(cc2)S(F)(=O)=O)O[C@H]([C@@H]1OCC#C)n1nc(-c2ccc(C)cc2)c2c(N)ncnc12 |r|
C[C@@H]1CCN(C[C@@H]1n1ccc2cnc3[nH]ccc3c12)C(=O)CC#N |r|
Cc1cc(Oc2ccccc2)ccc1-c1nn([C@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12 |r|
Cc1cc(Oc2ccccc2)cc(C)c1-c1nn([C@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12 |r,wD:18.19,(1.35,.46,;.58,1.79,;1.37,3.12,;.61,4.46,;1.39,5.78,;2.93,5.76,;3.72,7.09,;5.27,7.08,;6.02,5.73,;5.23,4.4,;3.69,4.43,;-.93,4.47,;-1.71,3.14,;-3.25,3.14,;-.96,1.81,;-1.65,.43,;-.93,-.93,;-2.01,-2.04,;-1.75,-3.56,;-2.85,-4.63,;-2.48,-6.12,;-1,-6.55,;.11,-5.48,;-.26,-3.98,;1.59,-5.89,;1.9,-7.09,;2.7,-4.83,;3.88,-5.17,;-3.38,-1.35,;-4.81,-1.92,;-6.02,-.97,;-5.8,.55,;-4.37,1.12,;-4.2,2.34,;-3.16,.17,)|
CN1CCN(CC1)c1ccc(Nc2ncc3cc(-c4ccccc4Cl)c(=O)n(C[C@H]4CCCO4)c3n2)cc1OC1CCCC1 |r|
COc1cc(ccc1Nc1ncc2cc(-c3ccccc3Cl)c(=O)n(C[C@H]3CCCO3)c2n1)N1CCN(C)CC1 |r|
CCOc1cc(ccc1Nc1ncc2cc(-c3ccccc3Cl)c(=O)n(C[C@H]3CCCO3)c2n1)N1CCN(C)CC1 |r|
CN1CCN(CC1)c1ccc(Nc2ncc3cc(-c4ccccc4Cl)c(=O)n(C[C@H]4CCCO4)c3n2)c(OC2CCCC2)c1 |r|
CN1CCN(CC1)c1ccc(Nc2ncc3cc(-c4cccc(NC(=O)c5ccccc5)c4C)c(=O)n(C[C@H]4CCCO4)c3n2)cc1C |r|
CN1CCN(CC1)c1ccc(Nc2ncc3cc(-c4cccc(NC(=O)c5ccccc5)c4)c(=O)n(C[C@H]4CCCO4)c3n2)cc1C |r|
CN1CCN(CC1)c1ccc(Nc2ncc3cc(-c4cccc(NC(=O)c5cccc(c5)C(F)(F)F)c4)c(=O)n(C[C@H]4CCCO4)c3n2)cc1C |r|
COc1cc(ccc1Nc1ncc2cc(-c3cccc(NC(=O)c4cccc(c4)C(F)(F)F)c3)c(=O)n(C[C@H]3CCCO3)c2n1)N1CCN(C)CC1 |r|
CCOc1cc(ccc1Nc1ncc2cc(-c3cccc(NC(=O)c4cccc(c4)C(F)(F)F)c3)c(=O)n(C[C@H]3CCCO3)c2n1)N1CCN(C)CC1 |r|
Brc1ccc2C(C(=O)Nc2c1)=C1Nc2ccccc2C1=N/OCCN1CCNCC1
COc1cc(Nc2c(cnc3cc(OCCON4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
CN1CCN(CC1)c2ccc(cc2)Nc3nc4ccc(cc4c(n3)Nc5cccc(c5)NC(=O)C=C)F
Cc1ccc(NC(=O)c2cn(CCNS(=O)(=O)c3ccccc3)nn2)cc1Nc1nccc(-c2cccnc2)n1
Cc1ccc(NC(=O)c2cn(CCNS(=O)(=O)c3ccc(F)cc3C)nn2)cc1Nc1nccc(-c2cccnc2)n1
Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCOC(=O)CNC(=O)C[C@@H]3N=C(c4ccc(Cl)cc4)c4c(sc(C)c4C)-n4c(C)nnc43)CC2)n1
Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCOC(=O)C(C)NC(=O)C[C@@H]3N=C(c4ccc(Cl)cc4)c4c(sc(C)c4C)-n4c(C)nnc43)CC2)n1
CN1CCN([C@H]2CC(F)(F)c3cc(NC(=O)c4ccc(F)c(C#Cc5cncc(N6CCOCC6)c5)c4)ccc32)CC1
CN1CCN([C@H]2CC(F)(F)c3cc(NC(=O)c4ccc(F)c(C#Cc5cncc(N6CCC6)c5)c4)ccc32)CC1
Cc1ccc(O)c(C)c1-c1cc(-c2cc(F)nc(N3CC[C@@H](N)C3)c2)cc(C(N)=O)c1N
Oc1ccc(F)c(Nc2nc(SCCN3CCOCC3)nc3c2cnn3CC(Cl)c2ccccc2)c1
Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F
CCOc1cn(nc1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)c(F)c1)-c1ccc(F)cc1C
C[C@@H](C(F)(F)F)N(Cc1ccc(cc1)F)C(=O)CN2C(=O)[C@]3(CCc4c3ccc(c4)NC(=O)NC)OC2=O
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
Cc1cc2c(c[nH]c2nc1)Cc3ccc(nc3F)NCc4cc(cnc4OC)F
Cc1[nH]c(/C=C2/C(=O)Nc3ccc(S(=O)(=O)N(C)c4cccc(Cl)c4)cc32)c(C)c1C(=O)N1CCN(C)CC1
COc1cccc2cc(-c3nc([C@H]4CC[C@H](C(=O)O)CC4)n4ncnc(N)c34)[nH]c12
Nc1nccn2c1c(-c1cc3cccc(Cl)c3[nH]1)nc2[C@H]1CC[C@H](C(=O)O)CC1
COc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(cc4)NC(=O)c5ccccc5
COc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
COc1cc2nccc(Oc3ccc(NC(=O)Nc4cc(C)on4)c(Cl)c3)c2cc1OC
COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(s3)C(N)=O)c2cc1OC
C[C@@]1(O)C[C@@H](C1)c1nc(-c2ccc3ccc(nc3c2)-c2ccccc2)c2c(N)nccn12 |r,wU:1.1,4.6,wD:1.0,(18.42,-37.26,;17.1,-36.49,;16.31,-37.82,;17.79,-35.11,;16.41,-34.42,;15.72,-35.8,;15.93,-32.97,;16.83,-31.71,;15.91,-30.47,;16.38,-29.01,;15.35,-27.88,;15.81,-26.41,;17.32,-26.08,;17.78,-24.62,;19.27,-24.29,;20.31,-25.42,;19.85,-26.89,;18.35,-27.21,;17.89,-28.68,;21.81,-25.09,;22.85,-26.23,;24.35,-25.9,;24.82,-24.43,;23.77,-23.29,;22.27,-23.63,;14.45,-30.96,;13.11,-30.19,;13.11,-28.65,;11.78,-30.96,;11.78,-32.51,;13.12,-33.28,;14.46,-32.5,)|
C=CC(=O)Nc1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12
CCc1cc(Nc2nccc(n2)-c2c(nc3ccccn23)-c2ccc(OC)c(c2)C(=O)Nc2c(F)cccc2F)c(OC)cc1N1CCC(CC1)N1CCN(CC1)S(C)(=O)=O
C[C@]1(CCCN1c1nc(Nc2cc([nH]n2)C2CC2)c2cccn2n1)C(=O)Nc1ccc(F)nc1 |r|
Cc1nc2ccsc2c(n1)Nc3c4c([nH]n3)C(N(C4)C(=O)N[C@H](CN(C)C)c5ccccc5)(C)C
CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc4ncccc4c3)C(C)(C)C)c(F)c2)ccn1
c1cc(c(cc1I)F)Nc2c(ccc(c2F)F)C(=O)N3CC(C3)([C@@H]4CCCCN4)O
CC1=CN2C(=O)C=C(N=C2C(=C1)[C@@H](C)Nc3ccccc3C(=O)O)N4CCOCC4
CCN1CCN(CC1)Cc2ccc(cc2C(F)(F)F)NC(=O)c3ccc(c(c3)Oc4ccnc5c4cc[nH]5)C
CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(/C=C/c4cnc5[nH]ccc5c4OC)c3)cc2C(F)(F)F)CC1
CN1CCN(CC1)C2CCN(CC2)c3ccc(c(c3)OC)Nc4ncc(c(n4)Nc5ccccc5P(=O)(C)C)Cl
O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
CC[C@@H]1CN(C[C@@H]1c1cnc2cnc3[nH]ccc3n12)C(=O)NCC(F)(F)F |r|
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC