2167 SMILES Strings for Gonadotropin-releasing hormone receptor

Compound Name
SMILES String
Clc1ccc(cc1-n1c(=O)[nH]c2ccsc2c1=O)S(=O)(=O)N1CCCc2ccccc12 |(-2.82,-3.08,;-1.48,-2.31,;-.15,-3.08,;1.18,-2.31,;1.18,-.77,;-.15,,;-1.48,-.77,;-2.82,,;-2.82,1.54,;-1.48,2.31,;-4.15,2.31,;-5.48,1.54,;-6.95,2.02,;-7.85,.77,;-6.95,-.48,;-5.48,,;-4.15,-.77,;-4.15,-2.31,;2.52,,;1.75,1.33,;3.29,-1.33,;3.85,.77,;3.85,2.31,;5.19,3.08,;6.52,2.31,;6.52,.77,;7.85,,;7.85,-1.54,;6.52,-2.31,;5.19,-1.54,;5.19,,)|
Clc1ccc(cc1-n1c(=O)[nH]c2sccc2c1=O)S(=O)(=O)N1CCCc2ccccc12 |(-2.82,-3.08,;-1.48,-2.31,;-.15,-3.08,;1.18,-2.31,;1.18,-.77,;-.15,,;-1.48,-.77,;-2.82,,;-2.82,1.54,;-1.48,2.31,;-4.15,2.31,;-5.48,1.54,;-6.95,2.02,;-7.85,.77,;-6.95,-.48,;-5.48,,;-4.15,-.77,;-4.15,-2.31,;2.52,,;1.75,1.33,;3.29,-1.33,;3.85,.77,;3.85,2.31,;5.19,3.08,;6.52,2.31,;6.52,.77,;7.85,,;7.85,-1.54,;6.52,-2.31,;5.19,-1.54,;5.19,,)|
CN(c1cccc(C)c1)S(=O)(=O)c1ccc(Cl)c(c1)-n1c(=O)[nH]c2sccc2c1=O |(3.19,2.69,;3.19,1.15,;4.52,.38,;4.52,-1.15,;5.85,-1.93,;7.19,-1.15,;7.19,.38,;8.52,1.15,;5.85,1.16,;1.85,.38,;2.62,-.95,;1.08,1.72,;.52,-.38,;.52,-1.93,;-.82,-2.69,;-2.15,-1.93,;-3.48,-2.69,;-2.15,-.38,;-.82,.38,;-3.48,.38,;-3.48,1.93,;-2.15,2.69,;-4.82,2.69,;-6.15,1.93,;-7.61,2.4,;-8.52,1.15,;-7.61,-.09,;-6.15,.38,;-4.82,-.38,;-4.82,-1.93,)|
OC(=O)c1scc2[nH]c(=O)n(-c3cc(ccc3Cl)S(=O)(=O)N3CCCc4ccccc34)c(=O)c12 |(-8.56,-1.78,;-7.02,-1.78,;-6.25,-3.11,;-6.25,-.44,;-7.15,.8,;-6.25,2.05,;-4.78,1.57,;-3.45,2.34,;-2.11,1.57,;-.78,2.34,;-2.11,.03,;-.78,-.74,;.55,.03,;1.89,-.74,;1.89,-2.28,;.55,-3.05,;-.78,-2.28,;-2.11,-3.05,;3.22,.03,;2.45,1.37,;3.99,-1.3,;4.55,.8,;4.55,2.34,;5.89,3.11,;7.22,2.34,;7.22,.8,;8.56,.03,;8.56,-1.51,;7.22,-2.28,;5.89,-1.51,;5.89,.03,;-3.45,-.74,;-3.45,-2.28,;-4.78,.03,)|
Cc1ccccc1COc1ccc(Cl)c(c1)-n1c(=O)[nH]c2csc(C(O)=O)c2c1=O |(7.22,-1.89,;7.22,-.35,;8.56,.42,;8.56,1.96,;7.22,2.73,;5.89,1.96,;5.89,.42,;4.55,-.35,;3.22,.42,;1.89,-.35,;1.89,-1.89,;.55,-2.66,;-.78,-1.89,;-2.11,-2.66,;-.78,-.35,;.55,.42,;-2.11,.42,;-2.11,1.96,;-.78,2.73,;-3.45,2.73,;-4.78,1.96,;-6.25,2.43,;-7.15,1.19,;-6.25,-.06,;-7.02,-1.39,;-8.56,-1.39,;-6.25,-2.73,;-4.78,.42,;-3.45,-.35,;-3.45,-1.89,)|
CNC(=O)c1scc2[nH]c(=O)n(-c3cc(ccc3Cl)S(=O)(=O)N3CCCc4ccccc34)c(=O)c12 |(-8.94,-.44,;-8.17,-1.78,;-6.63,-1.78,;-5.86,-3.11,;-5.86,-.44,;-6.77,.8,;-5.86,2.05,;-4.4,1.57,;-3.06,2.34,;-1.73,1.57,;-.39,2.34,;-1.73,.03,;-.39,-.74,;.94,.03,;2.27,-.74,;2.27,-2.28,;.94,-3.05,;-.39,-2.28,;-1.73,-3.05,;3.61,.03,;2.84,1.37,;4.38,-1.3,;4.94,.8,;4.94,2.34,;6.27,3.11,;7.61,2.34,;7.61,.8,;8.94,.03,;8.94,-1.51,;7.61,-2.28,;6.27,-1.51,;6.27,.03,;-3.06,-.74,;-3.06,-2.28,;-4.4,.03,)|
COc1cccc(F)c1C(C)Oc1ccc(F)c(c1)-n1c(=O)[nH]c2csc(C(O)=O)c2c1=O |(5.89,-2.66,;7.22,-1.89,;7.22,-.35,;8.56,.42,;8.56,1.96,;7.22,2.73,;5.89,1.96,;4.55,2.73,;5.89,.42,;4.55,-.35,;4.55,-1.89,;3.22,.42,;1.89,-.35,;1.89,-1.89,;.55,-2.66,;-.78,-1.89,;-2.11,-2.66,;-.78,-.35,;.55,.42,;-2.11,.42,;-2.11,1.96,;-.78,2.73,;-3.45,2.73,;-4.78,1.96,;-6.25,2.43,;-7.15,1.19,;-6.25,-.06,;-7.02,-1.39,;-8.56,-1.39,;-6.25,-2.73,;-4.78,.42,;-3.45,-.35,;-3.45,-1.89,)|
CN(C(=O)c1ccc(Cl)c(c1)-n1c(=O)[nH]c2csc(C(O)=O)c2c1=O)c1ccccc1 |(4.55,-1.89,;4.55,-.35,;3.22,.42,;3.22,1.96,;1.89,-.35,;1.89,-1.89,;.55,-2.66,;-.78,-1.89,;-2.11,-2.66,;-.78,-.35,;.55,.42,;-2.11,.42,;-2.11,1.96,;-.78,2.73,;-3.45,2.73,;-4.78,1.96,;-6.25,2.43,;-7.15,1.19,;-6.25,-.06,;-7.02,-1.39,;-8.56,-1.39,;-6.25,-2.73,;-4.78,.42,;-3.45,-.35,;-3.45,-1.89,;5.89,.42,;7.22,-.35,;8.56,.42,;8.56,1.96,;7.22,2.73,;5.89,1.96,)|
CC(C)(C(=O)c1ccc(Cl)c(c1)-n1c(=O)[nH]c2csc(C(O)=O)c2c1=O)c1ccccc1 |(4.39,-1.92,;4.39,-.38,;3.62,.95,;3.06,.39,;3.06,1.93,;1.72,-.38,;1.72,-1.92,;.39,-2.69,;-.94,-1.92,;-2.28,-2.69,;-.94,-.38,;.39,.39,;-2.28,.39,;-2.28,1.93,;-.94,2.7,;-3.61,2.7,;-4.94,1.93,;-6.41,2.4,;-7.31,1.16,;-6.41,-.09,;-6.89,-1.55,;-8.39,-1.87,;-5.85,-2.7,;-4.94,.39,;-3.61,-.38,;-3.61,-1.92,;5.72,.39,;7.06,-.38,;8.39,.39,;8.39,1.93,;7.06,2.7,;5.72,1.93,)|
COc1ccc(F)cc1C(C)(C)Sc1ccc(F)c(c1)-n1c(=O)[nH]c2csc(C(O)=O)c2c1=O |(5.72,-3.46,;7.06,-2.69,;7.06,-1.15,;8.39,-.38,;8.39,1.16,;7.06,1.93,;7.06,3.47,;5.72,1.16,;5.72,-.38,;4.39,-1.15,;4.39,-2.69,;3.62,.18,;3.06,-.38,;1.72,-1.15,;1.72,-2.69,;.39,-3.46,;-.94,-2.69,;-2.28,-3.46,;-.94,-1.15,;.39,-.38,;-2.28,-.38,;-2.28,1.16,;-.94,1.93,;-3.61,1.93,;-4.94,1.16,;-6.41,1.63,;-7.31,.39,;-6.41,-.86,;-6.89,-2.32,;-8.39,-2.64,;-5.85,-3.47,;-4.94,-.38,;-3.61,-1.15,;-3.61,-2.69,)|
CC(C)(c1ccccc1)S(=O)(=O)c1ccc(F)c(c1)-n1c(=O)[nH]c2csc(C(O)=O)c2c1=O |(4.34,2.69,;4.34,1.15,;4.74,-.33,;5.68,.38,;5.68,-1.15,;7.01,-1.93,;8.34,-1.15,;8.34,.38,;7.01,1.15,;3.01,.38,;2.24,1.72,;3.78,-.95,;1.68,-.38,;1.68,-1.93,;.34,-2.69,;-.99,-1.93,;-2.33,-2.69,;-.99,-.38,;.34,.38,;-2.33,.38,;-2.33,1.93,;-.99,2.69,;-3.66,2.69,;-4.99,1.93,;-6.46,2.4,;-7.36,1.15,;-6.46,-.09,;-6.86,-1.58,;-8.34,-1.98,;-5.77,-2.67,;-4.99,.38,;-3.66,-.38,;-3.66,-1.93,)|
COc1cc(F)c(cc1OCc1c(OC)ccc(F)c1F)-n1c(=O)[nH]c2csc(C(O)=O)c2c1=O |(4.34,-2.69,;3.01,-3.47,;1.68,-2.69,;.34,-3.47,;-.99,-2.69,;-2.33,-3.47,;-.99,-1.15,;.34,-.38,;1.68,-1.15,;3.01,-.38,;4.34,-1.15,;5.68,-.38,;7.01,-1.15,;7.01,-2.69,;5.68,-3.46,;8.34,-.38,;8.34,1.15,;7.01,1.93,;7.01,3.47,;5.68,1.15,;4.34,1.93,;-2.33,-.38,;-2.33,1.15,;-.99,1.93,;-3.66,1.93,;-4.99,1.15,;-6.46,1.63,;-7.36,.38,;-6.46,-.86,;-6.86,-2.35,;-8.34,-2.75,;-5.77,-3.44,;-4.99,-.38,;-3.66,-1.15,;-3.66,-2.69,)|
COCCOc1ccc(F)c(F)c1COc1ccc(F)c(c1)-n1c(=O)[nH]c2csc(C(O)=O)c2c1=O |(10.34,-2.69,;9.01,-3.46,;7.68,-2.69,;6.34,-3.46,;5.01,-2.69,;5.01,-1.15,;6.34,-.38,;6.34,1.16,;5.01,1.93,;5.01,3.47,;3.68,1.16,;2.34,1.93,;3.68,-.38,;2.34,-1.15,;1.01,-.38,;-.33,-1.15,;-.33,-2.69,;-1.66,-3.47,;-2.99,-2.69,;-4.33,-3.47,;-2.99,-1.15,;-1.66,-.38,;-4.33,-.38,;-4.33,1.15,;-2.99,1.93,;-5.66,1.93,;-6.99,1.15,;-8.46,1.63,;-9.36,.38,;-8.46,-.86,;-8.86,-2.35,;-10.34,-2.75,;-7.77,-3.44,;-6.99,-.38,;-5.66,-1.15,;-5.66,-2.69,)|
COc1cc(F)c(cc1COc1c(OC)ccc(F)c1F)-n1c(=O)[nH]c2csc(C(O)=O)c2c1=O |(4.34,-2.69,;3.01,-3.47,;1.68,-2.69,;.34,-3.47,;-.99,-2.69,;-2.33,-3.47,;-.99,-1.15,;.34,-.38,;1.68,-1.15,;3.01,-.38,;4.34,-1.15,;5.68,-.38,;7.01,-1.15,;7.01,-2.69,;8.34,-3.47,;8.34,-.38,;8.34,1.15,;7.01,1.93,;7.01,3.47,;5.68,1.15,;4.34,1.93,;-2.33,-.38,;-2.33,1.15,;-.99,1.93,;-3.66,1.93,;-4.99,1.15,;-6.46,1.63,;-7.36,.38,;-6.46,-.86,;-6.86,-2.35,;-8.34,-2.75,;-5.77,-3.44,;-4.99,-.38,;-3.66,-1.15,;-3.66,-2.69,)|
COc1cc(F)c(cc1CN(C)c1c(F)cccc1F)-n1c(=O)[nH]c2csc(C(O)=O)c2c1=O |(3.01,-3.46,;3.01,-1.92,;1.68,-1.16,;.34,-1.93,;-.99,-1.16,;-2.33,-1.93,;-.99,.38,;.34,1.15,;1.68,.38,;3.01,1.15,;4.34,.38,;4.34,-1.15,;5.68,1.15,;5.68,2.69,;4.34,3.46,;7.01,3.46,;8.34,2.69,;8.34,1.15,;7.01,.38,;7.01,-1.16,;-2.33,1.15,;-2.33,2.69,;-.99,3.46,;-3.66,3.46,;-4.99,2.69,;-6.46,3.17,;-7.36,1.92,;-6.46,.68,;-6.86,-.81,;-8.34,-1.21,;-5.77,-1.9,;-4.99,1.15,;-3.66,.38,;-3.66,-1.16,)|
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccn3)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
CCOCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccn3)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
CONC(=O)Nc1ccc(cc1)-n1nc2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC)c3F)c(=O)c2c1CN(C)C |(-10.58,-1.9,;-9.04,-1.9,;-8.27,-.56,;-6.73,-.56,;-5.96,-1.9,;-5.96,.77,;-4.42,.77,;-3.65,-.56,;-2.11,-.56,;-1.34,.77,;-2.11,2.1,;-3.65,2.1,;.2,.77,;1.11,-.48,;2.57,0,;3.91,-.77,;3.91,-2.31,;5.24,-3.08,;6.57,-2.31,;7.91,-1.54,;7.91,-3.08,;7.91,-4.62,;6.57,-5.39,;5.24,-4.62,;3.91,-5.39,;5.24,0,;6.57,-.77,;5.24,1.54,;6.57,2.31,;6.57,3.85,;7.91,4.62,;9.24,3.85,;9.24,2.31,;10.58,1.54,;10.58,0,;7.91,1.54,;7.91,0,;3.91,2.31,;3.91,3.85,;2.57,1.54,;1.11,2.02,;.71,3.5,;-.78,3.9,;-1.18,5.39,;-1.87,2.81,)|
CCNC(=O)Nc1ccc(cc1)-n1nc2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC)c3F)c(=O)c2c1CN(C)C |(-10.58,-1.9,;-9.04,-1.9,;-8.27,-.56,;-6.73,-.56,;-5.96,-1.9,;-5.96,.77,;-4.42,.77,;-3.65,-.56,;-2.11,-.56,;-1.34,.77,;-2.11,2.1,;-3.65,2.1,;.2,.77,;1.11,-.48,;2.57,0,;3.91,-.77,;3.91,-2.31,;5.24,-3.08,;6.57,-2.31,;7.91,-1.54,;7.91,-3.08,;7.91,-4.62,;6.57,-5.39,;5.24,-4.62,;3.91,-5.39,;5.24,0,;6.57,-.77,;5.24,1.54,;6.57,2.31,;6.57,3.85,;7.91,4.62,;9.24,3.85,;9.24,2.31,;10.58,1.54,;10.58,0,;7.91,1.54,;7.91,0,;3.91,2.31,;3.91,3.85,;2.57,1.54,;1.11,2.02,;.71,3.5,;-.78,3.9,;-1.18,5.39,;-1.87,2.81,)|
CNC(=O)Nc1ccc(cc1)-n1nc2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC)c3F)c(=O)c2c1CN(C)C |(-9.14,-2.67,;-8.37,-1.33,;-6.83,-1.33,;-6.06,-2.67,;-6.06,,;-4.52,,;-3.75,-1.33,;-2.21,-1.33,;-1.44,,;-2.21,1.33,;-3.75,1.33,;.1,,;1.01,-1.25,;2.47,-.77,;3.8,-1.54,;3.8,-3.08,;5.14,-3.85,;6.47,-3.08,;7.81,-2.31,;7.81,-3.85,;7.81,-5.39,;6.47,-6.16,;5.14,-5.39,;3.8,-6.16,;5.14,-.77,;6.47,-1.54,;5.14,.77,;6.47,1.54,;7.81,.77,;9.14,1.54,;9.14,3.08,;7.81,3.85,;7.81,5.39,;6.47,6.16,;6.47,3.08,;5.14,3.85,;3.8,1.54,;3.8,3.08,;2.47,.77,;1.01,1.25,;.61,2.73,;-.88,3.13,;-1.28,4.62,;-1.97,2.04,)|
CCNC(=O)Nc1ccc(cc1)-n1nc2n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(-c3cccc(OC)c3F)c(=O)c2c1CN(C)C |(-9.91,-2,;-8.37,-2,;-7.6,-.67,;-6.06,-.67,;-5.29,-2,;-5.29,.67,;-3.75,.67,;-2.98,-.67,;-1.44,-.67,;-.67,.67,;-1.44,2,;-2.98,2,;.87,.67,;1.78,-.58,;3.24,-.1,;4.57,-.87,;4.57,-2.41,;5.91,-3.18,;7.24,-2.41,;8.58,-1.64,;8.58,-3.18,;8.58,-4.72,;7.24,-5.49,;5.86,-4.75,;4.53,-5.52,;3.19,-6.29,;5.3,-6.85,;3.76,-4.19,;5.91,-.1,;7.24,-.87,;5.91,1.44,;7.24,2.21,;8.58,1.44,;9.91,2.21,;9.91,3.75,;8.58,4.52,;8.58,6.06,;7.24,6.83,;7.24,3.75,;5.91,4.52,;4.57,2.21,;4.57,3.75,;3.24,1.44,;1.78,1.91,;1.38,3.4,;-.11,3.8,;-.51,5.29,;-1.2,2.71,)|
CONC(=O)Nc1ccc(cc1)-n1nc2n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(-c3cccc(OC)c3F)c(=O)c2c1CN(C)C |(-4.13,4,;-4.9,2.67,;-6.44,2.67,;-7.21,1.33,;-8.75,1.33,;-6.44,,;-4.9,,;-4.13,-1.33,;-2.59,-1.33,;-1.82,,;-2.59,1.33,;-4.13,1.33,;-.28,,;.62,-1.25,;2.09,-.77,;3.42,-1.54,;3.42,-3.08,;4.75,-3.85,;6.09,-3.08,;7.42,-2.31,;7.42,-3.85,;7.42,-5.39,;6.09,-6.16,;4.75,-5.39,;3.42,-6.16,;2.09,-5.39,;3.42,-7.7,;2.09,-6.93,;4.75,-.77,;6.09,-1.54,;4.75,.77,;6.09,1.54,;7.42,.77,;8.75,1.54,;8.75,3.08,;7.42,3.85,;7.42,5.39,;8.75,6.16,;6.09,3.08,;4.75,3.85,;3.42,1.54,;3.42,3.08,;2.09,.77,;.62,1.25,;.22,2.73,;1.31,3.82,;.91,5.31,;2.8,4.22,)|
CNC(=O)Nc1ccc(cc1)-n1nc2n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(-c3cccc(OC)c3F)c(=O)c2c1CN(C)C |(-9.14,-1.9,;-8.37,-.56,;-6.83,-.56,;-6.06,-1.9,;-6.06,.77,;-4.52,.77,;-3.75,-.56,;-2.21,-.56,;-1.44,.77,;-2.21,2.1,;-3.75,2.1,;.1,.77,;1.01,-.48,;2.47,,;3.8,-.77,;3.8,-2.31,;5.14,-3.08,;6.47,-2.31,;7.81,-1.54,;7.81,-3.08,;7.81,-4.62,;6.47,-5.39,;5.14,-4.62,;3.8,-5.39,;2.47,-4.62,;3.8,-6.93,;5.14,-6.16,;5.14,,;6.47,-.77,;5.14,1.54,;6.47,2.31,;7.81,1.54,;9.14,2.31,;9.14,3.85,;7.81,4.62,;7.81,6.16,;6.47,6.93,;6.47,3.85,;5.14,4.62,;3.8,2.31,;3.8,3.85,;2.47,1.54,;1.01,2.02,;.61,3.5,;-.88,3.9,;-1.28,5.39,;-1.97,2.81,)|
CNC(=O)Nc1ccc(cc1)-n1nc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)nn3)c(=O)c2c1CN(C)C
CCNC(=O)Nc1ccc(cc1)-n1nc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)nn3)c(=O)c2c1CN(C)C
CONC(=O)Nc1ccc(cc1)-n1nc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)nn3)c(=O)c2c1CN(C)C
CNC(=O)Nc1ccc(cc1)-n1nc2n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(-c3ccc(OC)nn3)c(=O)c2c1CN(C)C
CCNC(=O)Nc1ccc(cc1)-c1cn2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC)c3F)c(=O)c2c1CN(C)C |(-9.91,-2.67,;-8.37,-2.67,;-7.6,-1.33,;-6.06,-1.33,;-5.29,-2.67,;-5.29,,;-3.75,,;-2.98,-1.33,;-1.44,-1.33,;-.67,,;-1.44,1.33,;-2.98,1.33,;.87,,;1.78,-1.25,;3.24,-.77,;4.57,-1.54,;4.57,-3.08,;3.24,-3.85,;1.91,-3.08,;1.91,-1.9,;.57,-3.85,;.57,-5.39,;1.91,-6.16,;3.24,-5.39,;4.57,-6.16,;5.91,-.77,;7.24,-1.54,;5.91,.77,;7.24,1.54,;8.58,.77,;9.91,1.54,;9.91,3.08,;8.58,3.85,;8.58,5.39,;7.24,6.16,;7.24,3.08,;5.91,3.85,;4.57,1.54,;4.57,3.08,;3.24,.77,;1.78,1.25,;1.38,2.73,;2.47,3.82,;2.07,5.31,;3.95,3.42,)|
CONC(=O)Nc1ccc(cc1)-c1cn2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC)c3F)c(=O)c2c1CN(C)C |(-9.91,-2.67,;-8.37,-2.67,;-7.6,-1.33,;-6.06,-1.33,;-5.29,-2.67,;-5.29,,;-3.75,,;-2.98,-1.33,;-1.44,-1.33,;-.67,,;-1.44,1.33,;-2.98,1.33,;.87,,;1.78,-1.25,;3.24,-.77,;4.57,-1.54,;4.57,-3.08,;3.24,-3.85,;1.91,-3.08,;1.91,-1.9,;.57,-3.85,;.57,-5.39,;1.91,-6.16,;3.24,-5.39,;4.57,-6.16,;5.91,-.77,;7.24,-1.54,;5.91,.77,;7.24,1.54,;8.58,.77,;9.91,1.54,;9.91,3.08,;8.58,3.85,;8.58,5.39,;7.24,6.16,;7.24,3.08,;5.91,3.85,;4.57,1.54,;4.57,3.08,;3.24,.77,;1.78,1.25,;1.38,2.73,;-.11,3.13,;-.51,4.62,;-1.2,2.04,)|
CNC(=O)Nc1ccc(cc1)-c1cn2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)nn3)c(=O)c2c1CN(C)C
CNC(=O)Nc1ccc(cc1)-c1cn2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC)c3F)c(=O)c2c1CN(C)C |(-9.14,-2.67,;-8.37,-1.33,;-6.83,-1.33,;-6.06,-2.67,;-6.06,,;-4.52,,;-3.75,-1.33,;-2.21,-1.33,;-1.44,,;-2.21,1.33,;-3.75,1.33,;.1,,;1.01,-1.25,;2.47,-.77,;3.8,-1.54,;3.8,-3.08,;5.14,-3.85,;6.47,-3.08,;7.81,-2.31,;7.81,-3.85,;7.81,-5.39,;6.47,-6.16,;5.14,-5.39,;3.8,-6.16,;5.14,-.77,;6.47,-1.54,;5.14,.77,;6.47,1.54,;7.81,.77,;9.14,1.54,;9.14,3.08,;7.81,3.85,;7.81,5.39,;6.47,6.16,;6.47,3.08,;5.14,3.85,;3.8,1.54,;3.8,3.08,;2.47,.77,;1.01,1.25,;.53,2.71,;-.98,3.03,;-1.45,4.5,;-2.01,1.89,)|
Cc1c(F)ccc2OCCCOc3cc(F)c(cc3OCc12)C1C(=O)Nc2csc(C(O)=O)c2C1=O
OC(=O)c1scc2NC(=O)C(C(=O)c12)c1cc2OCc3c(F)c(F)ccc3OCC3(CC3)COc2cc1F
OC(=O)c1scc2NC(=O)C(C(=O)c12)c1cc2OCc3c(OCCCCOc2cc1F)ccc(F)c3F
OC(=O)c1scc2NC(=O)C(C(=O)c12)c1cc2OCc3cc(F)cc(F)c3OOCCCOc2cc1F
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)nn3)c(=O)c2c1CN(C)C
C=C1N(Cc2c(C)cccc2C)c2sc(-c3ccc(NC(=O)NOC)cc3)c(CC(C)CCOC(F)(F)F)c2C(=O)N1c1ccc(OC)nn1
CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cn1
CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC(F)F)c3F)c(=O)c2c1CN(C)C |(11.91,-3.73,;10.37,-3.73,;9.6,-2.39,;8.06,-2.39,;7.29,-3.73,;7.29,-1.06,;5.75,-1.06,;4.98,.27,;3.44,.27,;2.67,-1.06,;3.44,-2.39,;4.98,-2.39,;1.13,-1.06,;.23,.18,;-1.24,-.29,;-2.57,.48,;-2.57,2.02,;-1.48,3.11,;.01,2.71,;.41,1.22,;1.09,3.8,;.69,5.28,;-.8,5.68,;-1.88,4.6,;-3.37,4.99,;-3.91,-.29,;-5.24,.48,;-3.91,-1.83,;-5.24,-2.6,;-5.24,-4.14,;-6.57,-4.91,;-7.91,-4.14,;-7.91,-2.61,;-9.24,-1.84,;-10.58,-2.61,;-11.91,-1.84,;-10.58,-4.15,;-6.58,-1.83,;-6.58,-.29,;-2.57,-2.6,;-2.57,-4.14,;-1.24,-1.83,;.23,-2.31,;.62,-3.79,;2.11,-4.19,;2.51,-5.68,;3.2,-3.1,)|
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(-c3ccc(OC)nn3)c(=O)c2c1CN(C)C
CNc1ccc(nn1)-n1c(=O)n(Cc2c(F)cccc2F)c2sc(c(CN(C)C)c2c1=O)-c1ccc(NC(=O)NOC)cc1
COc1ccc(nn1)-n1c(=O)n(Cc2c(F)cccc2F)c2sc(c(CN(C)C)c2c1=O)-c1ccc(NC(=O)NOCC(F)F)cc1
CCNC(=O)CNC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
[#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@@H](-[#6]-c1cccnc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(Cl)cc1)-[#7]-[#6](=O)-[#6@@H](-[#6]-c1ccc2ccccc2c1)-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](-[#7])=O
CC(C)C[C@H](NC(=O)[C@H](CCCNc1n[nH]c(N)n1)NC(=O)[C@H](CCCNc1n[nH]c(N)n1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
[H][C@@]1(CCOc2c(c(O)nc3cc(Cl)c(cc23)[N+]([O-])=O)-c2cc(C)cc(C)c2)CCCCN1C
CCCCN=C(NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)NC(N)=O |w:4.3|
CC(C)C[C@H](NC(=O)[C@@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCCCNC(NCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@H](CCCNC(NCCCC)=NC#N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)=NC#N |w:102.107,64.68|
CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(NCc1ccccn1)=NC#N)NC(=O)[C@H](CCCCNC(NCc1ccccn1)=NC#N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O |w:44.46,23.24|
CCCCNC(NCCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)=NC#N |w:92.97|
CCCCNC(NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@H](CCCCNC(NCCCC)=NC#N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)=NC#N |w:104.109,66.70|
CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(NC1CCCCC1)=NC#N)NC(=O)[C@H](CCCCNC(NC1CCCCC1)=NC#N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O |w:42.44,22.23|
CCCCNC(NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)=NC#N |w:94.99|
CC(C)C[C@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CNC(NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@H](CCCCNC(NC)=NC#N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)=NC#N |w:98.103,60.64|
CCCCNC(NCCCC[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)=NC#N |w:95.99|
CCCCNC(NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)=NC#N |w:108.115|
CC(C)C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](CCCCNc1nnc(N)[nH]1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCCCCCNC(NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@H](CCCCNC(NCCCCCC)=NC#N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)=NC#N |w:108.113,70.74|
CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(NC(C)C)=NC#N)NC(=O)[C@H](CCCCNC(NC(C)C)=NC#N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O |w:36.36,19.19|
CC(C)C[C@H](NC(=O)[C@@H](CCCNc1n[nH]c(N)n1)NC(=O)[C@H](CCCNc1n[nH]c(N)n1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](CCCNC(NCc1ccccn1)=NC#N)NC(=O)[C@H](CCCNC(NCc1ccccn1)=NC#N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O |w:42.44,22.23|
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)Nc3ccccc3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(CC(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)Nc3cccnc3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)NC3CC3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)Nc3ccccn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)Nc3cnccn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)c3cnccn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3ccccn3)c(Cl)cc2[nH]c1=O
Cc1nnc(NC(=O)c2cc3c(OCCC4CCCC[NH2+]4)c(-c4cc(C)cc(C)c4)c(=O)[nH]c3cc2Cl)s1
CCC(C)N(C(C)CC)C(=O)c1cc2c(OCCC3CCCC[NH2+]3)c(-c3cc(C)cc(C)c3)c(=O)[nH]c2cc1Cl
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3ccnc(C)n3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCC[C@@H]2CCCCN2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O |r|
Cc1cc(C)cc(c1)-c1c(OCC[C@@H]2CCCCN2)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O |r|
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3ncccn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3cnccn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3ccncc3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3cccnc3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)NCc3ccc4OCOc4c3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3nncs3)c(Cl)cc2[nH]c1=O
Cc1cc(NC(=O)c2cc3c(OCCC4CCCC[NH2+]4)c(-c4cc(C)cc(C)c4)c(=O)[nH]c3cc2Cl)no1
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3nc[nH]n3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3cc(Cl)ncn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
Cc1cc(NC(=O)c2cc3c(OCCC4CCCC[NH2+]4)c(-c4cc(C)cc(C)c4)c(=O)[nH]c3cc2Cl)on1
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3ccnc(n3)C3CC3)c(Cl)cc2[nH]c1=O
CCN(CC)C(=O)c1cc2c(OCCC3CCCC[NH2+]3)c(-c3cc(C)cc(C)c3)c(=O)[nH]c2cc1Cl
COc1nccc(NC(=O)c2cc3c(OCCC4CCCC[NH2+]4)c(-c4cc(C)cc(C)c4)c(=O)[nH]c3cc2Cl)n1
CC1CCC(C)N1C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccc(NS(C)(=O)=O)cc1)C(C)(C)C(=O)N1CCCC1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccc(O)cc1)C(=O)N1CCOCC1
CCOC(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CN(C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CCN(C(C)C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CCOC(=O)C(C)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CCCN(CCC)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CCN(CC)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CCN(CC)C(=O)C(C)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccc(NS(C)(=O)=O)cc1)C(=O)N1C2CCC1CC2 |TLB:35:37:39.40:43.42|
CC1CCC(C)N1C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CCCCN(CC)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CN(C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CC(C)CN(CC(C)C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CCN(CC)C(=O)Cc1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccc(NS(C)(=O)=O)cc1)C(=O)N1CCCC1
CC(C)CN(CC(C)C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CC1CCC(C)N1C(=O)Cc1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccc(NS(C)(=O)=O)cc1)C(=O)N1CCOCC1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccc(NS(C)(=O)=O)cc1)C(=O)N1CCCCC1
CCCN(CCC)C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccc(NS(C)(=O)=O)cc1)C(C)(C)C(=O)N1CCOCC1
CCOC(=O)Cc1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CC(C)N(C(C)C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CN(C)C(=O)Cc1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CCOC(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CN(C)C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
CCN(CC)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CCN(C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1)C(C)(C)C
CC(C)N(C(C)C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CCN(CC)C(=O)c1ccc2[nH]c(c(CCN(C)CCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CCN(C(C)C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
CCN(C1CCCCC1)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CN(CCCCc1ccncc1)CCc1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:26:28:30.31:33.34|
CCN(CCCCc1ccncc1)CCc1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:27:29:31.32:34.35|
CC(C)CN(CC(C)C)C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CCN(CC)C(=O)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
CCN(C1CCCCC1)C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CCN(CC)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CN(C)C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
CCC(CC)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1 |THB:5:7:9.10:12.13|
CCC(C)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1 |THB:4:6:8.9:11.12|
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccncc1)C(=O)N(CC(F)(F)F)CC(F)(F)F
CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
CCN(CCO)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccncc1)C(=O)N1CCOCC1
CC(C)CN(CC(C)C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccncc1)C(=O)N1CCCC1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccncc1)C(C)(C)C(=O)N1CCCCC1
CC1CCC(C)N1C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CN(C)C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccncc1)C(=O)N1C2CCC1CC2 |THB:30:32:38.37:34.35|
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1cccnc1)C(=O)N1CCCC1
CCN(C1CCCCCCC1)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccncc1)C(C)(C)C(=O)N1CCCC1
CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CC(C)CN(CC(C)C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
COCCN(CCOC)C(=O)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1cccnc1)C(C)(C)C(=O)N1CC(C)(C)C1
CC(C)NC(=O)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1cccnc1)C(C)(C)C(=O)N1CCCC1
CC(C)CN(CC(C)C)C(=O)C(C)(C)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1cccnc1)C(C)(C)C(N)=O
CC1CCC(C)N1C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CCCCN(CCCC)C(=O)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
CCN(C1CCCCC1)C(=O)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:26:28:30.31:33.34|
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC(CC2)C1)-c1cc(C)cc(C)c1 |wD:1.0,TLB:26:28:31.32:35.34,(5.63,.3,;6.4,-1.03,;7.94,-1.05,;8.71,.28,;10.25,.27,;11.02,1.6,;12.56,1.6,;13.35,2.93,;14.89,2.92,;15.64,1.58,;17.2,1.58,;17.97,2.92,;17.2,4.25,;15.66,4.25,;5.62,-2.36,;6.24,-3.78,;5.09,-4.79,;3.76,-4.02,;2.31,-4.49,;1.17,-3.46,;1.5,-1.96,;2.96,-1.49,;4.09,-2.53,;.36,-.92,;-.74,.18,;1.85,-.51,;-1.11,-1.38,;-1.44,-2.89,;-2.33,-.45,;-2.75,1,;-4.32,1.28,;-5.43,.35,;-5.44,-1.19,;-4.55,-.05,;-5.37,1.7,;-4.99,2.75,;-3.45,.18,;7.73,-4.11,;8.77,-2.96,;10.27,-3.29,;11.3,-2.15,;10.74,-4.76,;9.71,-5.9,;10.18,-7.36,;8.2,-5.58,)|
C[C@H](CNCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:24:26:31.32:28.29|
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:26:28:32.31:34.35,(5.75,.3,;6.52,-1.03,;8.06,-1.05,;8.83,.28,;10.37,.27,;11.14,1.6,;12.68,1.6,;13.46,2.93,;15,2.92,;15.78,4.25,;17.32,4.25,;18.09,2.92,;17.31,1.58,;15.76,1.58,;5.74,-2.36,;6.35,-3.78,;5.21,-4.79,;3.88,-4.02,;2.43,-4.49,;1.29,-3.46,;1.62,-1.96,;3.08,-1.49,;4.21,-2.53,;.47,-.92,;1.97,-.51,;-.62,.18,;-1,-1.38,;-1.32,-2.89,;-2.22,-.45,;-1.82,1.04,;-3.33,1.45,;-3.33,2.99,;-4.15,2.22,;-4.15,,;-5.2,-.45,;-4.81,1.04,;7.85,-4.11,;8.31,-5.58,;9.83,-5.9,;10.3,-7.36,;10.86,-4.76,;10.39,-3.29,;11.42,-2.15,;8.89,-2.96,)|
COCn1cc(CCNC[C@@H](C)c2c([nH]c3ccc(cc23)C(C)(C)C(=O)N2CC3CCC2CC3)-c2cc(C)cc(C)c2)ccc1=O |wD:10.10,TLB:24:26:30.29:32.33,(18.23,-1.38,;17.46,-.05,;15.92,-.03,;15.17,1.3,;13.63,1.31,;12.86,2.65,;11.32,2.65,;10.55,1.32,;9.01,1.33,;8.24,,;6.7,.02,;5.93,1.35,;5.91,-1.31,;6.53,-2.73,;5.39,-3.74,;4.06,-2.97,;2.6,-3.44,;1.47,-2.41,;1.8,-.91,;3.25,-.44,;4.39,-1.48,;.66,.13,;-.44,1.23,;2.15,.54,;-.81,-.33,;-1.14,-1.84,;-2.05,.6,;-1.65,1.93,;-2.82,2.33,;-4.43,1.7,;-5.08,.2,;-3.63,.82,;-3.63,2.98,;-2.82,4.08,;8.03,-3.06,;8.5,-4.53,;10.01,-4.85,;10.48,-6.31,;11.04,-3.71,;10.57,-2.24,;11.6,-1.1,;9.06,-1.91,;13.63,3.98,;15.17,3.98,;15.94,2.63,;17.48,2.63,)|
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CCC(C)(C)CC1)-c1cc(C)cc(C)c1
CCS(=O)(=O)N1CCN(CC1)C(=O)C(C)(C)c1ccc2[nH]c(c([C@H](C)CNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CCC2(CCCC2)CC1)-c1cc(C)cc(C)c1
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CCN(CC1)C(=O)OC(C)(C)C)-c1cc(C)cc(C)c1
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CCC2(CC1)OCCO2)-c1cc(C)cc(C)c1
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC(C)(C)C1)-c1cc(C)cc(C)c1
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C[C@H]2CCCC[C@H]2C1)-c1cc(C)cc(C)c1
CC(C)CN(CC(C)C)C(=O)C(C)(C)c1ccc2[nH]c(c([C@H](C)CNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccncc1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:33:35:37.38:40.41|
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CC1CCC2)-c1cc(C)cc(C)c1 |THB:26:28:31:33.34.35|
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2(C)CC1CC(C)(C)C2)-c1cc(C)cc(C)c1 |THB:26:28:32:35.34.38|
C[C@H](CNCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |r,wD:1.0,TLB:24:26:29.30:33.32,(25.26,-8.15,;26.29,-9.29,;27.8,-8.96,;28.26,-7.49,;29.77,-7.16,;30.24,-5.69,;31.74,-5.37,;32.77,-6.5,;34.27,-6.18,;34.74,-4.71,;33.7,-3.57,;32.2,-3.9,;25.83,-10.75,;26.74,-12,;25.84,-13.25,;24.37,-12.78,;23.03,-13.56,;21.7,-12.79,;21.7,-11.25,;23.03,-10.48,;24.36,-11.24,;20.36,-10.48,;21.13,-9.14,;19.6,-11.81,;19.02,-9.71,;19.02,-8.17,;17.69,-10.48,;16.41,-9.46,;14.8,-9.85,;13.82,-8.69,;14.04,-10.08,;15.23,-11.49,;14.85,-12.73,;14.16,-11.3,;28.28,-11.99,;29.03,-10.65,;30.57,-10.64,;31.33,-9.3,;31.36,-11.97,;30.59,-13.31,;31.37,-14.64,;29.05,-13.32,)|
C[C@H](CNCCc1cccnc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,TLB:24:26:30.29:32.33,(5.93,1.35,;6.7,.02,;8.24,,;9.01,1.33,;10.55,1.32,;11.32,2.65,;12.86,2.65,;13.63,3.98,;15.17,3.98,;15.94,2.63,;15.17,1.3,;13.63,1.31,;5.91,-1.31,;6.53,-2.73,;5.39,-3.74,;4.06,-2.97,;2.6,-3.44,;1.47,-2.41,;1.8,-.91,;3.25,-.44,;4.39,-1.48,;.66,.13,;-.44,1.23,;2.15,.54,;-.81,-.33,;-1.14,-1.84,;-2.05,.6,;-1.65,1.93,;-2.82,2.33,;-4.43,1.7,;-5.08,.2,;-3.63,.82,;-3.63,2.98,;-2.82,4.08,;8.03,-3.06,;9.06,-1.91,;10.57,-2.24,;11.6,-1.1,;11.04,-3.71,;10.01,-4.85,;10.48,-6.31,;8.5,-4.53,)|
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCCCC2C2CCCCC12)-c1cc(C)cc(C)c1
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C[C@H]2CC[C@@H]1C2)-c1cc(C)cc(C)c1 |TLB:26:28:34:32.31|
C[C@H](CNCCc1cc(C)c(=O)n(C)c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,TLB:27:29:33.32:35.36,(5.93,1.35,;6.7,.02,;8.24,,;9.01,1.33,;10.55,1.32,;11.32,2.65,;12.86,2.65,;13.63,3.98,;15.17,3.98,;15.94,5.31,;15.94,2.63,;17.48,2.63,;15.17,1.3,;15.92,-.03,;13.63,1.31,;5.91,-1.31,;6.53,-2.73,;5.39,-3.74,;4.06,-2.97,;2.6,-3.44,;1.47,-2.41,;1.8,-.91,;3.25,-.44,;4.39,-1.48,;.66,.13,;2.15,.54,;-.44,1.23,;-.81,-.33,;-1.14,-1.84,;-2.05,.6,;-1.65,1.93,;-2.82,2.33,;-4.43,1.7,;-5.08,.2,;-3.63,.82,;-3.63,2.98,;-2.82,4.08,;8.03,-3.06,;8.5,-4.53,;10.01,-4.85,;10.48,-6.31,;11.04,-3.71,;10.57,-2.24,;11.6,-1.1,;9.06,-1.91,)|
COc1ccc(CCNC[C@@H](C)c2c([nH]c3ccc(cc23)C(C)(C)C(=O)N2CC3CCC2CC3)-c2cc(C)cc(C)c2)cn1 |wD:10.10,TLB:24:26:30.29:32.33,(18.25,3.96,;17.48,2.63,;15.94,2.63,;15.17,3.98,;13.63,3.98,;12.86,2.65,;11.32,2.65,;10.55,1.32,;9.01,1.33,;8.24,,;6.7,.02,;5.93,1.35,;5.91,-1.31,;6.53,-2.73,;5.39,-3.74,;4.06,-2.97,;2.6,-3.44,;1.47,-2.41,;1.8,-.91,;3.25,-.44,;4.39,-1.48,;.66,.13,;-.44,1.23,;2.15,.54,;-.81,-.33,;-1.14,-1.84,;-2.05,.6,;-1.65,1.93,;-2.82,2.33,;-4.43,1.7,;-5.08,.2,;-3.63,.82,;-3.63,2.98,;-2.82,4.08,;8.03,-3.06,;8.5,-4.53,;10.01,-4.85,;10.48,-6.31,;11.04,-3.71,;10.57,-2.24,;11.6,-1.1,;9.06,-1.91,;13.63,1.31,;15.17,1.3,)|
C[C@H](CNCCc1ccc(=O)n(C)c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,TLB:26:28:32.31:34.35,(5.93,1.35,;6.7,.02,;8.24,,;9.01,1.33,;10.55,1.32,;11.32,2.65,;12.86,2.65,;13.63,3.98,;15.17,3.98,;15.94,2.63,;17.48,2.63,;15.17,1.3,;15.92,-.03,;13.63,1.31,;5.91,-1.31,;6.53,-2.73,;5.39,-3.74,;4.06,-2.97,;2.6,-3.44,;1.47,-2.41,;1.8,-.91,;3.25,-.44,;4.39,-1.48,;.66,.13,;-.44,1.23,;2.15,.54,;-.81,-.33,;-1.14,-1.84,;-2.05,.6,;-1.65,1.93,;-2.82,2.33,;-4.43,1.7,;-5.08,.2,;-3.63,.82,;-3.63,2.98,;-2.82,4.08,;8.03,-3.06,;9.06,-1.91,;10.57,-2.24,;11.6,-1.1,;11.04,-3.71,;10.01,-4.85,;10.48,-6.31,;8.5,-4.53,)|
C[C@H](CNCCc1ccc(=O)[nH]c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:25:27:31.30:33.34,(5.93,1.35,;6.7,.02,;8.24,,;9.01,1.33,;10.55,1.32,;11.32,2.65,;12.86,2.65,;13.63,3.98,;15.17,3.98,;15.94,2.63,;17.48,2.63,;15.17,1.3,;13.63,1.31,;5.91,-1.31,;6.53,-2.73,;5.39,-3.74,;4.06,-2.97,;2.6,-3.44,;1.47,-2.41,;1.8,-.91,;3.25,-.44,;4.39,-1.48,;.66,.13,;2.15,.54,;-.44,1.23,;-.81,-.33,;-1.14,-1.84,;-2.05,.6,;-1.65,1.93,;-2.82,2.33,;-2.82,4.08,;-3.63,2.98,;-3.63,.82,;-5.08,.2,;-4.43,1.7,;8.03,-3.06,;8.5,-4.53,;10.01,-4.85,;10.48,-6.31,;11.04,-3.71,;10.57,-2.24,;11.6,-1.1,;9.06,-1.91,)|
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3ccc4OCOc4c3)c(=O)n2c1CN(C)CCc1ccccn1
CCc1cc(CCNC[C@@H](C)c2c([nH]c3ccc(cc23)C(C)(C)C(=O)N2CC3CCC2CC3)-c2cc(C)cc(C)c2)ccn1 |wD:9.9,THB:23:25:29.28:31.32,(22.5,6.49,;20.96,6.49,;20.2,5.14,;18.65,5.12,;17.89,3.79,;16.36,3.76,;15.61,2.41,;14.07,2.37,;13.34,1.02,;11.79,.95,;10.98,2.26,;11.06,-.4,;11.72,-1.8,;10.64,-2.86,;9.28,-2.15,;7.85,-2.68,;6.67,-1.68,;6.94,-.17,;8.37,.34,;9.55,-.64,;5.75,.81,;6.74,1.99,;4.57,1.79,;4.76,-.37,;5.29,-1.8,;3.26,-.12,;3.45,1.26,;1.99,1.91,;.64,1.3,;.36,-.08,;1.72,.55,;1.48,2.44,;1.92,3.54,;13.26,-1.92,;14.12,-.64,;15.66,-.75,;16.54,.53,;16.33,-2.13,;15.47,-3.41,;16.14,-4.82,;13.93,-3.29,;18.68,2.46,;20.22,2.47,;20.97,3.82,)|
CCCc1cc(CCNC[C@@H](C)c2c([nH]c3ccc(cc23)C(C)(C)C(=O)N2CC3CCC2CC3)-c2cc(C)cc(C)c2)ccn1 |wD:10.10,THB:24:26:30.29:32.33,(23.27,4.17,;22.21,3.05,;20.72,3.4,;19.67,2.29,;18.15,2.65,;17.1,1.53,;15.59,1.87,;14.55,.74,;13.04,1.06,;12.01,-.08,;10.48,.25,;10.01,1.72,;9.43,-.92,;9.76,-2.41,;8.44,-3.18,;7.3,-2.17,;5.77,-2.33,;4.86,-1.1,;5.49,.32,;7,.48,;7.91,-.75,;4.58,1.55,;5.81,2.47,;3.66,2.81,;3.33,.65,;3.51,-.87,;1.92,1.26,;2.45,2.56,;1.17,3.54,;-.28,3.26,;-.88,1.98,;.59,2.26,;.8,4.17,;1.5,5.15,;11.23,-2.9,;12.37,-1.87,;13.84,-2.34,;15,-1.31,;14.16,-3.85,;13,-4.88,;13.32,-6.41,;11.53,-4.41,;17.54,.04,;19.04,-.31,;20.09,.83,)|
C[C@H](CNCCc1ccnc(COC(C)=O)c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:29:31:35.34:37.38,(9.49,1.53,;9.96,.07,;11.48,-.26,;12.52,.89,;14.02,.56,;15.07,1.69,;16.57,1.34,;17.02,-.14,;18.52,-.49,;19.56,.64,;19.14,2.11,;20.19,3.23,;21.69,2.88,;22.13,1.4,;23.62,1.04,;21.07,.28,;17.62,2.46,;8.91,-1.1,;9.23,-2.6,;7.91,-3.36,;6.77,-2.34,;5.25,-2.5,;4.34,-1.27,;4.96,.13,;6.49,.3,;7.4,-.93,;4.06,1.38,;5.29,2.3,;3.13,2.63,;2.81,.48,;2.98,-1.05,;1.41,1.09,;1.92,2.37,;.66,3.35,;-.81,3.09,;-1.4,1.81,;.08,2.09,;.29,4,;.99,4.96,;10.7,-3.08,;11.01,-4.58,;12.48,-5.07,;12.78,-6.58,;13.64,-4.02,;13.31,-2.53,;14.46,-1.49,;11.84,-2.05,)|
C[C@H](CNCCc1ccnc(CO)c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:26:28:32.31:34.35,(9.34,2.52,;9.81,1.05,;11.34,.72,;12.38,1.87,;13.89,1.54,;14.93,2.68,;16.45,2.33,;16.89,.84,;18.4,.49,;19.44,1.63,;19.02,3.1,;20.07,4.22,;21.57,3.87,;17.5,3.45,;8.75,-.12,;9.08,-1.62,;7.76,-2.39,;6.62,-1.36,;5.08,-1.53,;4.17,-.29,;4.8,1.11,;6.32,1.28,;7.23,.05,;3.89,2.36,;5.13,3.29,;2.97,3.62,;2.64,1.47,;2.81,-.05,;1.22,2.07,;1.75,3.36,;.48,4.34,;-.98,4.08,;-1.58,2.8,;-.11,3.08,;.1,4.98,;.8,5.96,;10.55,-2.1,;11.7,-1.08,;13.17,-1.55,;14.33,-.51,;13.5,-3.05,;12.33,-4.1,;12.65,-5.62,;10.86,-3.61,)|
C[C@H](CNCCc1cc[n+]([O-])cc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:25:27:31.30:33.34,(10.97,2.42,;11.45,.95,;12.96,.62,;14,1.76,;15.5,1.44,;16.55,2.56,;18.06,2.23,;18.5,.74,;20,.39,;21.05,1.53,;22.54,1.18,;20.62,2.98,;19.1,3.35,;10.4,-.22,;10.72,-1.71,;9.4,-2.48,;8.26,-1.47,;6.74,-1.63,;5.83,-.4,;6.45,1.02,;7.98,1.18,;8.88,-.05,;5.55,2.25,;4.62,3.51,;6.78,3.17,;4.29,1.35,;4.47,-.17,;2.9,1.96,;3.41,3.25,;2.15,4.23,;.68,3.96,;.09,2.68,;1.57,2.96,;1.78,4.86,;2.48,5.84,;12.19,-2.2,;12.5,-3.7,;13.96,-4.18,;14.27,-5.71,;15.12,-3.15,;14.79,-1.64,;15.94,-.61,;13.33,-1.17,)|
C[C@H](CNCCc1cc[n+]([O-])c(C)c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,TLB:26:28:32.31:34.35,(10.97,2.41,;11.45,.95,;12.96,.62,;14,1.76,;15.5,1.44,;16.55,2.56,;18.05,2.23,;18.5,.74,;20,.39,;21.04,1.53,;22.53,1.18,;20.62,2.98,;21.67,4.12,;19.1,3.35,;10.4,-.22,;10.72,-1.71,;9.4,-2.48,;8.25,-1.47,;6.74,-1.63,;5.83,-.4,;6.45,1.02,;7.97,1.18,;8.88,-.05,;5.54,2.25,;4.62,3.51,;6.78,3.17,;4.29,1.35,;4.47,-.17,;2.9,1.96,;3.41,3.25,;2.15,4.23,;2.48,5.84,;1.78,4.86,;1.57,2.96,;.09,2.68,;.68,3.96,;12.18,-2.2,;13.33,-1.17,;14.79,-1.64,;15.94,-.61,;15.12,-3.14,;13.96,-4.18,;14.26,-5.71,;12.49,-3.7,)|
C[C@H](CNCCc1ccnc(C)c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:25:27:31.30:33.34,(9.76,-.05,;10.57,-1.37,;12.12,-1.31,;12.85,.04,;14.39,.09,;15.13,1.42,;16.67,1.46,;17.46,.13,;18.99,.14,;19.74,1.49,;18.97,2.81,;19.74,4.16,;17.43,2.78,;9.84,-2.75,;10.5,-4.13,;9.42,-5.19,;8.06,-4.47,;6.63,-5,;5.45,-4.01,;5.72,-2.51,;7.15,-1.99,;8.33,-2.96,;4.54,-1.52,;5.52,-.33,;3.36,-.54,;3.54,-2.7,;4.08,-4.13,;2.05,-2.44,;2.24,-1.07,;.78,-.4,;-.57,-1.02,;-.85,-2.4,;.51,-1.78,;.26,.11,;.71,1.21,;12.04,-4.24,;12.9,-2.96,;14.43,-3.08,;15.32,-1.8,;15.11,-4.45,;14.25,-5.73,;14.91,-7.14,;12.71,-5.62,)|
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C[C@H](CNCCc1ccnc(c1)C(C)(C)O)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,TLB:28:30:34.33:36.37,(9.42,2.46,;9.89,.99,;11.42,.67,;12.45,1.81,;13.96,1.48,;14.99,2.61,;16.5,2.28,;16.95,.78,;18.45,.43,;19.49,1.58,;19.07,3.03,;17.55,3.39,;20.11,4.15,;19.67,5.63,;18.58,4.12,;21.61,3.8,;8.84,-.17,;9.16,-1.66,;7.85,-2.43,;6.71,-1.42,;5.18,-1.58,;4.27,-.35,;4.9,1.06,;6.41,1.23,;7.32,-.01,;3.99,2.3,;3.08,3.56,;5.23,3.22,;2.75,1.4,;2.92,-.12,;1.34,2,;1.86,3.3,;.59,4.28,;.92,5.89,;.22,4.91,;.01,3.01,;-1.46,2.73,;-.86,4.01,;10.63,-2.15,;11.77,-1.13,;13.24,-1.59,;14.4,-.57,;13.57,-3.1,;12.4,-4.13,;12.72,-5.66,;10.93,-3.66,)|
CC(O)c1cc(CCNC[C@@H](C)c2c([nH]c3ccc(cc23)C(C)(C)C(=O)N2CC3CCC2CC3)-c2cc(C)cc(C)c2)ccn1 |wD:10.10,THB:24:26:30.29:32.33,(21.57,3.87,;20.07,4.22,;19.63,5.7,;19.02,3.1,;17.5,3.45,;16.45,2.33,;14.93,2.68,;13.89,1.54,;12.38,1.87,;11.34,.72,;9.81,1.05,;9.34,2.52,;8.75,-.12,;9.08,-1.62,;7.76,-2.39,;6.62,-1.36,;5.08,-1.53,;4.17,-.29,;4.8,1.11,;6.32,1.28,;7.23,.05,;3.89,2.36,;5.13,3.29,;2.97,3.62,;2.64,1.47,;2.81,-.05,;1.22,2.07,;1.75,3.36,;.48,4.34,;-.98,4.08,;-1.58,2.8,;-.11,3.08,;.1,4.98,;.8,5.96,;10.55,-2.1,;11.7,-1.08,;13.17,-1.55,;14.33,-.51,;13.5,-3.05,;12.33,-4.1,;12.65,-5.62,;10.86,-3.61,;16.89,.84,;18.4,.49,;19.44,1.63,)|
C[C@H](CNCCc1ccnc(c1)C(C)=O)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,TLB:27:29:33.32:35.36,(9.34,2.52,;9.81,1.05,;11.34,.72,;12.38,1.87,;13.89,1.54,;14.93,2.68,;16.45,2.33,;16.89,.84,;18.4,.49,;19.44,1.63,;19.02,3.1,;17.5,3.45,;20.07,4.22,;21.57,3.87,;19.63,5.7,;8.75,-.12,;9.08,-1.62,;7.76,-2.39,;6.62,-1.36,;5.08,-1.53,;4.17,-.29,;4.8,1.11,;6.32,1.28,;7.23,.05,;3.89,2.36,;2.97,3.62,;5.13,3.29,;2.64,1.47,;2.81,-.05,;1.22,2.07,;1.75,3.36,;.48,4.34,;.8,5.96,;.1,4.98,;-.11,3.08,;-1.58,2.8,;-.98,4.08,;10.55,-2.1,;10.86,-3.61,;12.33,-4.1,;12.65,-5.62,;13.5,-3.05,;13.17,-1.55,;14.33,-.51,;11.7,-1.08,)|
C[C@H](CNCCc1cc(C)[n+]([O-])c(C)c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,TLB:27:29:33.32:35.36,(10.97,2.59,;11.45,1.13,;12.96,.81,;14,1.95,;15.5,1.62,;16.55,2.74,;18.06,2.4,;19.11,3.53,;20.62,3.16,;21.67,4.28,;21.05,1.7,;22.54,1.35,;20,.57,;20.46,-.89,;18.5,.92,;10.4,-.03,;10.72,-1.54,;9.4,-2.31,;8.26,-1.29,;6.74,-1.45,;5.83,-.21,;6.45,1.19,;7.98,1.35,;8.89,.13,;5.55,2.44,;4.62,3.68,;6.78,3.35,;4.3,1.53,;4.47,.02,;2.9,2.14,;3.41,3.43,;2.15,4.4,;2.48,6.03,;1.78,5.05,;1.57,3.14,;.09,2.86,;.68,4.14,;12.19,-2.01,;12.5,-3.53,;13.97,-4.01,;14.27,-5.53,;15.12,-2.97,;14.8,-1.47,;15.95,-.43,;13.33,-.99,)|
C[C@H](CNCCc1ccnc(c1)C#N)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:26:28:32.31:34.35,(9.34,2.52,;9.81,1.05,;11.34,.72,;12.38,1.87,;13.89,1.54,;14.93,2.68,;16.45,2.33,;16.89,.84,;18.4,.49,;19.44,1.63,;19.02,3.1,;17.5,3.45,;20.07,4.22,;21.12,5.33,;8.75,-.12,;9.08,-1.62,;7.76,-2.39,;6.62,-1.36,;5.08,-1.53,;4.17,-.29,;4.8,1.11,;6.32,1.28,;7.23,.05,;3.89,2.36,;5.13,3.29,;2.97,3.62,;2.64,1.47,;2.81,-.05,;1.22,2.07,;1.75,3.36,;.48,4.34,;-.98,4.08,;-1.58,2.8,;-.11,3.08,;.1,4.98,;.8,5.96,;10.55,-2.1,;11.7,-1.08,;13.17,-1.55,;14.33,-.51,;13.5,-3.05,;12.33,-4.1,;12.65,-5.62,;10.86,-3.61,)|
C[C@H](CNCCc1cc[n+]([O-])cc1C)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,TLB:26:28:32.31:34.35,(10.97,2.59,;11.44,1.13,;12.96,.81,;14,1.95,;15.5,1.62,;16.54,2.74,;18.05,2.4,;18.49,.92,;19.99,.57,;21.04,1.7,;22.53,1.35,;20.61,3.16,;19.1,3.53,;18.65,5,;10.39,-.03,;10.71,-1.54,;9.39,-2.31,;8.25,-1.29,;6.74,-1.45,;5.83,-.21,;6.45,1.19,;7.97,1.35,;8.88,.13,;5.54,2.44,;4.62,3.68,;6.78,3.35,;4.29,1.53,;4.47,.02,;2.9,2.13,;3.41,3.42,;2.15,4.4,;2.48,6.02,;1.78,5.05,;1.57,3.14,;.09,2.86,;.68,4.14,;12.18,-2.01,;13.32,-.99,;14.79,-1.47,;15.94,-.43,;15.11,-2.97,;13.96,-4.01,;14.26,-5.53,;12.49,-3.52,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3ccnc(NC[C@H]4CCCO4)n3)c1)C(C)(C)CCC2(C)C
C[C@H](CNCCc1ccc2nc[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:27:29:34.35:31.32|
C[C@H](CNCCc1ccc2nc[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:27:29:33.32:35.36,(8.9,-1.99,;9.93,-3.13,;11.43,-2.8,;11.9,-1.33,;13.39,-1.01,;13.88,.46,;15.37,.78,;16.4,-.36,;17.9,-.03,;18.38,1.44,;19.77,2.06,;19.61,3.58,;18.1,3.9,;17.34,2.58,;15.84,2.25,;9.46,-4.59,;10.36,-5.84,;9.46,-7.08,;7.99,-6.6,;6.67,-7.36,;5.34,-6.6,;5.34,-5.06,;6.67,-4.29,;7.99,-5.06,;3.99,-4.29,;2.65,-3.52,;4.76,-2.96,;3.22,-5.64,;3.99,-6.97,;1.68,-5.64,;.92,-4.31,;-.42,-5.1,;-1.76,-4.33,;-1.35,-5.82,;-.02,-6.59,;-.02,-8.13,;-.79,-6.81,;11.88,-6.01,;12.51,-7.41,;14.05,-7.57,;14.67,-8.99,;14.95,-6.32,;14.33,-4.92,;15.23,-3.66,;12.79,-4.76,)|
C[C@H](CNCCCCc1cnc2nc[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:29:31:36.37:33.34|
C[C@H](CNCCc1ccc2nsnc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,(14.68,-8.52,;14.68,-10.28,;16.19,-11.15,;17.72,-10.28,;19.23,-11.15,;20.75,-10.28,;22.26,-11.17,;22.27,-12.92,;23.78,-13.78,;25.28,-12.89,;26.94,-13.43,;27.96,-12.03,;26.94,-10.61,;25.28,-11.15,;23.77,-10.28,;13.18,-11.15,;13.19,-12.69,;11.87,-13.46,;10.54,-12.69,;9.24,-13.48,;7.91,-12.73,;7.89,-11.2,;9.21,-10.43,;10.54,-11.18,;6.56,-10.43,;5.47,-9.35,;7.33,-9.1,;5.25,-11.22,;5.26,-12.74,;3.93,-10.46,;4.7,-9.1,;2.85,-8.22,;1.01,-9.29,;.27,-10.75,;2.03,-9.56,;1.87,-8.02,;2.71,-6.99,;14.52,-13.43,;15.82,-12.66,;17.16,-13.41,;18.49,-12.61,;17.17,-14.94,;15.86,-15.71,;15.87,-17.25,;14.52,-14.97,)|
C[C@H](CNCCc1ccc2ncoc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:27:29:34.35:31.32|
C[C@H](CNCCc1ccc2ncoc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:27:29:33.32:35.36,(14.68,-8.52,;14.68,-10.28,;16.19,-11.15,;17.72,-10.28,;19.23,-11.15,;20.75,-10.28,;22.26,-11.17,;22.27,-12.92,;23.78,-13.78,;25.28,-12.89,;26.94,-13.43,;27.96,-12.03,;26.94,-10.61,;25.28,-11.15,;23.77,-10.28,;13.18,-11.15,;13.19,-12.69,;11.87,-13.46,;10.54,-12.69,;9.24,-13.48,;7.91,-12.73,;7.89,-11.2,;9.21,-10.43,;10.54,-11.18,;6.56,-10.43,;7.33,-9.1,;5.47,-9.35,;5.25,-11.22,;5.26,-12.74,;3.93,-10.46,;3.9,-8.9,;1.86,-9.08,;1.11,-8.09,;.91,-9.4,;1.84,-10.65,;.91,-12.57,;.8,-10.94,;14.52,-13.43,;15.82,-12.66,;17.16,-13.41,;18.49,-12.61,;17.17,-14.94,;15.86,-15.71,;15.87,-17.25,;14.52,-14.97,)|
C[C@H](CNCCc1ccc2nc(CO)[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,(13.53,-2.59,;13.53,-4.34,;15.04,-5.21,;16.54,-4.34,;18.05,-5.21,;19.58,-4.34,;21.07,-5.22,;21.09,-6.97,;22.6,-7.81,;24.08,-6.94,;25.74,-7.47,;26.76,-6.07,;28.5,-6.07,;29.37,-7.59,;25.75,-4.67,;24.08,-5.21,;22.58,-4.34,;12.02,-5.21,;12.04,-6.73,;10.72,-7.51,;9.4,-6.75,;8.1,-7.52,;6.77,-6.78,;6.76,-5.25,;8.07,-4.48,;9.39,-5.22,;5.43,-4.5,;4.34,-3.41,;6.19,-3.16,;4.11,-5.27,;4.14,-6.8,;2.79,-4.52,;3.7,-3.24,;1.94,-2.18,;1.94,-.95,;1.01,-1.89,;1.01,-3.44,;-.86,-4.43,;.01,-3.05,;13.36,-7.49,;14.67,-6.7,;15.99,-7.44,;17.31,-6.67,;16.01,-8.98,;14.69,-9.76,;14.71,-11.28,;13.37,-9,)|
C[C@H](CNCCCc1cccc2ncccc12)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:29:31:36.37:33.34|
C[C@H](CNCc1ccc2nc[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,(14.69,-8.53,;14.69,-10.28,;16.2,-11.16,;17.73,-10.28,;19.25,-11.16,;20.77,-10.28,;22.07,-11.45,;23.74,-10.88,;24.09,-9.16,;25.59,-8.26,;25.19,-6.54,;23.45,-6.4,;22.76,-8.02,;21.11,-8.57,;13.19,-11.16,;13.2,-12.7,;11.88,-13.47,;10.55,-12.7,;9.25,-13.49,;7.92,-12.74,;7.89,-11.2,;9.22,-10.43,;10.55,-11.19,;6.57,-10.44,;5.48,-9.35,;7.34,-9.11,;5.26,-11.23,;5.27,-12.75,;3.93,-10.47,;4.71,-9.11,;2.85,-8.23,;1.01,-9.3,;.27,-10.76,;2.03,-9.57,;1.87,-8.03,;2.72,-6.99,;14.53,-13.44,;14.53,-14.98,;15.88,-15.73,;15.88,-17.26,;17.19,-14.96,;17.18,-13.42,;18.5,-12.62,;15.83,-12.67,)|
C[C@H](CNCCc1cnc2nc[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:27:29:33.32:35.36,(14.69,-8.66,;14.69,-10.42,;16.2,-11.29,;17.73,-10.42,;19.25,-11.29,;20.77,-10.42,;22.27,-11.29,;22.18,-13.04,;23.65,-14,;25.22,-13.19,;26.85,-13.81,;27.95,-12.43,;26.98,-10.97,;25.3,-11.44,;23.82,-10.5,;13.19,-11.29,;13.2,-12.83,;11.88,-13.6,;10.55,-12.83,;9.25,-13.62,;7.92,-12.88,;7.89,-11.34,;9.22,-10.57,;10.55,-11.32,;6.57,-10.57,;5.48,-9.49,;7.34,-9.24,;5.26,-11.36,;5.27,-12.88,;3.94,-10.6,;4.06,-9.03,;2,-9.01,;1.36,-7.95,;1.04,-9.25,;1.83,-10.57,;.73,-12.4,;.78,-10.76,;14.53,-13.57,;14.53,-15.11,;15.88,-15.86,;15.88,-17.4,;17.19,-15.09,;17.18,-13.55,;18.5,-12.75,;15.83,-12.8,)|
C[C@H](CNCCc1ccc2[nH]c(=O)[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,(13.53,-2.59,;13.53,-4.34,;15.04,-5.21,;16.54,-4.34,;18.05,-5.21,;19.58,-4.34,;21.07,-5.22,;21.09,-6.97,;22.6,-7.81,;24.08,-6.94,;25.74,-7.47,;26.76,-6.07,;28.5,-6.07,;25.75,-4.67,;24.08,-5.21,;22.58,-4.34,;12.02,-5.21,;12.04,-6.73,;10.72,-7.51,;9.4,-6.75,;8.1,-7.52,;6.77,-6.78,;6.76,-5.25,;8.07,-4.48,;9.39,-5.22,;5.43,-4.5,;4.34,-3.41,;6.19,-3.16,;4.11,-5.27,;4.14,-6.8,;2.79,-4.52,;3.7,-3.24,;1.94,-2.18,;.01,-3.05,;-.86,-4.43,;1.01,-3.44,;1.01,-1.89,;1.94,-.95,;13.36,-7.49,;13.37,-9,;14.69,-9.76,;14.71,-11.28,;16.01,-8.98,;15.99,-7.44,;17.31,-6.67,;14.67,-6.7,)|
C[C@H](CNCc1cccc2ncccc12)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:27:29:34.35:31.32|
C[C@H](CNCCc1ccc2[nH]ncc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,(14.98,-6.75,;14.98,-8.5,;16.49,-9.37,;18,-8.5,;19.5,-9.37,;21.03,-8.5,;22.52,-9.39,;22.55,-11.14,;24.05,-11.99,;25.53,-11.11,;27.19,-11.65,;28.21,-10.25,;27.2,-8.83,;25.53,-9.37,;24.03,-8.5,;13.47,-9.37,;13.49,-10.91,;12.18,-11.67,;10.85,-10.91,;9.55,-11.69,;8.23,-10.95,;8.21,-9.4,;9.52,-8.65,;10.84,-9.4,;6.89,-8.66,;7.64,-7.33,;5.79,-7.57,;5.56,-9.44,;5.59,-10.96,;4.24,-8.68,;5.16,-7.41,;3.39,-6.36,;3.39,-5.11,;2.46,-6.07,;2.46,-7.6,;.59,-8.61,;1.46,-7.23,;14.81,-11.65,;16.12,-10.88,;17.44,-11.62,;18.76,-10.83,;17.47,-13.15,;16.14,-13.92,;16.16,-15.46,;14.82,-13.18,)|
C[C@H](CNCCCCc1cncc2ccccc12)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:30:32:37.38:34.35|
C[C@H](CNCCc1ccc2nc([nH]c2c1)C(F)(F)F)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,(4.55,1.53,;4.55,-.22,;6.06,-1.1,;7.58,-.22,;9.09,-1.1,;10.62,-.22,;12.11,-1.12,;12.14,-2.88,;13.65,-3.73,;15.14,-2.85,;16.8,-3.38,;17.82,-1.97,;16.81,-.57,;15.14,-1.1,;13.63,-.22,;19.57,-1.97,;21.51,-1.91,;19.54,-3.57,;19.54,.02,;3.04,-1.1,;3.05,-2.64,;1.73,-3.41,;.41,-2.64,;-.9,-3.43,;-2.23,-2.69,;-2.25,-1.15,;-.93,-.38,;.4,-1.12,;-3.58,-.38,;-2.81,.95,;-4.67,.71,;-4.9,-1.15,;-4.88,-2.69,;-6.23,-.41,;-5.31,.87,;-7.08,1.93,;-7.08,3.18,;-8.02,2.22,;-8.02,.68,;-9.89,-.33,;-9.02,1.05,;4.38,-3.38,;5.69,-2.61,;7.02,-3.35,;8.34,-2.56,;7.04,-4.89,;5.72,-5.66,;5.73,-7.2,;4.39,-4.92,)|
C[C@H](CNCCCCc1cnc2nccnc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:30:32:37.38:34.35|
C[C@H](CNCCCc1cncc2ccccc12)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:29:31:36.37:33.34|
C[C@H](CNCCCc1cnc2nccnc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:29:31:36.37:33.34|
C[C@H](CNCCCCc1cccc2ncccc12)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:30:32:37.38:34.35|
C[C@H](CNCCc1ccc2nc([nH]c2c1)C(O)=O)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,(13.53,-2.59,;13.53,-4.34,;15.04,-5.21,;16.54,-4.34,;18.05,-5.21,;19.58,-4.34,;21.07,-5.22,;21.09,-6.97,;22.6,-7.81,;24.08,-6.94,;25.74,-7.47,;26.76,-6.07,;25.75,-4.67,;24.08,-5.21,;22.58,-4.34,;28.5,-6.07,;29.37,-7.59,;29.39,-4.56,;12.02,-5.21,;12.04,-6.73,;10.72,-7.51,;9.4,-6.75,;8.1,-7.52,;6.77,-6.78,;6.76,-5.25,;8.07,-4.48,;9.39,-5.22,;5.43,-4.5,;4.34,-3.41,;6.19,-3.16,;4.11,-5.27,;4.14,-6.8,;2.79,-4.52,;3.7,-3.24,;1.94,-2.18,;.01,-3.05,;-.86,-4.43,;1.01,-3.44,;1.01,-1.89,;1.94,-.95,;13.36,-7.49,;13.37,-9,;14.69,-9.76,;14.71,-11.28,;16.01,-8.98,;15.99,-7.44,;17.31,-6.67,;14.67,-6.7,)|
C[C@H](CNCCCCc1ccc2ncccc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:30:32:37.38:34.35|
C[C@H](CNCCCc1cccc2cnccc12)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:29:31:36.37:33.34|
C[C@H](CNCCCCc1ccc2cnccc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:30:32:37.38:34.35|
COC(=O)c1nc2ccc(CCNC[C@@H](C)c3c([nH]c4ccc(cc34)C(C)(C)C(=O)N3CC4CCC3CC4)-c3cc(C)cc(C)c3)cc2[nH]1 |wD:14.14,(31.12,-7.73,;29.38,-7.73,;28.5,-6.2,;29.39,-4.69,;26.76,-6.2,;25.74,-7.6,;24.09,-7.07,;22.6,-7.95,;21.1,-7.1,;21.07,-5.35,;19.58,-4.47,;18.05,-5.34,;16.54,-4.47,;15.04,-5.34,;13.53,-4.47,;13.53,-2.73,;12.02,-5.34,;12.04,-6.86,;10.72,-7.65,;9.4,-6.88,;8.1,-7.66,;6.77,-6.91,;6.76,-5.38,;8.07,-4.61,;9.39,-5.35,;5.43,-4.63,;4.34,-3.55,;6.19,-3.29,;4.11,-5.41,;4.14,-6.93,;2.79,-4.66,;3.7,-3.37,;1.94,-2.31,;.01,-3.18,;-.86,-4.56,;1.01,-3.57,;1.01,-2.02,;1.94,-1.08,;13.36,-7.62,;13.37,-9.14,;14.69,-9.9,;14.71,-11.41,;16.02,-9.11,;15.99,-7.58,;17.31,-6.8,;14.67,-6.83,;22.58,-4.47,;24.09,-5.34,;25.75,-4.8,)|
C[C@H](CNCCCc1ccnc2nc(C)ccc12)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:30:32:37.38:34.35|
C[C@H](CNCCc1cnc2nc[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:27:29:34.35:31.32|
C[C@H](CNCCCCc1ccnc2nc(C)ccc12)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:31:33:38.39:35.36|
C[C@H](CNCCc1ccc2nn[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,(13.54,-2.59,;13.54,-4.34,;15.05,-5.22,;16.55,-4.34,;18.06,-5.22,;19.59,-4.34,;21.08,-5.22,;21.11,-6.97,;22.62,-7.82,;24.1,-6.94,;25.76,-7.47,;26.77,-6.07,;25.77,-4.67,;24.1,-5.22,;22.59,-4.34,;12.03,-5.22,;12.04,-6.73,;10.73,-7.52,;9.41,-6.75,;8.1,-7.53,;6.78,-6.79,;6.76,-5.25,;8.07,-4.48,;9.4,-5.22,;5.44,-4.5,;6.19,-3.16,;4.34,-3.41,;4.11,-5.28,;4.14,-6.8,;2.79,-4.53,;3.71,-3.24,;1.94,-2.18,;1.94,-.95,;1.01,-1.89,;1.01,-3.44,;-.86,-4.43,;.01,-3.05,;13.37,-7.49,;14.67,-6.71,;16,-7.45,;17.32,-6.67,;16.02,-8.98,;14.7,-9.77,;14.72,-11.29,;13.38,-9.01,)|
C[C@H](CNCCc1ccc2[nH]c(=O)[nH]c2c1F)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,(13.53,-2.59,;13.53,-4.34,;15.04,-5.21,;16.54,-4.34,;18.05,-5.21,;19.58,-4.34,;21.07,-5.22,;21.09,-6.97,;22.6,-7.81,;24.08,-6.94,;25.74,-7.47,;26.76,-6.07,;28.5,-6.07,;25.75,-4.67,;24.08,-5.21,;22.58,-4.34,;22.58,-2.59,;12.02,-5.21,;12.04,-6.73,;10.72,-7.51,;9.4,-6.75,;8.1,-7.52,;6.77,-6.78,;6.76,-5.25,;8.07,-4.48,;9.39,-5.22,;5.43,-4.5,;6.19,-3.16,;4.34,-3.41,;4.11,-5.27,;4.14,-6.8,;2.79,-4.52,;3.7,-3.24,;1.94,-2.18,;1.94,-.95,;1.01,-1.89,;1.01,-3.44,;-.86,-4.43,;.01,-3.05,;13.36,-7.49,;13.37,-9,;14.69,-9.76,;14.71,-11.28,;16.01,-8.98,;15.99,-7.44,;17.31,-6.67,;14.67,-6.7,)|
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)N(C)Cc2ccccn2)c1=O |r|
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNCc2ccccc2OC)c1=O
Clc1ccc(c(Cl)c1)[C@@]1(Cn2ccnc2)OC[C@H](CNCc2c[nH]c3ccccc23)O1
Clc1ccc(c(Cl)c1)[C@@]1(Cn2ccnc2)OC[C@H](CNC(=O)C2CCC(=O)N2C(=O)OCc2ccccc2)O1
OC[C@H]1CO[C@@](Cn2ccnc2)(O1)c1ccc(Cl)cc1Cl
CCC(C)n1ncn(-c2ccc(cc2)N2CCN(CC2)c2ccc(OC[C@H]3CO[C@@](Cn4ccnc4)(O3)c3ccc(Cl)cc3Cl)cc2)c1=O
CC(=O)N1CCN(CC1)c1ccc(OC[C@@H]2CO[C@](Cn3ccnc3)(O2)c2ccc(Cl)cc2Cl)cc1 |r|
Clc1ccc(c(Cl)c1)[C@@]1(Cn2ccnc2)OC[C@H](COc2ccccc2)O1
Clc1ccc(c(Cl)c1)[C@@]1(Cn2ccnc2)OC[C@H](CNC(=O)[C@H](CC2=CNCN2)NC(=O)[C@@H]2CCCN2C(=O)OCC(c2ccccc2)c2ccccc2)O1 |t:26|
Clc1ccc(c(Cl)c1)[C@@]1(Cn2ccnc2)OC[C@H](CNC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCC(=O)N2C(=O)OCc2ccccc2)O1
Clc1ccc(c(Cl)c1)[C@@]1(Cn2ccnc2)OC[C@H](CN2C(=O)c3ccccc3C2=O)O1
CC(C)C[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CNC(=O)C[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)c1cccnc1)c1cccnc1
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CNCN1)C(=O)NC[C@H]1CO[C@@](Cn2ccnc2)(O1)c1ccc(Cl)cc1Cl |t:34|
CC(C)C[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)c1cccnc1)c1cccnc1
CC(C)C[C@H](NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |wU:31.34,19.28,4.4,82.87,96.103,wD:37.50,51.63,8.15,63.80,(18.89,-16.23,;17.36,-16.48,;17.11,-18,;16.26,-15.38,;16.65,-13.86,;18.17,-13.47,;19.27,-12.46,;17.75,-11.3,;20.15,-13.44,;19.89,-14.7,;20.76,-15.67,;20.12,-16.81,;21.09,-17.68,;19.99,-18.92,;18.66,-18.75,;20.44,-20.11,;21.38,-12.89,;22.58,-12.37,;23.68,-13.03,;22.84,-11.02,;24.1,-10.59,;24.1,-9.23,;22.93,-8.55,;22.93,-7.22,;24.1,-6.54,;24.1,-5.19,;25.26,-7.22,;25.26,-8.56,;21.61,-10.33,;20.44,-9.65,;19.27,-10.33,;20.44,-8.29,;21.64,-7.62,;21.64,-6.28,;19.27,-7.62,;18.21,-6.8,;16.91,-7.22,;18.59,-5.44,;19.99,-5.12,;20.15,-3.69,;19.08,-2.75,;19.66,-1.46,;21.06,-1.59,;22.09,-.65,;23.45,-1.07,;23.74,-2.46,;22.71,-3.4,;21.35,-2.98,;17.43,-4.56,;16.26,-3.73,;14.81,-4.24,;16.68,-2.23,;18.21,-1.82,;18.37,-.27,;19.76,.39,;19.92,1.94,;18.63,2.85,;18.76,4.4,;17.2,2.19,;17.07,.64,;15.42,-1.33,;14.16,-.4,;14.16,1.13,;12.7,-.95,;11.41,-.06,;11.5,1.49,;12.92,2.17,;13.03,3.72,;11.73,4.6,;11.83,6.15,;10.53,7.01,;9.14,6.33,;9.04,4.78,;10.33,3.91,;10.21,2.35,;12.67,-2.46,;11.31,-3.24,;11.31,-4.79,;9.98,-2.43,;15.55,-12.76,;15.97,-11.25,;14.06,-13.14,;12.51,-13.54,;11.93,-14.99,;12.77,-16.3,;11.83,-17.52,;12.41,-18.94,;11.28,-19.98,;9.76,-19.5,;11.57,-21.44,;11.67,-12.25,;12.25,-10.81,;10.18,-12.59,;9.56,-14,;8.01,-13.84,;7.68,-12.38,;9.01,-11.6,;9.14,-10.07,;10.57,-9.43,;7.88,-9.14,;6.52,-8.16,;6.94,-6.67,;5.68,-5.77,;8.43,-6.16,)|
[H][C@@]12CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)NC[C@H](NC2=O)C(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)[C@H](N)Cc1ccc2ccccc2c1 |wU:80.94,56.62,19.20,92.98,8.9,27.28,wD:50.65,66.81,38.39,1.0,(-10.63,7.13,;-11.56,5.52,;-12.59,6.66,;-14,6.04,;-13.84,4.51,;-12.33,4.18,;-11.3,3.04,;-9.87,3.62,;-11.23,1.36,;-12.54,.56,;-12.51,-.98,;-13.83,-1.78,;-13.79,-3.32,;-15.11,-4.12,;-15.08,-5.66,;-16.46,-3.38,;-9.89,.59,;-8.56,1.36,;-8.56,2.9,;-7.23,.59,;-7.23,-.95,;-8.56,-1.72,;-8.56,-3.26,;-9.89,-.95,;-5.89,1.36,;-4.56,.59,;-4.56,-.95,;-3.22,1.36,;-3.22,-.18,;-1.89,-.95,;-.56,-.18,;.78,-.95,;.78,-2.49,;2.11,-3.26,;-.56,-3.26,;-1.89,.59,;-.56,1.36,;.78,.59,;-.56,2.9,;.78,2.13,;2.11,2.9,;2.11,4.44,;3.44,5.21,;4.78,4.44,;6.11,5.21,;4.78,2.9,;3.44,2.13,;.78,3.67,;.78,5.21,;2.11,5.98,;-.56,5.98,;-1.89,5.21,;-3.22,5.98,;-3.22,7.52,;-4.56,5.21,;-5.89,5.98,;-7.23,5.21,;-8.56,5.98,;-10.05,5.2,;-9.38,3.81,;-7.23,6.75,;-5.89,7.52,;-8.56,7.52,;-.56,7.52,;.78,8.29,;.78,9.83,;2.11,7.52,;2.57,6.44,;3.91,4.74,;3.49,3.26,;4.61,2.25,;5.98,3.36,;7.49,3.1,;8.48,4.28,;7.95,5.73,;6.43,5.99,;5.44,4.8,;3.44,8.29,;4.78,7.52,;4.78,5.98,;6.11,8.29,;6.11,9.83,;4.78,10.6,;3.44,9.83,;2.11,10.6,;2.11,12.14,;.78,12.91,;3.44,12.91,;4.78,12.14,;7.44,7.52,;8.78,8.29,;8.78,9.83,;10.11,7.52,;10.11,5.98,;11.45,8.29,;12.78,7.52,;12.78,5.98,;14.11,5.21,;15.45,5.98,;16.78,5.21,;18.11,5.98,;18.11,7.52,;16.78,8.29,;15.45,7.52,;14.11,8.29,)|
CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@@H]1C=CCN1C(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(O)=O |c:73|
[H][C@@]12CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CSSC[C@H](NC2=O)C(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)[C@H](N)Cc1ccc2ccccc2c1 |wU:79.93,55.61,19.20,91.97,8.9,27.28,wD:50.64,65.80,38.39,1.0,(2.69,9.22,;1.76,10.83,;3.27,11.15,;3.43,12.69,;2.02,13.31,;.99,12.17,;-.52,11.85,;-.73,10.32,;-2.01,12.63,;-2.05,14.17,;-3.4,14.91,;-3.43,16.45,;-4.78,17.19,;-4.81,18.73,;-6.16,19.47,;-3.5,19.53,;-3.35,11.86,;-3.35,10.32,;-2.01,9.55,;-4.68,9.55,;-6.01,10.32,;-6.01,11.86,;-7.35,12.63,;-4.68,12.63,;-4.68,8.01,;-6.01,7.24,;-7.35,8.01,;-6.01,5.7,;-7.35,6.47,;-8.68,5.7,;-8.68,4.16,;-10.01,3.39,;-11.35,4.16,;-12.68,3.39,;-11.35,5.7,;-7.35,4.93,;-7.35,3.39,;-8.68,2.62,;-6.01,2.62,;-7.35,1.85,;-7.35,.31,;-6.01,-.46,;-6.01,-2,;-7.35,-2.77,;-7.35,-4.31,;-8.68,-2,;-8.68,-.46,;-6.01,1.08,;-4.68,.31,;-4.68,-1.23,;-3.35,1.08,;-3.35,2.62,;-2.01,3.39,;-2.01,4.93,;-.68,5.7,;-.68,7.24,;.66,8.01,;.73,9.69,;-.81,9.8,;.66,6.47,;1.99,7.24,;.66,4.93,;-2.01,.31,;-.68,1.08,;-.68,2.62,;.66,.31,;.66,-1.23,;-.68,-2,;-2.09,-1.38,;-3.12,-2.52,;-2.35,-3.86,;-2.82,-5.32,;-1.79,-6.46,;-.28,-6.14,;.19,-4.68,;-.84,-3.54,;1.99,1.08,;3.32,.31,;3.32,-1.23,;4.66,1.08,;4.66,2.62,;5.99,3.39,;5.99,4.93,;7.32,5.7,;8.66,4.93,;9.99,5.7,;8.66,3.39,;7.32,2.62,;5.99,.31,;7.32,1.08,;8.23,2.32,;8.66,.31,;8.66,-1.23,;9.99,1.08,;11.32,.31,;11.32,-1.23,;12.66,-2,;13.99,-1.23,;15.33,-2,;16.66,-1.23,;16.66,.31,;15.33,1.08,;13.99,.31,;12.66,1.08,)|
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CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CNC(=O)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(=O)NCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@@H](N)Cc1ccc2ccccc2c1
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[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(C)C(C)C)[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)cc1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(C)C(C)C)[C@@H](C)[C@H](OC(=O)CC(C)C)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)cc1
COC1CCN(C1)C(=O)C1CCN(CCc2c([nH]c3sc(cc23)C(C)(C)C(=O)N2C3CCC2CC3)-c2cc(C)cc(C)c2)CC1 |w:2.1,THB:26:28:30.31:33.34|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CCN1CCC(CC1)C(=O)N1CCCC(O)C1)C(C)(C)C(=O)N1C2CCC1CC2 |w:30.34,THB:36:38:40.41:43.44|
COC1CCN(CC1)C(=O)C1CCN(CCc2c([nH]c3sc(cc23)C(C)(C)C(=O)N2C3CCC2CC3)-c2cc(C)cc(C)c2)CC1 |THB:27:29:31.32:34.35|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CCN1CCC(CC1)C(=O)N1CCOCC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:35:37:39.40:42.43|
CC1CN(CCc2c([nH]c3sc(cc23)C(C)(C)C(=O)N2C3CCC2CC3)-c2cc(C)cc(C)c2)CCC1C(=O)N1CCOCC1 |w:36.42,1.0,THB:17:19:21.22:24.25|
C[C@H](CNC(=O)N1CCC(C1)c1ccccc1)c1c([nH]c2sc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:28:30:32.33:35.36|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1C(=O)CN1CCC(CC1)C(=O)N1CCOCC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:36:38:40.41:43.44|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CN1CCN(CC(=O)N2CCCC2)CC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:34:36:38.39:41.42|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CCN1CCC(CC(=O)N2CCOCC2)CC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:36:38:40.41:43.44|
C[C@H](CNC(=O)N1CCC(C1)c1ccccc1)c1c([nH]c2sc(cc12)C(C)(C)C(=O)N1CCCC1)-c1cc(C)cc(C)c1
CC(C)OC(=O)N=C(NC[C@@H](C)c1c([nH]c2sc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1)N1CCC(C1)c1ccncc1 |w:6.5,THB:23:25:27.28:30.31|
C[C@H](CNC(=O)N1CCC(CC1)c1ccncc1)c1c([nH]c2sc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:29:31:33.34:36.37|
CC(C)OC(=O)N=C(NC[C@@H](C)c1c([nH]c2sc(cc12)C(C)(C)C(=O)N(C)C)-c1cc(C)cc(C)c1)N1CCC(C1)c1ccncc1 |w:6.5|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CCN1CCN(CC(=O)N2CCCC2)CC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:35:37:39.40:42.43|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1C(=O)CN1CCN(CC(=O)N2CCCC2)CC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:36:38:40.41:43.44|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CCN1CCC(CC1)OCC(=O)N1CCOCC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:37:39:41.42:44.45|
COC(=O)N=C(NC[C@@H](C)c1c([nH]c2sc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1)N1CCC(C1)c1ccncc1 |w:4.3,THB:21:23:25.26:28.29|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CCN1CCC(CNC(=O)N2CCOCC2)CC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:37:39:41.42:44.45|
CN(C)C(=O)CN1CCN(CCc2c([nH]c3sc(cc23)C(C)(C)C(=O)N2C3CCC2CC3)-c2cc(C)cc(C)c2)CC1 |THB:23:25:27.28:30.31|
CC(C)OC(=O)N=C(NC[C@@H](C)c1c([nH]c2sc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1)N1CCC(CC1)c1ccncc1 |w:6.5,THB:23:25:27.28:30.31|
CCN(CC)CCOC1CCN(CCc2c([nH]c3sc(cc23)C(C)(C)C(=O)N2C3CCC2CC3)-c2cc(C)cc(C)c2)CC1 |THB:25:27:29.30:32.33|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CCN1CCN(CC(=O)N2CCOCC2)CC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:36:38:40.41:43.44|
CC(=O)N1CCN(CC(O)CN2CCN(CCc3c([nH]c4sc(cc34)C(C)(C)C(=O)N3C4CCC3CC4)-c3cc(C)cc(C)c3)CC2)CC1 |w:8.8,THB:28:30:32.33:35.36|
CC(=O)NC1CCN(C1)C(=O)CN1CCN(CCc2c([nH]c3sc(cc23)C(C)(C)C(=O)N2C3CCC2CC3)-c2cc(C)cc(C)c2)CC1 |w:4.3,THB:29:31:33.34:36.37|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CCN1CCN(CC(O)CN2CCNCC2)CC1)C(C)(C)C(=O)N1C2CCC1CC2 |w:23.26,THB:37:39:41.42:44.45|
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CCN1CCC(CC1)N1CCOCC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:33:35:37.38:40.41|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CN=C(N)N)CC1)C(C)(C)CCC2(C)C |(6.78,4.17,;7.56,2.84,;9.09,2.85,;9.88,1.51,;9.1,.17,;7.57,.17,;6.81,1.51,;5.27,1.5,;4.5,.17,;5.27,-1.17,;4.24,-2.31,;2.83,-1.68,;2.99,-.15,;1.5,-2.45,;1.5,-3.99,;.17,-1.68,;-1.17,-2.45,;-2.5,-1.68,;-3.84,-2.45,;-5.18,-1.68,;-5.18,-.13,;-6.51,.64,;-7.84,-.13,;-9.18,.63,;-10.51,-.14,;-9.18,2.17,;-3.84,.65,;-2.5,-.13,;9.86,-1.16,;8.32,-1.15,;10.63,-2.48,;11.41,-1.17,;12.19,.17,;11.42,1.52,;12.95,1.52,;11.01,3.01,)|
COc1cc(OC)c(NC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)c(OC)c1
COc1nc(F)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(CCC3(C)C)cc2C)o1
COc1nc(OCCF)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(CCC3(C)C)cc2C)o1
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)N(C)C(=O)c1cccnc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@@H](NC=O)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)NC(=O)c1cnccn1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](N(C)C=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)NC(=O)c1cccnc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)NC(=O)c1ccc(O)cc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)N(C)C(=O)c1ccc(Cl)cc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)N(C)C(=O)c1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)NC(=O)c1cn[nH]c1N)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](NC(=O)CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)N(C)C=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@H](N(C)C(=O)CCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](NC(C)=O)N(C)C(=O)c1ccc2ccccc2c1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)NC(=O)c1cn[nH]c1N)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@@H](NC(=O)CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)NC(NC(=O)CNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)NC(=O)c1ccncc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)CC(=O)N(C)[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)N(C)C=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)N(C)C(=O)c1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)NC(=O)c1cnccn1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](NC(C)=O)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](N)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](N(C)C(=O)CCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](NC=O)C(N)=O
CC(C)CC(=O)N[C@@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](NC(C)=O)NC(=O)c1ccc2ccccc2c1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CN[C@@H](NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)N(C)C(C)=O)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)NC(=O)c1cccnc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)NC(=O)c1ccncc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)CC(=O)N[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)NC(=O)c1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](NC=O)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](NC(C)=O)NC(=O)c1ccc2ccccc2c1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)N(C)C(=O)c1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](NC=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](NC(C)=O)N(C)C(=O)c1ccc2ccccc2c1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CN(C)CCCOc1c(-c2ccccc2)c(=O)[nH]c2cc(Cl)ccc12
CN1CCC(COc2c(-c3cc(C)cc(C)c3)c(=O)[nH]c3cc(Cl)ccc23)C1
CN1CCCCC(C1)Oc1c(-c2ccccc2)c(=O)[nH]c2cc(Cl)ccc12
CN1CCCC(COc2c(-c3cc(C)cc(C)c3)c(=O)[nH]c3cc(ccc23)[N+]([O-])=O)C1
CN1CCCC(COc2c(-c3ccccc3)c(=O)[nH]c3cc(Cl)ccc23)C1
CC(COc1c(-c2cc(C)cc(C)c2)c(=O)[nH]c2cc(Cl)ccc12)CN(C)C
CN1CCCCC1COc1c(-c2ccccc2)c(=O)[nH]c2cc(Cl)ccc12
CN1CCCC1CCOc1c(-c2cc(C)cc(C)c2)c(=O)[nH]c2cc(Cl)ccc12
Clc1ccc2c(OCc3ccccn3)c(-c3ccccc3)c(=O)[nH]c2c1
CN1CCCC(CC1)Oc1c(-c2cc(C)cc(C)c2)c(=O)[nH]c2cc(Cl)ccc12
CN1CCCC(COc2c(-c3cc(C)cc(C)c3)c(=O)[nH]c3cc(Cl)ccc23)C1
CN1CCCCC1CCOc1c(-c2cc(C)cc(C)c2)c(=[OH+])[n-]c2cc(Cl)c(cc12)[N+]([O-])=O
Cc1cc(C)cc(c1)-c1c(OCCCN2CCCCC2)c2ccc(Cl)cc2[nH]c1=O
CN1CCOC(COc2c(-c3cc(C)cc(C)c3)c(=O)[nH]c3cc(Cl)ccc23)C1
Cc1cc(C)cc(c1)-c1c(OCC2CCCNC2)c2ccc(Cl)cc2[nH]c1=O
CN1CCCCC1CCOc1c(-c2cc(C)cc(C)c2)c(=O)[nH]c2cc(Br)ccc12
CN1CCC(CC1)Oc1c(-c2cc(C)cc(C)c2)c(=O)[nH]c2cc(Cl)ccc12
CN1CCCCC1CCOc1c(-c2cc(C)cc(C)c2)c(=O)[nH]c2cc(Cl)ccc12
CN1CCCCC1COc1c(-c2cc(C)cc(C)c2)c(=O)[nH]c2cc(Cl)ccc12
CN1CCCCC(COc2c(-c3cc(C)cc(C)c3)c(=O)[nH]c3cc(Cl)ccc23)C1
CN1CCCC(COc2c(-c3cc(C)cc(C)c3)c(=O)[nH]c3cc(C)ccc23)C1
CN1CCCCC1CCOc1c(-c2cc(C)cc(C)c2)c(=O)[nH]c2cc(ccc12)C(F)(F)F
Cc1cc(C)cc(c1)-c1c(OCCC2CCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
Cc1cc(C)cc(c1)-c1c(OCC2CCCNC2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
Cc1cc(C)cc(c1)-c1c(OCCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CCC(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H]1CC(=O)N(CC(N)=O)C(=O)[C@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](CCC(O)=O)NC1=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)[C@@H](CCCNC(N)=N)NC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
CC(C)C[C@H]1NC(=O)[C@H](C)NC(=O)[C@@](C)(Cc2ccc(O)cc2)NC(=O)[C@@H](CC(=O)NCC(NC(=O)[C@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@@H]1CCCN1C(C)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CCC(=O)NCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CCC(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC)NC1=O)C(=O)N1CCC[C@@H]1C(=O)NC(CN)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)[C@@H](CCCNC(N)=N)NC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCCNC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CCC(=O)C(C)(C)OC(C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC1=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CCC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc3cccnc3)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O)cc2
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CCC(=O)NCCC(=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)CNC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CCC(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)N(CC(O)=O)C(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC1=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)[C@@H](Cc3ccccc3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)CN(C)C(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)[C@H](Cc3ccccc3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)[C@@H](Cc3ccccc3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CSSC[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H]1CC(=O)NCC(NC(=O)[C@H]2CCCN2C(=O)C2CCNC(=O)CNC(=O)C[C@@H](NC1=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCCNC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CC)C(=O)N[C@@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc3cccnc3)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O)cc2
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CC(=O)NCC(NC(=O)[C@H]2CCCN2C(=O)[C@@H]2CCCCNC(=O)CC[C@@H](NC1=O)C(=O)N[C@@H](CC)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCCNC(=O)[C@@H](Cc3ccccc3)NC(=O)C[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NCC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC1=O)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)CCNC(=O)C[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC1=O)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)N[C@@H]1CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC1=O)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O)C(O)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCCNC(=O)C(Cc3ccccc3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)[C@@H](Cc3cnc[nH]3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)C(Cc3ccccc3)NC(=O)C[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)[C@@H](CC)NC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NCC(NC(=O)[C@@H]2CCCN2C(=O)C2CCNC(=O)[C@@H](Cc3ccc(Cl)cc3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC(C)C)C(=O)N2)C(N)=O
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CCC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O)cc2
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CC(=O)NCC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O)cc2
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CCC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O)cc2
CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCC(=O)N(CC(N)=O)C(=O)[C@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](CCC(O)=O)NC1=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CCC(=O)NCCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)NCCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C1CC(=O)NCCC(=O)NCCCC(NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H]1NC(=O)C(Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(=O)NC(CNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCNC(N)=N)NC1=O)C(O)=O)NC(=O)C1CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)N1)NC(C)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C1CNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(CCCNC(N)=N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)NCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C1CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)NC(C)C(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CCCCC1C[C@@H](NC(=O)CNC(=O)CC(NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(Cc1ccc2ccccc2c1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(CCCNC(N)=N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)NC(C)C(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CCCCC1CC(NC(=O)CCC(NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(Cc1ccc2ccccc2c1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)NCCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)N[C@H](C)C(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CCC(=O)NCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)NCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C1CC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)NCC(NC(C)=O)C(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CCCCC1C[C@@H](NC(=O)CCNC(=O)CC(NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(Cc1ccc2ccccc2c1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H]1NC(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2CCC(=O)NCCCCC(NC1=O)C(=O)N1CCC[C@@H]1C(=O)NCC(NC(=O)C[C@@H](NC(=O)[C@H]1CCCCNC(=O)[C@@H](Cc3ccc(Cl)cc3)NC(=O)C(CCC(=O)N1)NC(C)=O)C(=O)N2)C(O)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)NCCCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C1CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CCCCC1C[C@@H](NC(=O)[C@@H](C)NC(=O)CC(NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(Cc1ccc2ccccc2c1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CCCCC1C[C@@H](NC(=O)CNC(=O)CCC(NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(Cc1ccc2ccccc2c1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@@H](NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CCC(=O)NCC(=O)N1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CCCCC1C[C@@H](NC(=O)C(C)NC(=O)CC(NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(Cc1ccc2ccccc2c1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NC(C)C(N)=O
CC(C)C[C@H]1NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H]2CSSC[C@H](NC(C)=O)C(=O)N[C@@H](Cc3ccc(Cl)cc3)C(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)N[C@H](CC(=O)NC[C@@H](NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)C(=O)N2
CC(C)C[C@H]1NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H]2CNC(=O)CNC(=O)CC[C@@H](NC(C)=O)C(=O)N[C@@H](Cc3ccc(Cl)cc3)C(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)N[C@H](CC(=O)NC[C@@H](NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)C(=O)N2
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CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)NCCCC[C@@H](NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CNC(=O)C[C@H](NC(=O)[C@@H](Cc1c[nH]c3ccccc13)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc3ccccc3c1)NC(C)=O)C(=O)N2)C(N)=O
CCn1nccc1NC(=O)c1cc2c(OCCC3CCCC[NH2+]3)c(-c3cc(C)cc(C)c3)c(=O)[nH]c2cc1Cl
Cc1cc(NC(=O)c2cc3c(OCCC4CCCC[NH2+]4)c(-c4cc(C)cc(C)c4)c(=O)[nH]c3cc2Cl)sn1
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3cc(C)ncn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCC[NH2+]2)c2cc(C(=O)Nc3cc(C)nc(C)n3)c(Cl)cc2[nH]c1=O
CN(C)c1ccc(NC(=O)c2cc3c(OCCC4CCCC[NH2+]4)c(-c4cc(C)cc(C)c4)c(=O)[nH]c3cc2Cl)cc1
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3ccc(c(Cl)c3)-c3ccccc3)c(=[OH+])[n-]c2cc1Cl
Cc1cc(cc(C)c1C)-c1c(OCC[C@@H]2CCCCN2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCC[C@@H]2CCCCN2)c2cc(NC(=O)NC3CC3)c(Cl)cc2[nH]c1=O
Cc1cc(CC#N)cc(c1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
Cc1cc(C)cc(c1)-c1c(OCC[C@@H]2CCCCN2)c2cc(NC(=O)Nc3cncnc3)c(Cl)cc2[nH]c1=O
Cc1cccc(c1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
Cc1cc(C)cc(c1)-c1c(OCC[C@@H]2CCCCN2)c2cc(NC(=O)c3cnccn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCC[C@@H]2CCCCN2)c2cc(NC(=O)Nc3cnccn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCC[C@@H]2CCCCN2)c2cc(NC(=O)c3cncnc3)c(Cl)cc2[nH]c1=O
Clc1cc2[nH]c(=O)c(-c3ccc4ccccc4c3)c(OCCC3CCCCN3)c2cc1NC(=O)NC1CC1
Clc1cc(Cl)cc(c1)-c1c(OCC[C@@H]2CCCCN2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCC[C@@H]2CCCCN2)c2cc(NC(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
Clc1ccc(s1)-c1c(OCC[C@@H]2CCCCN2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3ccccc3)c(=[OH+])[n-]c2cc1Cl
COc1ccc(cc1OC)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)cc3)c(=[OH+])[n-]c2cc1Cl
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3ccsc3)c(=[OH+])[n-]c2cc1Cl
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(Cl)cc(Cl)c3)c(=[OH+])[n-]c2cc1Cl
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3cccs3)c(=[OH+])[n-]c2cc1Cl
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3ccc4ccccc4c3)c(=[OH+])[n-]c2cc1Cl
Clc1ccc(cc1Cl)-c1c(OCCC2CCCCN2)c2cc(NC(=O)NC3CC3)c(Cl)cc2[nH]c1=O
Cc1cc(ccc1I)-c1c(OCC[C@@H]2CCCCN2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3cccc(Br)c3)c(=[OH+])[n-]c2cc1Cl
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(C(=O)Nc3cnccn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)Nc3ncccn3)c(Cl)cc2[nH]c1=O
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(cc(c3)C(F)(F)F)C(F)(F)F)c(=[OH+])[n-]c2cc1Cl
Clc1cc2[nH]c(=O)c(-c3cccc(Br)c3)c(OCCC3CCCCN3)c2cc1NC(=O)NC1CC1
Cc1ccc(cc1C)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
CCN(CC)Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
Cc1ccc(c(C)c1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O |(16.25,-4.21,;14.92,-4.98,;13.58,-4.21,;12.25,-4.98,;12.25,-6.51,;13.58,-7.29,;13.56,-8.83,;14.91,-6.52,;10.9,-7.26,;9.57,-6.49,;9.57,-4.95,;8.24,-4.18,;8.24,-2.64,;6.91,-1.87,;5.58,-2.64,;4.25,-1.87,;4.25,-.33,;5.58,.44,;6.91,-.33,;8.24,-7.26,;6.91,-6.49,;5.58,-7.28,;5.58,-8.82,;4.23,-9.59,;6.91,-9.59,;8.24,-8.8,;9.57,-9.59,;10.9,-8.82,;12.23,-9.59,;4.25,-6.51,;4.25,-4.97,;2.9,-7.28,)|
Clc1cc2[nH]c(=O)c(-c3ccc4CCCc4c3)c(OCC[C@@H]3CCCCN3)c2cc1C(=O)Nc1ccncn1
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)c(Cl)c3)c(=[OH+])[n-]c2cc1Cl
Cc1cccc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)NC3CC3)c(Cl)cc2[nH]c1=O
Cc1cc(CC(N)=O)cc(c1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)s3)c(=[OH+])[n-]c2cc1Cl
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)Nc3ccncc3)c(Cl)cc2[nH]c1=O
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3cccc(F)c3)c(=[OH+])[n-]c2cc1Cl
CC(O)c1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
COc1ccc(cc1C)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3cccc(Cl)c3)c(=[OH+])[n-]c2cc1Cl
Cc1ccc(cc1C)-c1c(OCCC2CCCCN2)c2cc(NC(=O)NC3CC3)c(Cl)cc2[nH]c1=O
CC(C)(C)c1ccc(cc1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
Cc1ccc(cc1C)-c1c(OCC[C@@H]2CCCCN2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
[O-][N+](=O)c1cc2c(OCCC3CCCCN3)c(-c3ccccc3Cl)c(=[OH+])[n-]c2cc1Cl |(4.91,-4.97,;4.91,-6.51,;3.58,-7.28,;6.24,-7.28,;7.57,-6.49,;8.91,-7.26,;10.24,-6.49,;10.24,-4.95,;8.91,-4.18,;8.91,-2.64,;7.57,-1.87,;6.25,-2.64,;4.91,-1.87,;4.92,-.33,;6.26,.44,;7.58,-.33,;11.58,-7.26,;12.91,-6.51,;12.91,-4.98,;14.24,-4.21,;15.59,-4.98,;15.57,-6.52,;14.24,-7.29,;14.24,-8.83,;11.58,-8.82,;12.91,-9.59,;10.24,-9.59,;8.9,-8.8,;7.57,-9.59,;6.24,-8.82,;4.91,-9.59,)|
[O-][N+](=O)c1cccc(c1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
Clc1ccc(cc1Cl)-c1c(OCC[C@@H]2CCCCN2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
CC(=O)OCc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
CCC(C)C(N)C(=O)NC(C(C)CC)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC(CC(C)C)C(=O)NC(CC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
CCC(C)C(N)C(=O)NC(C(C)CC)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N[C@H](C)C(=O)NC(CC(C)C)C(=O)NC(CC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
CCC(C)C(N)C(=O)NC(C(C)CC)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(CC(C)C)C(=O)NC(CC(O)=O)C(O)=O
CC[C@H](C)[C@@H]1NC(=O)CSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](NC1=O)[C@@H](C)CC)C(O)=O
CCC(C)C(N)C(=O)NC(C(C)CC)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)NC(CC(C)C)C(=O)NC(CC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)n1c(O)c(Cc2c[nH]c3ccccc23)[nH]c1=O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
CCC(C)C(N)C(=O)NC(C(C)CC)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC(CC(C)C)C(=O)NC(CC(O)=O)C(O)=O
CC[C@H](C)[C@@H]1NC(=O)[C@@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](NC1=O)[C@@H](C)CC
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)C1(CCC1)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)CN(C)C(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)C(CCCNC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
CC(C)C[C@@H](NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1cccc2ccccc12)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCCNNC(=O)c1cccnc1)NC(=O)[C@H](C)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H]1CCCN1C(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)CCNC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCCN)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
CC(C)NCCCC[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)CNC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
CCCCC(NC(=O)[C@H](C)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
CCCCC(NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)c1ccccc1NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)C(CCCNC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](C)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(N)=O
C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc2ccccc2c1)C(N)=O
Oc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cccc3ccccc23)cc1
Cc1ccccc1-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1
Cc1cccc(C)c1-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1 |(7.92,-4.74,;8.38,-6.21,;9.88,-6.56,;10.32,-8.03,;9.29,-9.17,;7.78,-8.82,;6.73,-9.95,;7.33,-7.36,;5.82,-7.01,;4.74,-8.08,;3.37,-7.36,;1.94,-7.89,;.75,-6.91,;1.03,-5.4,;2.46,-4.86,;3.64,-5.84,;5.16,-5.63,;5.89,-4.25,;7.44,-4.2,;8.17,-2.85,;9.71,-2.8,;10.46,-1.45,;12,-1.42,;12.76,-.08,;14.31,-.05,;15.08,-1.38,;16.62,-1.38,;17.39,-.05,;18.93,-.05,;16.62,1.3,;15.07,1.28,)|
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNCCCc1ccc(O)cc1
Cc1cccc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1
Oc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNC(=O)CCCc1ccc(cc1)[N+]([O-])=O
Oc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cccc3cnccc23)cc1
Cn1ccc2cc(ccc12)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCCc1ccc(O)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNC(=O)CCCc1ccc(O)cc1
Cc1cccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1C
Oc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2ccccc2)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(cc1)[N+]([O-])=O
COc1cccc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1
Oc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc3ccccc3s2)cc1
Cc1ccc(cc1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNC[C@@H](O)COc1ccc(O)cc1
Oc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(Cl)cc(Cl)c2)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCc1ccc(O)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNCCCCCCc1ccc(O)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNC[C@H](O)CCc1ccc(O)cc1
Oc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2csc3ccccc23)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(OCc2ccccc2)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNC[C@H](O)COc1ccc(O)cc1
Oc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2ccc(F)cc2)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNCCCCCc1ccc(O)cc1
Oc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2ccc3ccccc3c2)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCc1ccc(O)cc1
COc1cc(OC)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNC(=O)CCCc1ccc(N)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCCCc1ccc(O)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCc1ccc(O)cc1
CCc1cccc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(N)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNCCc1ccc(O)cc1
Cc1ccc(C)c(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1
COc1ccc(cc1OC)-c1[nH]c2ccccc2c1CCNCc1ccc(O)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(OC(=O)N3CCN(CC3)S(C)(=O)=O)cc2c1CCNCCCCc1ccc(O)cc1
CCNC(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(OC(=O)N3CCCCC3)cc2c1CCNCCCCc1ccc(O)cc1
CCCS(=O)(=O)N1CCN(CC1)C(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CCCNC(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CCC(=O)N1CCN(CC1)C(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CCCC(=O)N1CCN(CC1)C(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
COc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CCOC(=O)N1CCN(CC1)C(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CC(C)S(=O)(=O)N1CCN(CC1)C(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(OC(=O)N3CCNCC3)cc2c1CCNCCCCc1ccc(O)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1CCNCCCCc1ccc(O)cc1
CN1CCN(CC1)C(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(OCc3ccccc3)cc2c1CCNCCCCc1ccc(O)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(OC(=O)N3CCN(CC(N)=O)CC3)cc2c1CCNCCCCc1ccc(O)cc1
CCS(=O)(=O)N1CCN(CC1)C(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CC(=O)N1CCN(CC1)C(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CNC(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CN(C)C(=O)Oc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(cc(C)c1C)-c1c(OCC[C@@H]2CCN2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O |r|
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(cc1)S(N)(=O)=O
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(cc1)[N+]([O-])=O
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(N)cc1
CC(C)S(=O)(=O)Nc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(C)cc(C)c2)cc1
CNS(=O)(=O)Nc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(C)cc(C)c2)cc1
CC(=O)Nc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(C)cc(C)c2)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(NS(C)(=O)=O)cc1
CNC(=O)Nc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(C)cc(C)c2)cc1
CCNS(=O)(=O)Nc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(C)cc(C)c2)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(F)cc1
CCNC(=O)Nc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(C)cc(C)c2)cc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(NS(=O)(=O)c2ccccc2)cc1
CCS(=O)(=O)Nc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(C)cc(C)c2)cc1
CC(=O)Nc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(C)cc(C)c2)cn1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCc1ccccn1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1cccnc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCc1cccnc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCc1ccncc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCc1ccccn1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccncc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1cncnc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccccn1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc2CCCCc2c1
COc1ccc(CCCCNCCc2c([nH]c3ccccc23)-c2cc(C)cc(C)c2)cn1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCc1ccncc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1cnc[nH]1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCCc1cccnc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(NS(C)(=O)=O)nc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1cnc2ccccc2c1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(=O)[nH]c1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCc1cccnc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCc1cccnc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCCc1ccncc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCc1ccncc1
Cc1cc(C)cc(c1)-c1[nH]c2ccccc2c1CCNCCCCc1ccc(N)nc1
CCNC(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccc(O)cc1)C(=O)NCc1ccccc1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCN(CCCCc1ccc(O)cc1)C(=O)OCc1ccccc1)C(O)=O
CCOC(=O)c1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
CN(C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CC1CCC(C)N1C(=O)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1cccnc1)C(=O)N1CCOCC1
CCN(CCO)C(=O)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccncc1)C1(CCC1)C(=O)N1C2CCC1CC2 |THB:34:36:38.39:41.42|
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1cccnc1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:33:35:37.38:40.41|
CC(C)CN(CCCCc1ccncc1)CCc1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:29:31:33.34:36.37|
CC(C)N(CCCCc1ccncc1)CCc1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:28:30:32.33:35.36|
Cc1cc(C)cc(c1)-c1[nH]c2ccc(cc2c1CCNCCCCc1ccncc1)C(C)(C)C(=O)N1CCOCC1
CCCCN(CCCC)C(=O)c1ccc2[nH]c(c(CCNCCCCc3ccncc3)c2c1)-c1cc(C)cc(C)c1
CN(C)C(=O)c1ccc2[nH]c(c(CCNCCCCc3cccnc3)c2c1)-c1cc(C)cc(C)c1
C[C@H](CNCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C[C@H]2CC[C@@H]1C2)-c1cc(C)cc(C)c1 |TLB:24:26:32:30.29|
C[C@H](CNCCC1CCC(=O)N(C)C1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,TLB:26:28:32.31:34.35,(5.93,1.35,;6.7,.02,;8.24,,;9.01,1.33,;10.55,1.32,;11.32,2.65,;12.86,2.65,;13.63,3.98,;15.17,3.98,;15.94,2.63,;17.48,2.63,;15.17,1.3,;15.92,-.03,;13.63,1.31,;5.91,-1.31,;6.53,-2.73,;5.39,-3.74,;4.06,-2.97,;2.6,-3.44,;1.47,-2.41,;1.8,-.91,;3.25,-.44,;4.39,-1.48,;.66,.13,;-.44,1.23,;2.15,.54,;-.81,-.33,;-1.14,-1.84,;-2.05,.6,;-1.65,1.93,;-2.82,2.33,;-4.43,1.7,;-5.08,.2,;-3.63,.82,;-3.63,2.98,;-2.82,4.08,;8.03,-3.06,;9.06,-1.91,;10.57,-2.24,;11.6,-1.1,;11.04,-3.71,;10.01,-4.85,;10.48,-6.31,;8.5,-4.53,)|
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CCC2)-c1cc(C)cc(C)c1 |THB:26:28:30.31:34.35.33|
C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C[C@@H]2CC[C@H]1C2)-c1cc(C)cc(C)c1 |TLB:26:28:34:32.31|
C[C@H](CNCCc1cccn(C)c1=O)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:26:28:32.31:34.35,(5.93,1.35,;6.7,.02,;8.24,,;9.01,1.33,;10.55,1.32,;11.32,2.65,;12.86,2.65,;13.63,3.98,;15.17,3.98,;15.94,2.63,;15.17,1.3,;15.92,-.03,;13.63,1.31,;12.84,-.02,;5.91,-1.31,;6.53,-2.73,;5.39,-3.74,;4.06,-2.97,;2.6,-3.44,;1.47,-2.41,;1.8,-.91,;3.25,-.44,;4.39,-1.48,;.66,.13,;2.15,.54,;-.44,1.23,;-.81,-.33,;-1.14,-1.84,;-2.05,.6,;-1.65,1.93,;-2.82,2.33,;-2.82,4.08,;-3.63,2.98,;-3.63,.82,;-5.08,.2,;-4.43,1.7,;8.03,-3.06,;9.06,-1.91,;10.57,-2.24,;11.6,-1.1,;11.04,-3.71,;10.01,-4.85,;10.48,-6.31,;8.5,-4.53,)|
CC(C)C[C@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCNOC(=O)c1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NOC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCNCc1cc(O)c2C(=O)c3c(O)cc(cc3C(=O)c2c1)C(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NOC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCNC(=O)CC=Nc1c(O)c2ccccc2c(O)c1Cl)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NOC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |w:17.16|
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OCC(C)C)cc1
CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(c(CN(C)CCc3ccncc3)n2c1=O)-c1ccc(OCC(C)C)cc1
CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC2CCCC2)cc1
CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(c(CN(C)CCc3cccnc3)n2c1=O)-c1ccc(OCC(C)C)cc1
CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(CC2CC2)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CN(CCc1ccccn1)Cc1c(c(C#N)c2n(Cc3ccccc3F)cc(C(=O)OC3CCCC3)c(=O)n12)-c1ccc(OC2CCCC2)cc1
CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OCC(C)C)cc1
CCOC(=O)c1cn(Cc2ccccc2)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OCC(C)C)cc1
COc1ccc(cc1)-c1c(CN(C)CCc2ccccn2)n2c(c1C#N)n(Cc1ccccc1F)cc(C(=O)OC(C1CC1)C1CC1)c2=O
COc1ccc(cc1)-c1c(CN(C)CCc2ccccn2)n2c(c1C#N)n(Cc1ccccc1F)cc(C(=O)OC1CCCC1)c2=O
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2)c2c(C#N)c(c(CN(C)C)n2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2OC)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OCC(C)C)cc1
CCOC(=O)c1cn(Cc2ccccc2C#N)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
Cc1cc(cc(C)c1C)-c1c(OCC[C@@H]2CCN2)c2cc(ccc2[nH]c1=O)C(=O)Nc1ccncn1
CCOC(=O)c1cn(Cc2ccccc2)c2c(C#N)c(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2OC)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2cc(F)ccc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OCC(C)C)cc1
CCOC(=O)c1cn(Cc2cccc(F)c2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(c(CN(C)CCc3ccccc3)n2c1=O)-c1ccc(OCC(C)C)cc1
CCOC(=O)c1cn(Cc2cc(F)ccc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OCC(C)C)cc1
CCOC(=O)c1cn(Cc2ccccc2Cl)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
COc1ccc(cc1)-c1c(CN(C)CCc2ccccn2)n2c(c1C#N)n(Cc1ccccc1F)cc(C(=O)OC1CCOC1)c2=O
CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
COc1ccc(cc1)-c1c(CN(C)CCc2ccccn2)n2c(c1C#N)n(Cc1ccccc1F)cc(C(=O)OC(C)C)c2=O
CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(C)=O)cc1
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)NC(CC)CC)c(=O)n2c1CN(C)CCc1ccccn1
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)OCC)c(=O)n2c1CN(C)CCc1ccccn1
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)NCCCc3ccccc3)c(=O)n2c1CN(C)CCc1ccccn1
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)NCCOC)c(=O)n2c1CN(C)CCc1ccccn1
CCOC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)C(C)C)cc1
CCCCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(NC(=O)CCC)cc1
CN(CCc1ccccn1)Cc1c(cc2n(Cc3ccccc3F)cc(C3=NC(C)(C)CO3)c(=O)n12)-c1ccc(cc1)[N+]([O-])=O |t:28|
CCOC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(N)cc1
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)C
CCOC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(NC(=O)C(C)C)cc1
CCOC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(cc1)[N+]([O-])=O
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)CCc1ccccn1
CCOC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(C)=O)cc1
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)CCN(CC)CC
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)NC3CCCC3)c(=O)n2c1CN(C)CCc1ccccn1
CCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)CCC)cc1
CCOC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(NC(C)=O)cc1
CCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(NC(=O)CCC)cc1
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)CCc1ccccc1
CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(N)cc1
CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(OC)cc1
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)Cc1ccccc1
CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CN(CCc1ccccn1)Cc1c(cc2n(Cc3ccccc3F)cc(-c3nc(co3)C(C)(C)C)c(=O)n12)-c1ccc(cc1)[N+]([O-])=O
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)NCCCc3ccccc3)c(=O)n2c1CN(C)Cc1ccccc1
CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)NC3CCCCC3)c(=O)n2c1CN(C)CCc1ccccn1
CCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(c(CN(C)CCN(CC)CC)n2c1=O)-c1ccc(NC(=O)CCC)cc1
C[C@H](CNCCCc1ccc2cnccc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:29:31:33.34:37.36|
C[C@H](CNCCCc1ccc2ncccc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:29:31:36.37:33.34|
C[C@H](CNCCc1ccc2nc(C)[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:28:30:32.33:36.35|
C[C@H](CNCCc1ccc2nn[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |TLB:27:29:31.32:35.34|
C[C@H](CNCCc1cnc2nn[nH]c2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,(13.54,-2.6,;13.54,-4.34,;15.05,-5.22,;16.56,-4.34,;18.07,-5.22,;19.6,-4.34,;21.09,-5.23,;21.12,-6.98,;22.63,-7.82,;24.11,-6.95,;25.77,-7.48,;26.79,-6.07,;25.78,-4.67,;24.11,-5.22,;22.6,-4.34,;12.03,-5.22,;12.05,-6.74,;10.74,-7.52,;9.41,-6.75,;8.11,-7.53,;6.78,-6.79,;6.76,-5.25,;8.08,-4.49,;9.4,-5.23,;5.44,-4.5,;6.2,-3.16,;4.34,-3.42,;4.11,-5.28,;4.14,-6.81,;2.79,-4.53,;3.71,-3.24,;1.94,-2.18,;1.94,-.95,;1.01,-1.89,;1.01,-3.44,;-.87,-4.43,;.01,-3.06,;13.38,-7.5,;14.68,-6.71,;16.01,-7.45,;17.33,-6.68,;16.03,-8.99,;14.71,-9.77,;14.73,-11.29,;13.39,-9.02,)|
C[C@H](CNCCc1ccc2ocnc2c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:27:29:34.35:31.32|
C[C@H](CNCCCCc1cccc2cnccc12)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:30:32:37.38:34.35|
C[C@H](CNCCc1cccc2cnccc12)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |THB:28:30:35.36:32.33|
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OC(C)C)c(=O)n2c1CN(C)Cc1ccccc1
CONC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OC(C)C)c(=O)n2c1CN(C)Cc1ccccc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)C=C)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)C(C)C)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)C2CC2)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)c2ccccc2)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)c2ccoc2)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NOC)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)c2ccsc2)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)CC)cc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(C)Cc1ccccc1
Cc1cc(cc(C)c1C)-c1c(OCC[C@@H]2CCN2)c2cc(C(=O)Nc3ncccn3)c(Cl)cc2[nH]c1=O
CCCC(=O)Nc1ccc(cc1)-c1nc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1N1CCC2C=CC=CC2C1 |c:46,48|
CCCC(=O)Nc1ccc(cc1)-c1nc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN1CCCC1
CCCC(=O)Nc1ccc(cc1)-c1cn2c(n1)n(Cc1ccccc1F)cc(C(=O)OC(CC)CC)c2=O
CCCC(=O)Nc1ccc(cc1)-c1nc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)CCOC
CCCC(=O)Nc1ccc(cc1)-c1nc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)Cc1ccco1
CCOC(=O)c1cn(Cc2ccccc2F)c2nc(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
CCCC(=O)Nc1ccc(cc1)-c1nc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)CCc1ccccc1
CCCC(=O)Nc1ccc(cc1)-c1nc2n(Cc3ccccc3F)cc(C(=O)OCC)c(=O)n2c1CN(C)CCc1ccccn1
CCCC(=O)Nc1ccc(cc1)-c1nc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)CCc1ccccn1
CCCC(=O)Nc1ccc(cc1)-c1nc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)CC#N
CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)C(C)C)cc1
CCCC(=O)Nc1ccc(cc1)-c1cn2c(n1)n(Cc1ccccc1F)cc(C(=O)OCC)c2=O
CCOC(=O)c1cn(Cc2ccccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(OC)cc1
CCCC(=O)Nc1ccc(cc1)-c1nc2n(Cc3ccccc3F)cc(C(=O)OCC)c(=O)n2c1CN(C)Cc1ccccc1
CCCC(=O)Nc1ccc(cc1)-c1nc2n(Cc3ccccc3F)cc(C(=O)OC(CC)CC)c(=O)n2c1CN(C)Cc1cccnc1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(S)c3)c(=O)n2c1CN(C)CCc1ccccn1
COCCN(C)Cc1c(nc2n(Cc3ccccc3F)c(C)c(-c3ccc4OCOc4c3)c(=O)n12)-c1ccc(OC)cc1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3ccc(OC)c(OC)c3)c(=O)n2c1CN(C)CCc1ccccn1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(F)c3)c(=O)n2c1CN(C)CCc1ccccn1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(Br)c(=O)n2c1CN(C)CCc1ccccn1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3ccc4OCOc4c3)c(=O)n2c1CN(C)Cc1ccccc1
CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2nc(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(c3)C(F)(F)F)c(=O)n2c1CN(C)CCc1ccccn1
CCN(CC)CCN(C)Cc1c(nc2n(Cc3ccccc3F)c(C)c(-c3ccc4OCOc4c3)c(=O)n12)-c1ccc(OC)cc1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3ccc4OCOc4c3)c(=O)n2c1CN(C)CCc1ccccc1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)CCc1ccccn1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3ccc4OCOc4c3)c(=O)n2c1CN1CCOCC1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3ccc(OC)cc3)c(=O)n2c1CN(C)CCc1ccccn1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3ccccc3OC)c(=O)n2c1CN(C)CCc1ccccn1 |(-8.58,-6.47,;-7.81,-5.14,;-6.27,-5.13,;-5.48,-6.47,;-3.94,-6.46,;-3.19,-5.13,;-3.96,-3.79,;-5.5,-3.79,;-1.65,-5.13,;-.75,-6.38,;.72,-5.9,;2.04,-6.66,;2.04,-8.2,;.71,-8.97,;-.62,-8.17,;-1.95,-8.96,;-1.95,-10.5,;-.61,-11.27,;.72,-10.5,;2.05,-11.25,;3.37,-5.9,;4.71,-6.67,;3.37,-4.36,;4.7,-3.6,;4.7,-2.06,;6.03,-1.29,;7.38,-2.06,;7.37,-3.6,;6.03,-4.37,;6.03,-5.9,;7.36,-6.68,;2.04,-3.58,;2.04,-2.04,;.72,-4.36,;-.75,-3.88,;-1.23,-2.41,;-.19,-1.27,;1.31,-1.59,;-.67,.19,;-2.17,.51,;-2.65,1.98,;-4.15,2.29,;-4.64,3.75,;-3.61,4.9,;-2.09,4.59,;-1.63,3.12,)|
CCCCN(C)Cc1c(nc2n(Cc3ccccc3F)c(C)c(-c3ccc4OCOc4c3)c(=O)n12)-c1ccc(OC)cc1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3ccc4OCOc4c3)c(=O)n2c1CN(C)CCc1ccncc1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3ccc4OCOc4c3)c(=O)n2c1CN1CCCN(C)CC1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3cc(Cl)cc(Cl)c3)c(=O)n2c1CN(C)CCc1ccccn1
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3ccc4OCOc4c3)c(=O)n2c1CN(C)CCc1ccccc1F
COc1ccc(cc1)-c1nc2n(Cc3ccccc3F)c(C)c(-c3cc(OC)c(OC)c(OC)c3)c(=O)n2c1CN(C)CCc1ccccn1
COCc1cc(CCNC[C@@H](C)c2c([nH]c3ccc(cc23)C(C)(C)C(=O)N2CC3CCC2CC3)-c2cc(C)cc(C)c2)ccn1 |wD:10.10,TLB:24:26:30.29:32.33,(21.92,.09,;21.01,-1.17,;19.48,-1.01,;18.58,-2.26,;17.05,-2.1,;16.14,-3.34,;14.6,-3.18,;13.69,-4.44,;12.17,-4.27,;11.26,-5.52,;9.73,-5.36,;9.1,-3.95,;8.82,-6.6,;9.28,-8.07,;8.06,-8.97,;6.81,-8.07,;5.31,-8.4,;4.27,-7.26,;4.76,-5.8,;6.25,-5.48,;7.28,-6.6,;3.74,-4.65,;4.88,-3.62,;2.71,-3.5,;2.59,-5.66,;2.9,-7.16,;1.13,-5.17,;.82,-3.67,;-.7,-3.5,;-1.86,-4.54,;-1.76,-6.07,;-.62,-5.04,;-1.33,-3.64,;-1.33,-2.11,;10.79,-8.4,;11.82,-7.26,;13.32,-7.58,;14.36,-6.44,;13.8,-9.05,;12.76,-10.19,;13.22,-11.65,;11.27,-9.86,;16.77,-4.75,;18.3,-4.92,;19.21,-3.67,)|
C[C@H](CNCCc1ccnc(c1)C(O)=O)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:27:29:33.32:35.36,(11.15,-5.67,;11.63,-7.13,;13.16,-7.46,;14.18,-6.32,;15.7,-6.64,;16.74,-5.51,;18.24,-5.86,;18.68,-7.34,;20.2,-7.69,;21.24,-6.56,;20.8,-5.09,;19.29,-4.74,;21.85,-3.97,;23.36,-4.32,;21.43,-2.49,;10.58,-8.28,;10.9,-9.8,;9.59,-10.57,;8.45,-9.54,;6.92,-9.71,;6.02,-8.47,;6.63,-7.07,;8.16,-6.91,;9.07,-8.14,;5.72,-5.83,;6.96,-4.9,;4.81,-4.58,;4.48,-6.72,;4.65,-8.25,;3.08,-6.12,;3.6,-4.83,;2.33,-3.85,;.87,-4.11,;.26,-5.39,;1.75,-5.11,;1.96,-3.22,;2.66,-2.25,;12.36,-10.28,;12.68,-11.78,;14.15,-12.27,;14.46,-13.79,;15.3,-11.22,;14.98,-9.73,;16.14,-8.7,;13.51,-9.26,)|
C[C@H](CNCCc1ccncc1C)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,TLB:25:27:31.30:33.34,(10.97,2.26,;11.78,.95,;13.33,1.02,;14.06,2.37,;15.6,2.41,;16.34,3.76,;17.88,3.78,;18.67,2.46,;20.2,2.47,;20.95,3.82,;20.18,5.13,;18.64,5.11,;17.85,6.44,;11.05,-.4,;11.71,-1.8,;10.63,-2.86,;9.27,-2.15,;7.84,-2.68,;6.66,-1.68,;6.93,-.17,;8.36,.34,;9.54,-.64,;5.75,.81,;4.57,1.79,;6.73,1.99,;4.75,-.37,;5.29,-1.8,;3.26,-.12,;3.45,1.26,;1.99,1.91,;1.92,3.54,;1.47,2.44,;1.72,.55,;.36,-.08,;.64,1.3,;13.25,-1.92,;13.92,-3.29,;15.46,-3.4,;16.12,-4.82,;16.32,-2.12,;15.64,-.75,;16.53,.53,;14.11,-.64,)|
C[C@H](CNCCc1cc(C)nc(C)c1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:26:28:32.31:34.35,(9.77,-.05,;10.58,-1.37,;12.14,-1.31,;12.87,.04,;14.4,.09,;15.15,1.42,;16.69,1.46,;17.45,2.79,;18.99,2.81,;19.76,4.16,;19.76,1.49,;19.02,.14,;19.81,-1.17,;17.48,.13,;9.85,-2.75,;10.51,-4.13,;9.43,-5.19,;8.07,-4.48,;6.64,-5.01,;5.46,-4.01,;5.73,-2.52,;7.16,-1.99,;8.34,-2.97,;4.54,-1.52,;5.53,-.33,;3.36,-.54,;3.55,-2.7,;4.08,-4.13,;2.05,-2.45,;2.24,-1.07,;.78,-.4,;-.57,-1.02,;-.85,-2.41,;.51,-1.78,;.26,.11,;.71,1.21,;12.05,-4.25,;12.73,-5.62,;14.26,-5.74,;14.93,-7.15,;15.13,-4.46,;14.45,-3.08,;15.33,-1.8,;12.91,-2.97,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NC[C@H]1CC[C@@H](CC1)C(N)=O)C(C)(C)CCC2(C)C |wU:20.25,wD:17.18,(9.62,-7.31,;8.27,-6.52,;6.94,-7.29,;5.61,-6.52,;5.61,-4.98,;6.94,-4.21,;8.27,-4.98,;9.62,-4.21,;9.62,-2.67,;10.78,-1.63,;10.16,-.24,;8.62,-.4,;8.29,-1.9,;7.61,.77,;6.1,.47,;8.1,2.22,;7.09,3.38,;5.58,3.08,;4.56,4.25,;3.06,3.96,;2.57,2.49,;3.57,1.33,;5.07,1.63,;1.05,2.19,;.03,3.33,;.56,.72,;4.28,-4.21,;5.61,-3.44,;2.94,-3.44,;2.94,-4.98,;2.94,-6.52,;4.28,-7.29,;5.37,-8.38,;2.78,-7.7,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CN)c1)C(C)(C)CCC2(C)C
Cc1noc(C)c1CNCC1CCC(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 |(2.34,1.95,;3.11,3.28,;2.5,4.71,;3.65,5.72,;4.98,4.94,;6.39,5.55,;4.64,3.43,;5.65,2.28,;5.18,.82,;6.21,-.33,;7.72,-.03,;8.73,-1.19,;10.23,-.89,;10.74,.56,;12.25,.86,;13.26,-.29,;12.76,-1.75,;11.25,-2.05,;13.77,-2.92,;15.31,-2.76,;15.94,-4.15,;14.78,-5.19,;14.78,-6.73,;13.42,-7.5,;12.09,-6.73,;10.76,-7.5,;10.76,-9.04,;12.09,-9.81,;13.42,-9.04,;14.78,-9.83,;9.43,-9.81,;10.53,-10.9,;7.94,-10.22,;8.08,-9.04,;8.08,-7.5,;9.43,-6.73,;8.08,-5.96,;10.76,-5.96,;13.45,-4.42,;9.73,1.73,;8.31,1.56,)|
CCOC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 |wU:5.4,wD:8.8,(.17,.16,;.66,1.61,;-.35,2.77,;.14,4.22,;-.88,5.37,;1.66,4.53,;2.15,6,;3.66,6.29,;4.67,5.13,;6.18,5.41,;7.19,4.26,;6.7,2.82,;5.19,2.51,;7.71,1.65,;9.25,1.79,;9.87,.41,;8.71,-.64,;8.71,-2.18,;7.36,-2.95,;6.03,-2.18,;4.7,-2.95,;4.7,-4.49,;6.03,-5.26,;7.36,-4.49,;8.71,-5.27,;3.37,-5.26,;4.46,-6.35,;1.87,-5.65,;2.03,-4.49,;2.03,-2.95,;3.37,-2.18,;4.7,-1.41,;2.03,-1.41,;7.38,.13,;4.16,3.66,;2.66,3.38,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCCC(CN)C1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CN)CC1)C(C)(C)CCC2(C)C |(-.7,-11.61,;-2.04,-10.83,;-3.38,-11.6,;-4.71,-10.83,;-4.71,-9.3,;-3.38,-8.53,;-2.04,-9.3,;-.7,-8.53,;-.69,-6.99,;.45,-5.95,;-.16,-4.57,;-1.69,-4.71,;-2.02,-6.22,;-2.72,-3.55,;-4.22,-3.85,;-2.21,-2.1,;-3.23,-.94,;-4.73,-1.24,;-5.23,-2.69,;-6.75,-2.99,;-7.75,-1.83,;-9.27,-2.14,;-10.29,-1,;-7.26,-.36,;-5.75,-.08,;-6.03,-8.53,;-7.38,-7.76,;-4.7,-7.76,;-7.38,-9.3,;-7.38,-10.83,;-6.03,-11.6,;-7.53,-12.01,;-4.94,-12.68,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CNCc3cc(=O)[nH]c(=O)[nH]3)CC1)C(C)(C)CCC2(C)C |(5.32,-14.61,;3.97,-13.84,;2.66,-14.61,;1.33,-13.84,;1.33,-12.3,;2.64,-11.53,;3.97,-12.3,;5.3,-11.51,;6.65,-12.28,;6.67,-13.82,;9.33,-13.77,;9.29,-12.23,;7.96,-11.49,;10.62,-11.44,;10.6,-9.9,;11.97,-12.19,;13.28,-11.39,;14.64,-12.14,;14.65,-13.7,;15.99,-14.44,;17.32,-13.66,;18.67,-14.4,;19.98,-13.61,;21.33,-14.37,;22.66,-13.59,;23.99,-14.33,;25.32,-13.56,;26.65,-14.31,;25.3,-12.02,;23.95,-11.25,;23.92,-9.71,;22.62,-12.05,;17.3,-12.09,;15.94,-11.35,;,-11.53,;-1.35,-10.76,;1.33,-10.74,;-1.32,-12.3,;-1.32,-13.84,;,-14.61,;1.33,-15.38,;-1.35,-15.36,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCNCC1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CNC(=O)C(F)(F)F)CC1)C(C)(C)CCC2(C)C |(4.72,-8.31,;3.37,-7.54,;2.04,-8.29,;.71,-7.54,;.71,-6,;2.04,-5.23,;3.37,-6,;4.72,-5.23,;4.72,-3.69,;5.88,-2.64,;5.26,-1.26,;3.72,-1.41,;3.39,-2.92,;2.71,-.24,;1.2,-.54,;3.2,1.21,;2.19,2.37,;.68,2.07,;-.33,3.24,;-1.84,2.96,;-2.33,1.49,;-3.85,1.17,;-4.87,2.33,;-4.38,3.77,;-2.89,4.08,;-5.41,4.94,;-6.42,6.08,;-6.55,3.91,;-4.25,5.94,;-1.33,.32,;.17,.62,;-.62,-5.23,;-1.96,-4.46,;.71,-4.46,;-1.96,-6,;-1.96,-7.54,;-.62,-8.29,;.47,-9.39,;-2.12,-8.71,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NC[C@H]1CC[C@H](CNC(N)=N)CC1)C(C)(C)CCC2(C)C |wU:20.22,wD:17.18,(13.73,-14.94,;12.37,-14.16,;11.04,-14.93,;9.71,-14.16,;9.71,-12.62,;11.04,-11.85,;12.37,-12.62,;13.73,-11.85,;13.73,-10.31,;14.89,-9.27,;14.26,-7.89,;12.72,-8.03,;12.4,-9.54,;11.71,-6.87,;10.2,-7.17,;12.21,-5.42,;11.2,-4.25,;9.69,-4.56,;8.68,-3.39,;7.17,-3.67,;6.67,-5.14,;5.16,-5.46,;4.14,-4.3,;4.63,-2.85,;3.6,-1.7,;6.12,-2.54,;7.68,-6.31,;9.18,-6,;8.38,-11.85,;7.05,-11.08,;9.71,-11.08,;7.05,-12.62,;7.05,-14.16,;8.38,-14.93,;9.48,-16.01,;6.89,-15.34,)|
Cc1ccc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cc1
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NC[C@@H]1CC[C@H](CNC(N)=N)CC1)C(C)(C)CCC2(C)C |wU:20.22,17.18,(9.88,-8.62,;8.54,-7.82,;7.19,-8.59,;5.86,-7.82,;5.86,-6.28,;7.19,-5.51,;8.54,-6.28,;9.88,-5.51,;9.89,-3.97,;11.04,-2.94,;10.41,-1.55,;8.89,-1.7,;8.56,-3.2,;7.87,-.54,;6.35,-.84,;8.36,.91,;7.36,2.07,;5.84,1.77,;4.84,2.94,;3.31,2.65,;2.83,1.18,;1.31,.88,;.29,2.02,;.78,3.49,;-.25,4.64,;2.29,3.8,;3.83,.02,;5.34,.32,;4.53,-5.51,;3.2,-4.74,;5.88,-4.74,;3.2,-6.28,;3.2,-7.82,;4.53,-8.59,;5.63,-9.69,;3.04,-9.01,)|
CN(C)Cc1ccc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cc1
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1ccc(CN)cc1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCCC(CNC(=O)C(F)(F)F)C1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCN(CC1)C(=O)OC(C)(C)C)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCCCC1)C(C)(C)CCC2(C)C
COC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 |wU:4.3,wD:7.7,(3.41,-.35,;4.92,-.05,;5.93,-1.2,;5.44,-2.66,;7.44,-.89,;7.95,.58,;9.45,.86,;10.46,-.29,;11.96,,;12.98,-1.17,;12.48,-2.61,;10.98,-2.91,;13.5,-3.78,;15.03,-3.62,;15.65,-5.01,;14.5,-6.04,;14.5,-7.58,;13.15,-8.35,;11.82,-7.58,;10.49,-8.35,;10.49,-9.89,;11.82,-10.66,;13.15,-9.89,;14.5,-10.67,;9.16,-10.66,;10.25,-11.75,;7.67,-11.07,;7.82,-9.89,;7.82,-8.35,;9.16,-7.58,;10.5,-6.81,;7.82,-6.81,;13.18,-5.27,;9.96,-1.75,;8.44,-2.05,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1ccccc1)C(C)(C)CCC2(C)C
Cc1cnc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cn1
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CC1)C#N)C(C)(C)CCC2(C)C |(17.2,-15.94,;15.87,-15.15,;14.52,-15.92,;13.19,-15.15,;13.19,-13.61,;14.52,-12.84,;15.87,-13.61,;17.2,-12.84,;17.23,-11.3,;18.37,-10.25,;17.74,-8.87,;16.22,-9.01,;15.9,-10.53,;15.2,-7.85,;13.68,-8.15,;15.69,-6.4,;14.68,-5.25,;13.17,-5.54,;12.16,-4.37,;10.65,-4.67,;10.16,-6.14,;11.16,-7.29,;12.68,-7,;8.64,-6.45,;7.12,-6.75,;11.86,-12.84,;10.53,-12.07,;13.21,-12.07,;10.53,-13.61,;10.53,-15.15,;11.86,-15.92,;12.96,-17.01,;10.37,-16.32,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCN(CC1)C(N)=N)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NC[C@H]1CC[C@@H](CC1)C(O)=O)C(C)(C)CCC2(C)C |wU:20.25,wD:17.18,(8.87,-7.01,;7.54,-6.23,;6.19,-7,;4.86,-6.23,;4.86,-4.69,;6.19,-3.92,;7.54,-4.69,;8.87,-3.92,;8.89,-2.38,;10.04,-1.34,;9.41,.05,;7.89,-.1,;7.56,-1.61,;6.87,1.07,;5.35,.76,;7.36,2.51,;6.35,3.68,;4.84,3.38,;3.83,4.54,;2.32,4.26,;1.83,2.79,;2.83,1.63,;4.32,1.93,;.31,2.47,;-.18,1.02,;-.72,3.63,;3.53,-3.92,;4.88,-3.15,;2.2,-3.15,;2.2,-4.69,;2.2,-6.23,;3.53,-7,;4.63,-8.08,;2.04,-7.4,)|
CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(c(CN(C)Cc3ccco3)n2c1=O)-c1cccc(OC)c1
CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1cccc(OC)c1
CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(c(CN(C)Cc3ccccc3)n2c1=O)-c1cccc(OC)c1
CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OCC(C)C)cc1
CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(c(CN(C)Cc3ccco3)n2c1=O)-c1ccc(OCC(C)C)cc1
CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(OCC(C)C)cc1
Cc1cnc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)nc1NCC1CCCO1
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3nccc(NC[C@H]4CCCO4)n3)c1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CNc3ncccn3)CC1)C(C)(C)CCC2(C)C |(-1.64,-16.7,;-3,-15.99,;-4.37,-16.7,;-5.73,-15.99,;-5.73,-14.55,;-4.37,-13.84,;-3,-14.54,;-1.65,-13.82,;-.28,-14.53,;-.28,-15.97,;2.44,-15.99,;2.44,-14.54,;1.08,-13.82,;3.81,-13.82,;3.81,-12.38,;5.17,-14.55,;6.66,-13.66,;8.16,-14.5,;9.65,-13.61,;11.17,-14.45,;11.2,-16.18,;12.71,-17.02,;14.19,-16.13,;15.6,-17.12,;15.46,-18.85,;16.88,-19.84,;18.43,-19.1,;18.58,-17.37,;17.17,-16.39,;9.71,-17.04,;8.2,-16.23,;-7.08,-13.82,;-8.46,-13.11,;-5.73,-13.1,;-8.43,-14.55,;-8.43,-15.99,;-7.08,-16.7,;-5.73,-17.41,;-8.46,-17.41,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3nccc(NCC4CCCO4)n3)c1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3cc(Cl)nc(N)n3)c1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NC[C@H]1CC[C@H](CNc3ccnc(NC[C@@H]4CCCO4)n3)CC1)C(C)(C)CCC2(C)C |wU:20.22,30.31,wD:17.18,(1.39,3.28,;.04,4,;-1.33,3.28,;-2.7,4,;-2.7,5.43,;-1.34,6.15,;.03,5.44,;1.38,6.17,;2.77,5.46,;2.76,4.01,;5.48,4,;5.48,5.44,;4.13,6.17,;6.86,6.17,;6.87,7.61,;8.23,5.43,;9.59,6.14,;10.96,5.43,;10.94,3.99,;12.31,3.26,;13.68,3.99,;15.17,3.09,;16.69,3.92,;18.17,3.02,;18.17,1.58,;19.54,.86,;20.9,1.59,;20.9,3.02,;22.38,3.92,;23.92,3.09,;25.4,3.99,;26.63,2.78,;28.74,4.91,;27.49,6.12,;25.82,5.67,;19.54,3.75,;13.68,5.43,;12.31,6.14,;-4.07,6.17,;-5.43,6.88,;-2.7,6.89,;-5.41,5.43,;-5.41,3.99,;-4.07,3.28,;-2.7,2.57,;-5.43,2.57,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3nccc(n3)N3CCOCC3)c1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCCC(CNc3ncccn3)C1)C(C)(C)CCC2(C)C
Cc1cc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)nc(N)n1
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCCC(C1)Nc1nccc(NCC3CCCO3)n1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CNc3ncc(C#N)c(N)n3)CC1)C(C)(C)CCC2(C)C |(-1.59,-12.61,;-2.93,-11.9,;-4.29,-12.61,;-5.65,-11.9,;-5.65,-10.47,;-4.31,-9.75,;-2.95,-10.46,;-1.59,-9.74,;-.21,-10.44,;-.23,-11.88,;2.49,-11.9,;2.49,-10.46,;1.13,-9.74,;3.85,-9.74,;3.87,-8.3,;5.21,-10.47,;6.7,-9.58,;8.21,-10.42,;9.7,-9.53,;11.2,-10.36,;11.23,-12.09,;12.74,-12.93,;14.22,-12.04,;15.64,-13.03,;17.19,-12.3,;18.6,-13.28,;18.46,-15.01,;19.88,-15.99,;21.29,-16.98,;16.9,-15.74,;16.74,-17.45,;15.49,-14.76,;9.75,-12.95,;8.25,-12.14,;-7,-9.74,;-8.37,-9.03,;-5.65,-9.02,;-8.36,-10.47,;-8.36,-11.91,;-7,-12.61,;-8.37,-13.32,;-5.65,-13.32,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3nccc(NC[C@@H]4CCCO4)n3)c1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1ccc(CNc3ncccn3)cc1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3nccc(n3)C(F)(F)F)c1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3ccnc(NC[C@@H]4CCCO4)n3)c1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NC[C@H]1CC[C@H](CNc3ccnc(NC[C@H]4CCCO4)n3)CC1)C(C)(C)CCC2(C)C |wU:20.22,wD:30.31,17.18,(.22,-7.48,;-1.11,-6.77,;-2.46,-7.48,;-3.82,-6.77,;-3.82,-5.34,;-2.48,-4.64,;-1.13,-5.34,;.22,-4.63,;1.58,-5.34,;1.56,-6.77,;4.25,-6.77,;4.25,-5.34,;2.91,-4.62,;5.6,-4.64,;5.62,-3.22,;6.95,-5.36,;8.42,-4.48,;9.92,-5.31,;9.92,-7.02,;11.42,-7.84,;12.89,-6.97,;14.38,-7.8,;15.85,-6.94,;17.33,-6.07,;17.3,-4.38,;18.78,-3.5,;20.27,-4.35,;20.28,-6.06,;21.76,-6.9,;23.23,-6.04,;24.73,-6.89,;24.73,-8.6,;27.69,-8.58,;27.68,-6.87,;26.18,-6.02,;18.81,-6.92,;12.87,-5.26,;11.37,-4.41,;-5.14,-4.64,;-6.52,-3.92,;-3.82,-3.92,;-6.49,-5.34,;-6.49,-6.77,;-5.14,-7.47,;-6.52,-8.16,;-3.82,-8.19,)|
COC(=O)c1cc(C)nc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1
COCCNc1nccc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CNc3nccc(Cl)n3)CC1)C(C)(C)CCC2(C)C |(-1.64,-16.7,;-3,-15.99,;-4.37,-16.7,;-5.73,-15.99,;-5.73,-14.55,;-4.37,-13.84,;-3,-14.54,;-1.65,-13.82,;-.28,-14.53,;-.28,-15.97,;2.44,-15.99,;2.44,-14.54,;1.08,-13.82,;3.81,-13.82,;3.81,-12.38,;5.17,-14.55,;6.66,-13.66,;8.16,-14.5,;8.2,-16.23,;9.71,-17.04,;11.2,-16.18,;12.71,-17.02,;14.19,-16.13,;15.6,-17.12,;17.17,-16.39,;18.58,-17.37,;18.43,-19.1,;16.88,-19.84,;16.73,-21.55,;15.46,-18.85,;11.17,-14.45,;9.65,-13.61,;-7.08,-13.82,;-8.46,-13.11,;-5.73,-13.1,;-8.43,-14.55,;-8.43,-15.99,;-7.08,-16.7,;-8.46,-17.41,;-5.73,-17.41,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CNc3nccc(NCC4CCCO4)n3)CC1)C(C)(C)CCC2(C)C |(-3.76,-4.21,;-5.12,-3.49,;-6.47,-4.21,;-7.83,-3.49,;-7.83,-2.07,;-6.47,-1.34,;-5.12,-2.05,;-3.76,-1.33,;-2.4,-2.05,;-2.4,-3.49,;.31,-3.49,;.31,-2.05,;-1.04,-1.33,;1.68,-1.34,;1.68,.1,;3.04,-2.07,;4.52,-1.18,;6.02,-2.01,;6.47,-3.67,;8.11,-4.11,;9.34,-2.9,;11.02,-3.36,;12.51,-2.48,;13.86,-1.76,;13.86,-.32,;15.22,.38,;16.58,-.32,;16.58,-1.76,;18.05,-2.65,;19.56,-1.83,;21.05,-2.72,;21.05,-4.43,;22.54,-5.29,;24.03,-2.72,;22.54,-1.86,;15.22,-2.48,;8.9,-1.24,;7.22,-.79,;-9.19,-1.34,;-10.55,-.63,;-7.83,-.61,;-10.53,-2.07,;-10.53,-3.5,;-9.19,-4.21,;-7.83,-4.92,;-10.55,-4.91,)|
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1ccc(CNc3nccc(NCC4CCCO4)n3)cc1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3ncc(F)c(N)n3)c1)C(C)(C)CCC2(C)C
COCCCNc1ccnc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3ncccn3)c1)C(C)(C)CCC2(C)C
Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CNc3ccnc(Cl)n3)CC1)C(C)(C)CCC2(C)C |(-2.48,-15.18,;-3.84,-14.47,;-5.21,-15.18,;-6.57,-14.47,;-6.57,-13.03,;-5.21,-12.32,;-3.84,-13.03,;-2.49,-12.3,;-1.12,-13.02,;-1.12,-14.46,;1.6,-14.47,;1.6,-13.03,;.24,-12.3,;2.97,-12.32,;2.97,-10.87,;4.33,-13.03,;5.82,-12.14,;7.32,-12.98,;7.35,-14.71,;8.84,-15.55,;10.33,-14.67,;11.84,-15.52,;13.34,-14.63,;14.84,-15.47,;16.33,-14.58,;17.83,-15.42,;17.85,-17.16,;16.36,-18.06,;16.39,-19.78,;14.86,-17.2,;10.31,-12.95,;8.8,-12.09,;-7.91,-12.32,;-6.57,-11.59,;-9.29,-11.59,;-9.27,-13.03,;-9.27,-14.47,;-7.91,-15.18,;-9.29,-15.89,;-6.57,-15.91,)|
COc1cc(OC)nc(NCC2CCC(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)CC2)n1 |(19.23,-16.95,;19.26,-18.68,;17.79,-19.57,;17.82,-21.3,;16.33,-22.18,;16.35,-23.9,;17.87,-24.75,;14.83,-21.35,;14.81,-19.62,;13.31,-18.78,;11.83,-19.65,;10.31,-18.81,;8.84,-19.69,;7.33,-18.86,;7.3,-17.14,;5.79,-16.3,;4.3,-17.19,;2.94,-16.47,;2.95,-15.04,;1.58,-17.19,;1.58,-18.63,;-1.14,-18.62,;-1.12,-17.18,;-2.5,-16.46,;-3.86,-17.19,;-5.22,-16.48,;-6.56,-17.19,;-6.56,-18.63,;-5.2,-19.33,;-3.86,-18.63,;-2.5,-19.33,;-7.91,-19.33,;-9.28,-20.04,;-6.56,-20.06,;-9.27,-18.63,;-9.27,-17.19,;-7.91,-16.47,;-9.28,-15.75,;-6.56,-15.75,;.22,-16.46,;8.79,-16.25,;10.29,-17.09,;16.27,-18.73,)|
COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN1CCC(CC1)c1ccccc1
COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1ccccn1
COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN1CCN(C)CC1
COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)CCc1ccccc1
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CNCc3ccccc3)n2c1=O)C(C)(C)C
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)C(C)(C)C
COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN1CCc2ccccc2C1
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc3c(CN(CCc4ccccn4)CC3(C)C)n2c1=O
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CNCc3ccccn3)n2c1=O)C(C)(C)C
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CN(C)C)n2c1=O)C(C)(C)C
CCN(CC)CCN(C)Cc1c(nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12)C(C)(C)C
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CN(C)Cc3ccccn3)n2c1=O)C(C)(C)C
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CNCCc3ccccn3)n2c1=O)C(C)(C)C
COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1ccccc1
COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)CCc1ccccn1
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CN(C)CCc3ccccc3)n2c1=O)C(C)(C)C
CCCCN(C)Cc1c(nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12)C(C)(C)C(=O)OC
COCCN(C)Cc1c(nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12)C(C)(C)C
CCN(CCc1ccccn1)Cc1c(nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12)C(C)(C)C
COCCN(C)Cc1c(nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12)C(C)(C)C(=O)OC
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CNCC3CCCCC3)n2c1=O)C(C)(C)C
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CN(C)Cc3ccccn3)n2c1=O)C(C)(C)CO
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(cn2c1=O)C(C)(C)CNCCc1ccccn1
COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1ccccc1O
COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1cccnc1
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CN(C)CCc3ccccn3)n2c1=O)C(C)(C)C
COc1cccc(c1)-c1c(C)n(Cc2ccccc2F)c2nc(c(CNCC3CCCC3)n2c1=O)C(C)(C)C
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCNCc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCNCCc2ccccc2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1cccc(OC(F)(F)F)c1
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1ccc2OCCOc2c1
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1cccc(O)c1
COc1ccc(cc1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN2CCC[C@@H]2Cc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCNCCc2ccccn2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1ccccc1
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1ccc2OCOc2c1
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN2CCC[C@H]2Cc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCNCCc2cnc[nH]2)c1=O
CCc1c(-c2cccc(OC)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN2CCCC2c2ccccn2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1ccc(Oc2ccccc2)cc1
COc1cccc(c1)-c1cn(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
CCc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)NCc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H]2CCCN2Cc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)N(C)Cc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(C)N(C)CCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)NCc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)N(C)CCc2ccccn2)c1=O |r|
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(C)NCCCOCC(C)C)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)NCc2ccccn2)c1=O |r|
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)N(C)Cc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)Cc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H]2CCCN2Cc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)NCCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(C)NCCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)N(C)CCc2ccccn2)c1=O |r|
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)N(C)Cc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(C)N(C)Cc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)N)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(C)N(C)CCCOCC(C)C)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(C)N(C)Cc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)NCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCNCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(C)NCc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)N)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(C)NCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)NCCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNCc2ccccc2C)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@@H](C)CNCc2ccccc2OC)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@@H](C)CNCC(C)C)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNCc2cccc(F)c2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@@H](C)CNC2CCCC2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNCc2ccc(F)cc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CN(C)Cc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CN(C)CC2CC2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNCC2CC2)c1=O
COc1ccc(CNC[C@@H](C)n2c(=O)c(c(C)n(Cc3c(F)cccc3F)c2=O)-c2cccc(OC)c2)cc1
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@@H](C)CN(C)CC2CC2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@@H](C)CNCC2CC2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNC2CCCC2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNCc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C2CCN(Cc3ccccc3)C2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNCC(C)C)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@@H](C)CNCc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@@H](C)CNCc2ccccc2F)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNCc2ccccc2F)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@@H](C)CN(C)Cc2ccccc2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C2CCNC2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@@H](C)CNCc2ccccc2C)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CN(C)CCc2ccccn2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C2CCN(CCc3ccccn3)C2)c1=O
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@@H](C)CN(C)CCc2ccccn2)c1=O
COc1cccc(CNC[C@@H](C)n2c(=O)c(c(C)n(Cc3c(F)cccc3F)c2=O)-c2cccc(OC)c2)c1
CC(C)C[C@H](NC(=O)[C@H](CCCCNC(=O)CCCc1c(C)c2cc3[nH]c(cc4cc(cc5nc(cc1[nH]2)c(CCC(O)=O)c5C)c(C=C)c4C)c(C=C)c3C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)C1CC[C@H](N1)C(=O)NCC(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCNC(=O)CCCc1c(C)c2cc3[nH]c(cc4cc(cc5nc(cc1[nH]2)c(CCC(O)=O)c5C)c(C=C)c4C)c(C=C)c3C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccccc1)NC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)C1CC[C@H](N1)C(=O)NCC(N)=O
CCNC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)[N+]([O-])=O)Cc1ccccn1
CC(C)C(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(N)cc1)Cc1ccccc1
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)[N+]([O-])=O)Cc1ccccc1
CC(C)C[C@H](N)C(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CCNc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)N(C)C)Cc1ccccc1
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(NC(=O)C(F)(F)F)cc1)Cc1ccccc1
CN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)[N+]([O-])=O
CC(C)CNc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CCC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(NC(C)=O)cc1)Cc1ccccc1
CN(CCc1ccccc1)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)[N+]([O-])=O
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(NC(=O)CCCN)cc1)Cc1ccccc1
[O-][N+](=O)c1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN1CCNCC1
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)[N+]([O-])=O
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(NC(=O)CCN)cc1)Cc1ccccc1
CN(CCc1ccccn1)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)[N+]([O-])=O
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CC(C)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
C[C@H](N)C(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CCCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)[N+]([O-])=O
CCN(CC)CCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)[N+]([O-])=O
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(NC(=O)CN)cc1)Cc1ccccc1
Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(Cl)cc1C(F)(F)F
Fc1cc(cnc1CNC(=O)c1ccc2N(C(C3CC3)C3(CCS(=O)(=O)CC3)c2c1)S(=O)(=O)c1cccc(c1)C#N)C(F)(F)F
FC(F)(F)Oc1cccc(c1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(cc1Cl)C(F)(F)F
FC(F)(F)c1cnc(CNC(=O)c2ccc3N(C(C4CC4)C4(CCS(=O)(=O)CC4)c3c2)S(=O)(=O)c2ccc(Cl)cc2)c(Cl)c1
Cc1cc(cc(C)c1C)-c1c(OCC[C@@H]2CCCC(N2)C(F)(F)F)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
Cc1cc(C)cc(c1)-c1c(OCCC2NCCc3ccccc23)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
CCC1CCC[C@@H](CCOc2c(-c3cc(C)cc(C)c3)c(=O)[nH]c3cc(Cl)c(cc23)C(=O)Nc2ccncn2)N1
C[C@H]1CCC[C@@H](CCOc2c(-c3cc(C)cc(C)c3)c(=O)[nH]c3cc(Cl)c(cc23)C(=O)Nc2ccncn2)N1
CC1CCC(CCOc2c(-c3cc(C)cc(C)c3)c(=[OH+])[n-]c3cc(Cl)c(cc23)[N+]([O-])=O)NC1
C[C@@H]1CCC[C@@H](CCOc2c(-c3cc(C)cc(C)c3)c(=O)[nH]c3cc(Cl)c(cc23)C(=O)Nc2ccncn2)N1
CC1CCCNC1CCOc1c(-c2cc(C)cc(C)c2)c(=[OH+])[n-]c2cc(Cl)c(cc12)[N+]([O-])=O
Cc1cc(C)cc(c1)-c1c(OCCC2Cc3ccccc3CN2)c2cc(c(Cl)cc2[n-]c1=[OH+])[N+]([O-])=O
C[C@H]1CCC[C@@H](CCOc2c(-c3cc(C)c(C)c(C)c3)c(=O)[nH]c3cc(Cl)c(cc23)C(=O)Nc2ccncn2)N1
Cc1cc(C)cc(c1)-c1c(OCC[C@@H]2CCCCN2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccc(F)c1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.81,-7.48,;3.8,-4.81,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CCCCC1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.48,;1.49,-3.48,;.72,-4.79,;1.49,-6.14,;3.03,-6.14,;3.81,-4.81,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1C(F)(F)F |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.48,;1.49,-3.48,;.72,-4.81,;1.49,-6.14,;3.04,-6.14,;3.8,-4.81,;5.35,-4.79,;6.75,-4.79,;6.38,-6.03,;6.37,-3.53,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;1.89,-1.99,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,;5.34,-4.79,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1Cl |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;3.8,-4.81,;3.04,-6.15,;1.49,-6.15,;.73,-7.48,;.72,-4.82,;1.49,-3.49,;1.89,-1.99,)|
CC(C)Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:19.20,(1.49,-3.48,;3.03,-3.48,;3.8,-4.81,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,)|
Cc1ccc(Cn2c(C)c(-c3ccccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)o1 |wD:21.22,(2.68,-7.44,;2.52,-5.91,;1.19,-5.14,;1.5,-3.64,;3.03,-3.48,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.67,-4.88,)|
CCCCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:20.21,(3.81,-7.48,;3.03,-6.15,;3.8,-4.82,;3.03,-3.49,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,)|
CN(C)CCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:20.21,(5.35,-4.81,;3.8,-4.81,;3.04,-6.14,;3.03,-3.48,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,)|
Cc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:23.25,(5.34,-4.79,;3.8,-4.81,;3.04,-6.15,;1.49,-6.15,;.72,-4.82,;1.49,-3.49,;3.03,-3.49,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCO |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.48,;3.8,-4.81,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccc1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;3.8,-4.82,;3.03,-6.15,;3.8,-7.48,;5.34,-7.48,;6.11,-6.14,;5.34,-4.81,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1C1CCCCC1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.02,-3.49,;3.79,-4.82,;5.33,-4.82,;6.1,-3.49,;5.33,-2.15,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CC1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.71,-4.26,;3.04,-5.03,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccnc1 |wD:14.15,(5.35,.51,;3.81,.51,;3.04,1.85,;3.81,3.18,;5.35,3.18,;6.12,4.51,;5.35,5.86,;3.79,5.84,;3.04,4.51,;1.5,4.5,;1.5,1.85,;.71,3.18,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.81,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.16,;3.04,-.82,;3.81,-2.15,;3.04,-3.49,;1.5,-3.49,;.72,-4.82,;1.5,-6.15,;3.04,-6.15,;3.81,-4.81,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccn1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;3.8,-4.82,;3.03,-6.15,;3.8,-7.48,;5.34,-7.48,;6.11,-6.14,;5.34,-4.81,)|
CC(c1ccccc1)n1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:23.25,(5.34,-2.15,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,;5.34,-4.81,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccn1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.48,;1.49,-3.48,;.72,-4.81,;1.49,-6.14,;3.04,-6.14,;3.8,-4.81,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;3.8,-4.81,;3.04,-6.15,;1.49,-6.15,;.73,-7.48,;.72,-4.82,;1.49,-3.49,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;1.89,-1.99,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,;5.34,-4.79,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCN1CCNCC1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.48,;3.8,-4.81,;3.03,-6.14,;3.79,-7.47,;5.33,-7.47,;6.1,-6.14,;5.34,-4.79,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Cl |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,;5.35,-4.82,)|
COc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:24.26,(6.1,-3.46,;5.33,-4.81,;3.8,-4.81,;3.04,-6.15,;1.49,-6.15,;.72,-4.82,;1.49,-3.49,;3.03,-3.49,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,)|
COCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:19.20,(3.03,-6.14,;3.8,-4.81,;3.03,-3.48,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)CC(C)(C)C)c1=O |wU:26.28,(15.11,4.27,;13.77,3.5,;13.77,1.96,;15.11,1.19,;15.11,-.36,;13.77,-1.12,;12.44,-.33,;12.44,1.19,;11.11,1.98,;11.09,-1.1,;11.09,-2.64,;12.42,-3.41,;9.76,-3.41,;9.76,-4.96,;11.09,-5.73,;11.09,-7.27,;9.75,-8.04,;12.42,-8.04,;13.75,-7.27,;13.75,-5.73,;12.42,-4.96,;13.51,-3.86,;8.43,-2.64,;7.09,-3.41,;8.43,-1.1,;7.1,-.33,;5.76,-1.08,;4.43,-.31,;5.76,-2.62,;4.42,-3.39,;3.09,-2.62,;3.08,-4.16,;4.42,-4.93,;9.76,-.33,;9.78,1.21,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)NCc2ccccc2)c1=O |wU:26.28,(4.84,1.97,;3.5,1.18,;3.51,-.38,;4.84,-1.13,;4.87,-2.67,;3.55,-3.44,;2.23,-2.67,;2.2,-1.16,;1.09,-.05,;.9,-3.45,;.9,-5,;2.24,-5.76,;-.42,-5.76,;-.42,-7.3,;-1.74,-8.07,;-3.07,-7.3,;-4.17,-6.2,;-4.4,-8.07,;-4.39,-9.61,;-3.04,-10.36,;-1.74,-9.6,;-.65,-10.67,;-1.76,-5.01,;-3.08,-5.76,;-1.76,-3.48,;-3.08,-2.71,;-3.08,-1.16,;-1.74,-.36,;-4.43,-.38,;-4.43,1.18,;-5.9,1.69,;-6.2,3.22,;-7.67,3.73,;-8.84,2.7,;-8.55,1.17,;-7.07,.68,;-.44,-2.7,;-.44,-1.16,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](NC(C)C)C2CCCCC2)c1=O |wU:26.28,(6.63,1.74,;5.3,.97,;5.3,-.57,;6.65,-1.34,;6.63,-2.89,;5.3,-3.65,;3.97,-2.88,;3.97,-1.34,;2.64,-.57,;2.64,-3.64,;2.64,-5.16,;3.97,-5.93,;1.29,-5.96,;1.29,-7.5,;2.62,-8.26,;2.62,-9.81,;1.29,-10.58,;3.95,-10.58,;5.3,-9.81,;5.3,-8.26,;3.95,-7.47,;5.05,-6.39,;-.04,-5.18,;-.05,-6.68,;-.04,-3.62,;-1.37,-2.85,;-2.7,-3.62,;-4.03,-2.85,;-5.36,-3.62,;-6.7,-2.83,;-5.37,-5.16,;-2.7,-5.16,;-1.37,-5.93,;-1.38,-7.47,;-2.72,-8.24,;-4.05,-7.47,;-4.03,-5.93,;1.31,-2.85,;1.31,-1.31,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](NC(C)C)C2CCCC2)c1=O |wU:26.28,(6.63,1.74,;5.3,.97,;5.3,-.57,;6.65,-1.34,;6.63,-2.89,;5.3,-3.65,;3.97,-2.88,;3.97,-1.34,;2.64,-.57,;2.64,-3.64,;2.64,-5.16,;3.97,-5.93,;1.29,-5.96,;1.29,-7.5,;2.62,-8.26,;2.62,-9.81,;1.29,-10.58,;3.95,-10.58,;5.3,-9.81,;5.3,-8.26,;3.95,-7.47,;5.05,-6.39,;-.04,-5.18,;-.05,-6.68,;-.04,-3.62,;-1.37,-2.85,;-2.7,-3.62,;-4.03,-2.85,;-5.36,-3.62,;-6.7,-2.83,;-5.37,-5.16,;-2.7,-5.16,;-1.46,-6.07,;-1.94,-7.54,;-3.48,-7.54,;-3.96,-6.07,;1.31,-2.85,;1.31,-1.31,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)C2CCCCC2)c1=O |wU:26.28,(3.3,5.29,;1.97,4.52,;1.97,2.98,;3.31,2.21,;3.3,.65,;1.97,-.1,;.64,.67,;.64,2.21,;-.69,2.98,;-.7,-.09,;-.7,-1.62,;.63,-2.39,;-2.05,-2.41,;-2.05,-3.95,;-.72,-4.71,;-.72,-6.26,;-2.05,-7.03,;.61,-7.03,;1.96,-6.26,;1.96,-4.71,;.61,-3.94,;1.71,-2.85,;-3.38,-1.63,;-3.38,-3.13,;-3.38,-.08,;-4.71,.69,;-6.04,-.08,;-7.37,.69,;-6.04,-1.62,;-4.71,-2.39,;-4.73,-3.94,;-6.06,-4.7,;-7.39,-3.92,;-7.39,-2.39,;-2.03,.69,;-2.02,2.23,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)N)c1=O |wU:26.29,(5.29,-3.86,;3.95,-4.63,;3.95,-6.17,;5.29,-6.94,;5.29,-8.5,;3.95,-9.26,;2.62,-8.49,;2.62,-6.94,;1.28,-6.17,;1.27,-9.25,;1.27,-10.78,;2.6,-11.55,;-.06,-11.57,;-.06,-13.11,;1.27,-13.87,;1.27,-15.42,;-.07,-16.19,;2.6,-16.19,;3.93,-15.42,;3.93,-13.87,;2.6,-13.1,;3.69,-12.01,;-1.39,-10.79,;-2.73,-11.55,;-1.39,-9.23,;-2.72,-8.46,;-4.06,-9.23,;-4.06,-10.78,;-5.4,-8.46,;-.06,-8.46,;-.05,-6.92,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C2CCCC2)N(C)C)c1=O |wU:26.34,(6.63,1.74,;5.3,.97,;5.3,-.57,;6.65,-1.34,;6.63,-2.89,;5.3,-3.65,;3.97,-2.88,;3.97,-1.34,;2.64,-.57,;2.64,-3.64,;2.64,-5.16,;3.97,-5.93,;1.29,-5.96,;1.29,-7.5,;2.62,-8.26,;2.62,-9.81,;1.29,-10.58,;3.95,-10.58,;5.3,-9.81,;5.3,-8.26,;3.95,-7.47,;5.05,-6.39,;-.04,-5.18,;-.05,-6.68,;-.04,-3.62,;-1.37,-2.85,;-2.7,-3.62,;-2.7,-5.16,;-3.96,-6.07,;-3.48,-7.54,;-1.94,-7.54,;-1.46,-6.07,;-4.03,-2.85,;-5.36,-3.62,;-4.03,-1.31,;1.31,-2.85,;1.31,-1.31,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](Cc2ccccc2)N(C)C)c1=O |wD:26.36,(12.82,6.04,;11.49,5.27,;11.49,3.73,;12.83,2.96,;12.82,1.42,;11.49,.65,;10.16,1.42,;10.16,2.96,;8.83,3.73,;8.82,.67,;8.82,-.87,;10.15,-1.64,;7.47,-1.66,;7.47,-3.2,;8.8,-3.95,;10.13,-3.18,;11.23,-2.08,;11.48,-3.95,;11.48,-5.51,;10.13,-6.28,;8.8,-5.51,;7.47,-6.28,;6.14,-.87,;4.81,-1.64,;6.14,.67,;4.81,1.44,;3.48,.68,;3.48,-.86,;2.15,-1.63,;.82,-.85,;-.51,-1.61,;-.53,-3.15,;.82,-3.93,;2.15,-3.16,;2.15,1.45,;.82,.69,;2.15,2.99,;7.49,1.44,;7.5,2.98,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](N)CCc2ccccc2)c1=O |wD:26.28,(13.94,6.45,;12.6,5.67,;12.6,4.13,;13.94,3.36,;13.94,1.82,;12.6,1.04,;11.27,1.82,;11.27,3.36,;9.94,4.14,;9.92,1.07,;9.92,-.48,;11.25,-1.25,;8.59,-1.26,;8.59,-2.81,;9.92,-3.58,;11.25,-2.79,;12.35,-1.69,;12.59,-3.56,;12.59,-5.12,;11.25,-5.89,;9.92,-5.12,;8.58,-5.89,;7.26,-.48,;5.92,-1.25,;7.26,1.07,;5.92,1.84,;4.57,1.08,;3.25,1.85,;4.57,-.47,;3.23,-1.24,;3.23,-2.77,;1.92,-3.53,;1.92,-5.06,;3.25,-5.82,;4.57,-5.05,;4.57,-3.52,;8.59,1.84,;8.6,3.38,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)C2CCCC2)c1=O |wU:26.28,(3.3,5.29,;1.97,4.52,;1.97,2.98,;3.31,2.21,;3.3,.65,;1.97,-.1,;.64,.67,;.64,2.21,;-.69,2.98,;-.7,-.09,;-.7,-1.62,;.63,-2.39,;-2.05,-2.41,;-2.05,-3.95,;-.72,-4.71,;-.72,-6.26,;-2.05,-7.03,;.61,-7.03,;1.96,-6.26,;1.96,-4.71,;.61,-3.94,;1.71,-2.85,;-3.38,-1.63,;-3.38,-3.13,;-3.38,-.08,;-4.71,.69,;-6.04,-.08,;-7.37,.69,;-6.04,-1.62,;-4.8,-2.53,;-5.29,-3.99,;-6.83,-3.97,;-7.3,-2.52,;-2.03,.69,;-2.02,2.23,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C2CCCC2)N(C)C)c1=O |wD:26.34,(26.87,2.44,;25.54,1.67,;25.54,.13,;26.88,-.64,;26.87,-2.19,;25.54,-2.95,;24.21,-2.18,;24.21,-.64,;22.88,.13,;22.87,-2.94,;22.87,-4.47,;24.2,-5.24,;21.52,-5.26,;21.52,-6.8,;22.85,-7.56,;22.85,-9.11,;21.52,-9.88,;24.18,-9.88,;25.53,-9.11,;25.53,-7.56,;24.18,-6.79,;25.28,-5.69,;20.19,-4.48,;20.17,-5.94,;20.19,-2.92,;18.86,-2.15,;17.53,-2.92,;17.53,-4.47,;16.29,-5.37,;16.76,-6.84,;18.3,-6.84,;18.77,-5.38,;16.2,-2.15,;14.87,-2.92,;16.2,-.61,;21.54,-2.15,;21.55,-.61,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](CC(C)C)NC(C)C)c1=O |wU:26.32,(9.92,5.69,;8.59,4.94,;8.59,3.38,;9.94,2.61,;9.92,1.07,;8.59,.3,;7.26,1.09,;7.26,2.61,;5.93,3.4,;5.93,.32,;5.93,-1.21,;7.26,-1.98,;4.58,-1.99,;4.58,-3.53,;5.91,-4.3,;7.24,-3.53,;8.34,-2.43,;8.59,-4.3,;8.59,-5.84,;7.24,-6.61,;5.91,-5.84,;4.58,-6.61,;3.25,-1.22,;1.92,-1.98,;3.25,.33,;1.92,1.1,;.59,.34,;.59,-1.2,;-.75,-1.97,;-2.08,-1.2,;-.76,-3.51,;-.74,1.11,;-2.07,.34,;-3.56,.76,;-2.85,-.99,;4.6,1.1,;4.6,2.64,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C2CCCCC2)N(C)C)c1=O |wU:26.35,(6.63,1.74,;5.3,.97,;5.3,-.57,;6.65,-1.34,;6.63,-2.89,;5.3,-3.65,;3.97,-2.88,;3.97,-1.34,;2.64,-.57,;2.64,-3.64,;2.64,-5.16,;3.97,-5.93,;1.29,-5.96,;1.29,-7.5,;2.62,-8.26,;2.62,-9.81,;1.29,-10.58,;3.95,-10.58,;5.3,-9.81,;5.3,-8.26,;3.95,-7.47,;5.05,-6.39,;-.04,-5.18,;-.05,-6.68,;-.04,-3.62,;-1.37,-2.85,;-2.7,-3.62,;-2.7,-5.16,;-1.37,-5.93,;-1.38,-7.47,;-2.72,-8.24,;-4.05,-7.47,;-4.03,-5.93,;-4.03,-2.85,;-5.36,-3.62,;-4.03,-1.31,;1.31,-2.85,;1.31,-1.31,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](N)Cc2ccccc2)c1=O |wD:26.28,(15.8,4.99,;14.47,4.22,;14.47,2.68,;15.8,1.91,;15.8,.35,;14.47,-.4,;13.14,.37,;13.14,1.91,;11.81,2.68,;11.79,-.4,;11.79,-1.92,;13.12,-2.69,;10.46,-2.71,;10.46,-4.25,;11.79,-5.02,;11.79,-6.56,;10.45,-7.33,;13.12,-7.33,;14.45,-6.56,;14.45,-5.02,;13.12,-4.25,;14.21,-3.13,;9.13,-1.94,;7.79,-2.69,;9.13,-.38,;7.8,.39,;6.46,-.38,;5.13,.39,;6.46,-1.92,;5.12,-2.69,;3.79,-1.9,;2.46,-2.67,;2.46,-4.21,;3.79,-4.98,;5.12,-4.21,;10.46,.39,;10.48,1.93,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)NC2CCCC2)c1=O |wU:26.28,(10.27,.16,;8.93,-.64,;8.94,-2.2,;10.29,-2.96,;10.31,-4.5,;8.98,-5.28,;7.64,-4.51,;7.63,-2.97,;6.5,-1.86,;6.31,-5.29,;6.33,-6.83,;7.66,-7.59,;5,-7.61,;5,-9.15,;3.66,-9.93,;3.68,-11.45,;4.75,-12.54,;2.35,-12.23,;1,-11.47,;1,-9.93,;2.33,-9.15,;1.23,-8.05,;3.66,-6.85,;2.33,-7.61,;3.66,-5.31,;2.32,-4.53,;2.32,-2.97,;3.67,-2.19,;.96,-2.2,;.96,-.64,;-.3,.28,;.17,1.77,;1.74,1.77,;2.23,.28,;4.98,-4.53,;4.96,-2.99,)|
CN[C@H](CC(C)C)Cn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1cccc(OC)c1F |wU:2.1,(3.53,-4.51,;4.86,-3.74,;6.19,-4.51,;6.19,-6.05,;4.86,-6.82,;3.53,-6.05,;4.85,-8.36,;7.54,-3.76,;8.87,-4.53,;10.2,-3.76,;10.2,-2.22,;11.53,-4.53,;11.53,-6.07,;12.86,-6.84,;10.2,-6.84,;10.2,-8.38,;11.53,-9.15,;12.86,-8.38,;13.94,-7.29,;14.19,-9.15,;14.19,-10.69,;12.86,-11.46,;11.53,-10.69,;10.18,-11.46,;8.87,-6.07,;7.52,-6.84,;12.86,-3.76,;14.19,-4.55,;15.54,-3.79,;15.55,-2.24,;14.19,-1.47,;14.19,.07,;15.54,.84,;12.86,-2.24,;11.53,-1.45,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)Cc2ccccc2)c1=O |wU:26.28,(11.77,3.73,;10.44,2.96,;10.44,1.42,;11.78,.65,;11.77,-.89,;10.44,-1.66,;9.11,-.87,;9.11,.65,;7.78,1.44,;7.77,-1.64,;7.77,-3.17,;9.1,-3.94,;6.42,-3.95,;6.42,-5.49,;7.75,-6.26,;7.75,-7.8,;6.42,-8.57,;9.08,-8.57,;10.43,-7.8,;10.43,-6.26,;9.08,-5.49,;10.18,-4.39,;5.09,-3.18,;3.76,-3.94,;5.09,-1.63,;3.76,-.86,;2.43,-1.62,;1.1,-.85,;2.43,-3.16,;1.1,-3.93,;-.23,-3.16,;-1.58,-3.92,;-1.58,-5.46,;-.23,-6.24,;1.1,-5.47,;6.44,-.86,;6.45,.68,)|
CN[C@@H](Cc1ccccc1)Cn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1cccc(OC)c1F |r,wU:2.1,(24.86,-2.08,;26.19,-1.31,;26.19,.23,;24.85,1,;24.85,2.54,;26.18,3.31,;26.18,4.85,;24.84,5.62,;23.5,4.83,;23.51,3.3,;27.52,1.01,;28.86,.24,;30.18,1.02,;30.18,2.56,;31.51,.24,;31.51,-1.3,;32.85,-2.07,;30.18,-2.06,;30.18,-3.6,;31.52,-4.37,;32.84,-3.6,;31.5,-2.83,;34.17,-4.36,;34.18,-5.91,;32.84,-6.68,;31.51,-5.91,;30.17,-6.68,;28.86,-1.3,;27.52,-2.07,;32.85,1.01,;34.17,.23,;35.51,.99,;35.52,2.53,;34.17,3.31,;34.17,4.85,;35.51,5.62,;32.84,2.54,;31.51,3.3,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)C(C)C)c1=O |wU:26.28,(4.12,9.96,;2.78,9.19,;2.78,7.65,;4.12,6.88,;4.12,5.33,;2.78,4.57,;1.45,5.34,;1.45,6.88,;.12,7.65,;.1,4.59,;.1,3.05,;1.43,2.28,;-1.23,2.26,;-1.23,.72,;.1,-.05,;.1,-1.6,;-1.24,-2.37,;1.43,-2.37,;2.76,-1.6,;2.76,-.05,;1.43,.72,;2.52,1.82,;-2.56,3.04,;-3.9,2.28,;-2.56,4.59,;-3.89,5.37,;-5.23,4.59,;-6.56,5.37,;-5.23,3.05,;-6.58,2.28,;-4.84,1.57,;-1.23,5.37,;-1.21,6.91,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](N)C(C)C)c1=O |wD:26.28,(23.22,8.17,;21.87,7.4,;21.87,5.87,;23.22,5.09,;23.22,3.54,;21.87,2.78,;20.54,3.56,;20.54,5.09,;19.21,5.87,;19.21,2.79,;19.21,1.26,;20.54,.49,;17.87,.48,;17.87,-1.06,;19.2,-1.83,;19.2,-3.37,;17.86,-4.14,;20.53,-4.14,;21.87,-3.37,;21.87,-1.83,;20.53,-1.06,;21.61,.04,;16.54,1.25,;15.2,.49,;16.54,2.8,;15.21,3.57,;13.87,2.82,;12.54,3.59,;13.87,1.28,;12.54,.51,;14.26,-.22,;17.88,3.57,;17.88,5.11,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](N)C2CCCC2)c1=O |wD:26.28,(26.35,5.99,;25.01,5.22,;25.01,3.68,;26.35,2.91,;26.35,1.37,;25.01,.6,;23.68,1.38,;23.68,2.91,;22.35,3.69,;22.34,.62,;22.34,-.92,;23.67,-1.69,;21.01,-1.7,;21.01,-3.24,;22.34,-4.01,;22.34,-5.55,;21,-6.32,;23.67,-6.32,;25,-5.55,;25,-4,;23.67,-3.23,;24.76,-2.13,;19.68,-.92,;19.65,-2.39,;19.68,.62,;18.35,1.39,;17.01,.63,;15.68,1.4,;17.01,-.91,;18.25,-1.8,;17.76,-3.27,;16.22,-3.27,;15.76,-1.8,;21.01,1.39,;21.02,2.93,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](N)CC(C)C)c1=O |wD:26.28,(12.09,5.83,;10.76,5.06,;10.76,3.54,;12.09,2.75,;12.09,1.21,;10.76,.44,;9.43,1.23,;9.43,2.75,;8.1,3.54,;8.08,.46,;8.08,-1.07,;9.41,-1.84,;6.75,-1.85,;6.75,-3.39,;8.08,-4.16,;9.41,-3.39,;10.5,-2.29,;10.74,-4.16,;10.74,-5.7,;9.41,-6.47,;8.08,-5.7,;6.74,-6.47,;5.42,-1.08,;4.08,-1.84,;5.42,.47,;4.09,1.24,;2.75,.48,;1.42,1.25,;2.75,-1.06,;1.41,-1.83,;.08,-1.06,;1.41,-3.37,;6.75,1.24,;6.77,2.78,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)CC(C)C)c1=O |wU:26.28,(12.16,6.15,;10.83,5.38,;10.83,3.84,;12.18,3.07,;12.16,1.52,;10.83,.76,;9.5,1.53,;9.5,3.07,;8.17,3.84,;8.17,.77,;8.17,-.75,;9.5,-1.52,;6.82,-1.55,;6.82,-3.09,;8.15,-3.85,;9.48,-3.08,;10.58,-1.98,;10.83,-3.85,;10.83,-5.4,;9.48,-6.17,;8.15,-5.4,;6.82,-6.17,;5.49,-.77,;4.16,-1.52,;5.49,.79,;4.16,1.56,;2.83,.79,;1.5,1.56,;2.83,-.75,;1.49,-1.52,;.16,-.75,;1.48,-3.06,;6.84,1.56,;6.84,3.1,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)N)c1=O |wD:26.29,(24.66,-3.65,;23.32,-4.42,;23.32,-5.96,;24.67,-6.73,;24.66,-8.27,;23.32,-9.04,;21.99,-8.26,;21.99,-6.73,;20.66,-5.95,;20.66,-9.01,;20.66,-10.55,;21.99,-11.32,;19.32,-11.34,;19.32,-12.88,;20.65,-13.65,;20.65,-15.19,;19.3,-15.96,;21.98,-15.96,;23.32,-15.19,;23.32,-13.63,;21.98,-12.86,;23.06,-11.77,;17.99,-10.55,;16.64,-11.32,;17.99,-9.01,;16.66,-8.24,;15.31,-9.01,;15.31,-10.55,;13.98,-8.24,;19.33,-8.24,;19.33,-6.7,)|
Cc1c(-c2csc(n2)-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1c(-c2csc(Nc3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1ccc(cc1)-c1nc(cs1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Cc1c(-c2csc(n2)-c2ccccc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1c(-c2csc(n2)-c2ccc(F)cc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1c(-c2csc(n2)-c2ccc(Cl)cc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1ccc(cc1F)-c1nc(cs1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Cc1ccc(Nc2nc(cs2)-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1
COc1ccccc1Nc1nc(cs1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Cc1c(-c2csc(n2)N2CCOCC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1ccc(s1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Cc1c(-c2cccs2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1c(-c2csc(NCc3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
COc1ccc(Nc2nc(cs2)-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1OC
Cc1ccccc1Nc1nc(cs1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Cc1c(-c2ccc(Cl)s2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1ccc(Nc2nc(cs2)-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c(C)c1
Cc1c(-c2csc(n2)-c2ccc3OCCc3c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
CCOC(=O)Nc1ccc(cc1)-c1nc(cs1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Cc1c(-c2csc(Nc3ccc(cc3)[N+]([O-])=O)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
CN(c1nc(cs1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O)c1ccccc1
Cc1c(-c2csc(N)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
CCNc1nc(cs1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Cc1c(-c2ccc(Cl)cc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1c(-c2csc(n2)-c2cccc(c2)C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1c(-c2csc(Cc3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1nc(cs1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Cc1c(-c2csc(n2)-c2ccc(cc2)C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1c(-c2csc(n2)-c2ccc(cc2)C(C)(C)C)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
COc1ccc(Nc2nc(cs2)-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1
Cc1cc(cc(C)c1C)-c1c(OCCC2OCCO2)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O
Cc1cc(cc(C)c1C)-c1c(OCC[C@@H]2CCC[C@@H](N2)C(F)(F)F)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
CN1[C@@H](CCOc2c(-c3cc(C)c(C)c(C)c3)c(=O)[nH]c3cc(Cl)c(cc23)C(=O)Nc2cnsn2)CCC1=O
Cc1cc(cc(C)c1C)-c1c(OCC[C@H]2CCC(=O)N2)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O
Cc1cc(cc(C)c1C)-c1c(OCCC2COCCN2)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O
CN1[C@H](CCOc2c(-c3cc(C)c(C)c(C)c3)c(=O)[nH]c3cc(Cl)c(cc23)C(=O)Nc2ccncn2)CCC[C@@H]1C(F)(F)F
Cc1cc(cc(C)c1C)-c1c(OCCC2CCCC2)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O
Cc1cc(cc(C)c1C)-c1c(OCC[C@@H]2CCN2)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O
Cc1cc(cc(C)c1C)-c1c(OCCC2CC3CCN2CC3)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O |(5.79,2.75,;5.81,1.21,;4.48,.44,;4.48,-1.1,;5.81,-1.87,;7.14,-1.1,;8.47,-1.87,;7.14,.44,;8.48,1.21,;3.13,-1.85,;1.8,-1.07,;1.8,.47,;.47,1.24,;.47,2.78,;-.86,3.55,;-2.19,2.77,;-3.52,3.55,;-2.94,4.71,;-1.45,4.29,;-.86,5.09,;-2.19,5.87,;-3.52,5.09,;.47,-1.85,;-.86,-1.07,;-2.19,-1.85,;-3.52,-1.1,;-3.52,.44,;-4.87,-1.87,;-6.2,-1.1,;-7.62,-1.7,;-8.63,-.56,;-7.88,.77,;-6.36,.44,;-2.19,-3.41,;-3.54,-4.18,;-.86,-4.18,;.47,-3.39,;1.8,-4.18,;3.13,-3.41,;4.46,-4.18,)|
Cc1cc(cc(C)c1C)-c1c(OCC[C@H]2CCO2)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O
Cc1cc(cc(C)c1C)-c1c(OCC[C@@H]2CCCCN2)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O
Cc1cc(cc(C)c1C)-c1c(OCC[C@H]2CC(=O)N2)c2cc(C(=O)Nc3cnsn3)c(Cl)cc2[nH]c1=O
Cc1cc(cc(C)c1C)-c1c(OCC[C@@H]2CCCN2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
Cc1cc(cc(C)c1C)-c1c(OCCC2CCCO2)c2cc(C(=O)Nc3ccncn3)c(Cl)cc2[nH]c1=O
NC(Cc1c[nH]c2ccccc12)Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2c(F)cccc2F)c1=O |(-3.42,2.79,;-2.07,2.05,;-.76,2.81,;-.78,4.34,;.45,5.24,;-.04,6.68,;-1.55,6.68,;-2.57,7.8,;-4.05,7.46,;-4.53,6.03,;-3.49,4.9,;-2.01,5.22,;-2.07,.52,;-.72,-.26,;-.72,-1.81,;-2.07,-2.58,;.62,-2.69,;.62,-5.65,;-.72,-6.41,;-2.07,-5.65,;-2.07,-4.12,;-3.42,-6.42,;-3.42,-7.97,;-2.07,-8.75,;-.72,-7.97,;.62,-8.75,;1.95,-1.81,;3.29,-2.58,;1.95,-.26,;3.29,.52,;3.29,2.05,;1.97,2.81,;4.63,2.84,;5.97,2.05,;5.97,.5,;4.63,-.26,;4.63,-1.79,;.62,.52,;.62,2.07,)|
N[C@@H](Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2c(F)cccc2F)c1=O)c1ccccc1 |wD:1.0,(-2.88,-.17,;-2.88,1.33,;-1.56,2.1,;-.25,1.33,;-.25,-.22,;-1.58,-.98,;1.21,-1.02,;1.21,-3.98,;-.13,-4.74,;-.13,-6.31,;1.21,-7.07,;-1.47,-7.07,;-2.81,-6.31,;-2.81,-4.76,;-1.47,-3.98,;-1.49,-2.45,;2.41,-.22,;3.75,-.97,;2.41,1.33,;3.77,2.12,;3.77,3.65,;2.43,4.4,;5.08,4.42,;6.45,3.64,;6.42,2.09,;5.08,1.33,;5.08,-.19,;1.09,2.12,;1.09,3.66,;-4.19,2.09,;-5.51,1.33,;-6.82,2.07,;-6.85,3.62,;-5.51,4.38,;-4.19,3.62,)|
COc1cccc(c1)-c1c(C)n(CCN(C)CCc2ccccn2)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2c(F)cccc2F)c1=O |r|
COc1cccc(c1)-n1c(=O)n(CC(N)c2ccccc2)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1)-n1c(=O)n(CCN(C)CCc2ccccn2)c(=O)n(Cc2c(F)cccc2F)c1=O
N[C@@H](Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2ccc3nsnc3c2)c1=O)c1ccccc1
N[C@@H](Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2ccccc2F)c1=O)c1ccccc1 |wD:1.0,(-2.74,-.19,;-2.72,1.33,;-1.41,2.09,;-.08,1.33,;-.08,-.22,;-1.43,-.98,;1.36,-1.02,;1.36,-3.98,;.02,-4.74,;.03,-6.31,;1.36,-7.07,;-1.33,-7.07,;-2.67,-6.31,;-2.66,-4.76,;-1.33,-3.98,;-1.33,-2.46,;2.57,-.22,;3.91,-.98,;2.57,1.33,;3.93,2.12,;5.24,1.33,;6.58,2.09,;6.61,3.64,;5.24,4.43,;3.93,3.64,;2.59,4.4,;1.25,2.12,;1.25,3.66,;-4.04,2.09,;-4.04,3.62,;-5.36,4.38,;-6.69,3.62,;-6.67,2.07,;-5.36,1.33,)|
CSc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(SCCNCc4ccccc4)nc3c2)cc1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(SCCc4ccccn4)nc3c2)cc1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(SCc4ccccn4)nc3c2)cc1
OCCSc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(SCc4ccncc4)nc3c2)cc1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(SCCc4cccnc4)nc3c2)cc1
CCSc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(Cl)cc1
CCOC(=O)CSc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
CCOc1nc2cc(ccc2n1Cc1ccsc1)S(=O)(=O)NCc1ccc(F)cc1
CCOc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(NCCN4CCOCC4)nc3c2)cc1
CCSc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(OC)cc1
CCSc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
CCSc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1cccc(OC)c1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(OCCN4CCOCC4)nc3c2)cc1
CCSc1nc2cc(ccc2n1CCc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(SCCN4CCOCC4)nc3c2)cc1
CCSc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCCN1CCOCC1
CCOc1nc2cc(ccc2n1Cc1cccc(Cl)c1)S(=O)(=O)NCc1ccc(F)cc1
CCSc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(cc1)[N+]([O-])=O
CCOc1nc2cc(ccc2n1CCN1CCOCC1)S(=O)(=O)NCc1ccc(F)cc1
CC(C)(C)CC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
CCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
CC(C)(C)NC(=O)NCCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
COc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(CCNC(=O)NC(C)(C)C)nc3c2)cc1
CCNC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(nc3c2)C2CC2)cc1
CC(C)(C)NC(=O)CCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(CCNC(=O)Nc4ccccc4Cl)nc3c2)cc1
CC(C)(C)NC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccccc1
NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
CC(C)(C)NC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(Cl)cc1Cl
CC(C)(C)OC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
Fc1ccc(CNS(=O)(=O)c2ccc3n(Cc4ccccc4)c(CCNC(=O)Nc4ccccc4F)nc3c2)cc1
CC(C)(C)NC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
CC(C)(C)NC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(c(F)c1)C(F)(F)F
CC(C)(C)NC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)c(F)c1
CC(C)(C)NC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccccc1F
CC(C)NC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
CC(C)(C)NC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(Cl)cc1
CC(C)c1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
COc1cccc(c1)-c1c2OCC(c3ccccc3)n2c(=O)n(CC(N)c2ccccc2)c1=O
COc1cccc(c1Cl)-c1c2SCC(c3ccccc3F)n2c(=O)n(CC(N)c2ccccc2)c1=O |(5.96,6.15,;4.63,5.38,;4.63,3.84,;5.97,3.06,;5.96,1.52,;4.63,.76,;3.3,1.53,;3.3,3.07,;1.97,3.83,;1.97,.76,;1.97,-.78,;3.1,-1.8,;2.48,-3.18,;.96,-3.02,;-.09,-4.16,;-1.58,-3.84,;-2.61,-4.98,;-2.14,-6.44,;-.63,-6.77,;.4,-5.62,;1.9,-5.94,;.64,-1.52,;-.69,-.78,;-2.02,-1.55,;-.69,.76,;-2.02,1.53,;-3.35,.76,;-3.35,-.78,;-4.68,1.53,;-4.68,3.07,;-6.01,3.83,;-7.37,3.06,;-7.35,1.51,;-6.01,.75,;.64,1.53,;.64,3.08,)|
NC(Cn1c(=O)c(c2SCC(c3ccccc3F)n2c1=O)-c1ccccc1F)c1ccccc1 |(-3.05,-.44,;-3.05,1.1,;-1.72,1.87,;-.37,1.1,;.94,1.88,;.94,3.42,;2.27,1.1,;2.27,-.44,;3.41,-1.45,;2.78,-2.83,;1.27,-2.68,;.24,-3.83,;-1.28,-3.5,;-2.3,-4.63,;-1.84,-6.1,;-.32,-6.42,;.71,-5.28,;2.22,-5.6,;.96,-1.19,;-.37,-.44,;-1.72,-1.21,;3.62,1.87,;4.93,1.1,;6.28,1.86,;6.28,3.4,;4.93,4.19,;3.6,3.41,;2.27,4.17,;-4.38,1.87,;-5.71,1.09,;-7.04,1.84,;-7.04,3.4,;-5.71,4.17,;-4.38,3.41,)|
NC(Cn1c(=O)c(c2OCC(c3ccccc3)n2c1=O)-c1ccccc1F)c1ccccc1 |(-2.98,-.61,;-2.98,.93,;-1.65,1.69,;-.3,.93,;1.01,1.72,;1.01,3.26,;2.34,.93,;2.34,-.61,;3.48,-1.63,;2.85,-3.02,;1.34,-2.85,;.3,-3.99,;-1.2,-3.66,;-2.23,-4.81,;-1.76,-6.26,;-.25,-6.6,;.78,-5.44,;1.03,-1.36,;-.3,-.61,;-1.65,-1.38,;3.69,1.69,;5,.93,;6.34,1.68,;6.35,3.24,;5,4,;3.67,3.24,;2.34,4,;-4.31,1.69,;-5.63,.91,;-6.96,1.68,;-6.97,3.24,;-5.63,4,;-4.31,3.24,)|
NC(Cn1c(=O)c(c2SCC(c3ccccc3F)n2c1=O)-c1ccccc1Cl)c1ccccc1 |(-3.03,-.44,;-3.03,1.1,;-1.7,1.87,;-.37,1.1,;.96,1.88,;.96,3.42,;2.27,1.1,;2.27,-.44,;3.41,-1.45,;2.78,-2.83,;1.27,-2.68,;.22,-3.83,;-1.28,-3.5,;-2.3,-4.63,;-1.84,-6.1,;-.32,-6.42,;.71,-5.28,;2.22,-5.6,;.96,-1.19,;-.37,-.44,;-1.7,-1.21,;3.62,1.87,;4.95,1.1,;6.26,1.86,;6.28,3.4,;4.95,4.19,;3.62,3.41,;2.27,4.17,;-4.38,1.87,;-5.69,1.09,;-7.04,1.84,;-7.06,3.4,;-5.71,4.17,;-4.38,3.41,)|
COc1cccc(c1F)-c1c2OCC(c3ccccc3)n2c(=O)n(CC(N)c2ccccc2)c1=O |(6.04,6,;4.68,5.21,;4.68,3.67,;6.04,2.9,;6.04,1.36,;4.68,.58,;3.37,1.37,;3.35,2.9,;2.02,3.67,;2.02,.6,;2.02,-.94,;3.16,-1.96,;2.53,-3.37,;1.01,-3.2,;-.02,-4.35,;.45,-5.8,;-.58,-6.94,;-2.1,-6.62,;-2.56,-5.15,;-1.54,-4.01,;.71,-1.71,;-.62,-.94,;-1.98,-1.71,;-.62,.6,;-1.98,1.37,;-3.31,.58,;-3.31,-.96,;-4.65,1.36,;-4.65,2.9,;-5.98,3.67,;-7.31,2.9,;-7.31,1.35,;-5.98,.58,;.69,1.38,;.69,2.92,)|
COc1cccc(c1F)-c1c2CCC(c3ccccc3)n2c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:25.28,(6.04,6,;4.68,5.21,;4.68,3.67,;6.04,2.89,;6.04,1.35,;4.68,.58,;3.37,1.37,;3.35,2.9,;2.02,3.66,;2.02,.6,;2.02,-.94,;3.16,-1.97,;2.53,-3.37,;1.01,-3.2,;-.02,-4.35,;.45,-5.81,;-.58,-6.95,;-2.1,-6.62,;-2.56,-5.15,;-1.54,-4.01,;.71,-1.71,;-.62,-.94,;-1.98,-1.71,;-.62,.6,;-1.98,1.37,;-3.31,.58,;-3.31,-.96,;-4.65,1.36,;-4.65,2.9,;-5.98,3.66,;-7.31,2.89,;-7.31,1.35,;-5.98,.58,;.69,1.37,;.69,2.91,)|
N[C@@H](Cn1c(=O)c(c2SCC(c3ccccc3)n2c1=O)-c1ccccc1F)c1ccccc1 |r,wD:1.0,(-7.11,-15.38,;-7.12,-13.84,;-5.79,-13.07,;-4.45,-13.83,;-3.12,-13.06,;-3.12,-11.51,;-1.79,-13.83,;-1.79,-15.37,;-.66,-16.39,;-1.27,-17.79,;-2.79,-17.63,;-3.81,-18.77,;-5.32,-18.45,;-6.35,-19.6,;-5.87,-21.07,;-4.35,-21.38,;-3.33,-20.23,;-3.11,-16.14,;-4.45,-15.37,;-5.78,-16.15,;-.46,-13.06,;.87,-13.83,;2.2,-13.06,;2.2,-11.52,;.86,-10.75,;-.47,-11.53,;-1.81,-10.77,;-8.45,-13.08,;-8.45,-11.54,;-9.79,-10.77,;-11.12,-11.54,;-11.11,-13.09,;-9.78,-13.85,)|
NC(Cn1c(=O)c(c2OCC(c3ccccc3F)n2c1=O)-c1ccccc1F)c1ccccc1 |(-3.05,-.44,;-3.05,1.1,;-1.72,1.87,;-.37,1.1,;.94,1.89,;.94,3.42,;2.27,1.1,;2.27,-.44,;3.41,-1.45,;2.78,-2.85,;1.27,-2.68,;.24,-3.83,;-1.28,-3.5,;-2.3,-4.64,;-1.84,-6.1,;-.32,-6.42,;.71,-5.28,;2.22,-5.6,;.96,-1.19,;-.37,-.44,;-1.72,-1.21,;3.62,1.87,;4.93,1.1,;6.28,1.86,;6.28,3.41,;4.93,4.19,;3.6,3.41,;2.27,4.17,;-4.38,1.87,;-5.71,1.09,;-7.04,1.84,;-7.04,3.41,;-5.71,4.17,;-4.38,3.41,)|
COc1cccc(c1F)-c1c2SCC(c3ccccc3F)n2c(=O)n(CC(N)c2ccccc2)c1=O |(5.97,6.15,;4.63,5.38,;4.63,3.84,;5.98,3.06,;5.97,1.52,;4.63,.76,;3.31,1.53,;3.3,3.07,;1.97,3.83,;1.97,.76,;1.97,-.78,;3.11,-1.8,;2.48,-3.18,;.96,-3.02,;-.09,-4.16,;-1.58,-3.83,;-2.61,-4.98,;-2.14,-6.44,;-.62,-6.77,;.4,-5.62,;1.91,-5.93,;.65,-1.52,;-.68,-.78,;-2.02,-1.55,;-.68,.76,;-2.02,1.53,;-3.35,.76,;-3.35,-.78,;-4.68,1.53,;-4.68,3.07,;-6.01,3.83,;-7.37,3.06,;-7.34,1.51,;-6.01,.75,;.63,1.53,;.63,3.08,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r,wD:14.15,(17.08,-29.9,;15.75,-29.13,;15.75,-27.59,;17.08,-26.82,;18.41,-27.59,;19.74,-26.82,;19.74,-25.28,;18.4,-24.51,;17.07,-25.28,;15.73,-24.52,;14.42,-26.81,;14.42,-25.27,;13.09,-27.59,;11.75,-26.82,;10.42,-27.6,;10.43,-29.14,;9.09,-26.83,;9.09,-25.29,;7.76,-24.53,;6.42,-25.3,;6.43,-26.85,;7.77,-27.61,;13.09,-29.13,;11.76,-29.9,;14.42,-29.89,;14.42,-31.43,;15.75,-32.2,;17.07,-31.43,;15.73,-30.66,;18.41,-32.19,;18.41,-33.74,;17.08,-34.51,;15.74,-33.74,;14.41,-34.51,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Cl |wD:14.15,(3.92,-1.42,;2.57,-.65,;2.57,.89,;3.92,1.67,;5.23,.88,;6.56,1.65,;6.56,3.19,;5.23,3.94,;3.9,3.19,;2.57,3.96,;1.24,1.67,;1.24,3.21,;-.09,.89,;-1.42,1.67,;-2.75,.88,;-2.75,-.66,;-4.08,1.65,;-5.41,.88,;-6.74,1.63,;-6.74,3.19,;-5.41,3.96,;-4.08,3.19,;-.09,-.65,;-1.42,-1.42,;1.24,-1.41,;1.24,-2.95,;-.09,-3.72,;-1.42,-2.94,;-2.75,-3.71,;-2.75,-5.25,;-1.4,-6.02,;-.09,-5.25,;1.26,-6,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccnc1 |wD:14.15,(2.95,-1.61,;1.62,-.84,;1.62,.7,;2.95,1.47,;4.29,.69,;5.62,1.47,;5.62,3.01,;4.29,3.78,;2.95,3.01,;1.62,3.78,;.29,1.49,;.29,3.03,;-1.04,.7,;-2.38,1.47,;-3.71,.69,;-3.71,-.85,;-5.07,1.47,;-6.38,.69,;-7.73,1.45,;-7.73,3.01,;-6.4,3.78,;-5.07,3.01,;-1.04,-.84,;-2.38,-1.61,;.29,-1.6,;.29,-3.14,;1.62,-3.91,;1.62,-5.46,;2.95,-6.23,;4.29,-5.46,;4.29,-3.91,;2.95,-3.14,)|
Cc1oc(=O)n(C[C@H](N)c2ccccc2)c(=O)c1-c1ccccc1F |wD:7.7,(3.67,-2.85,;2.33,-2.08,;1,-2.85,;-.32,-2.08,;-1.66,-2.85,;-.32,-.54,;-1.66,.23,;-2.99,-.54,;-2.99,-2.08,;-4.32,.23,;-5.65,-.56,;-6.98,.2,;-7,1.75,;-5.65,2.52,;-4.32,1.77,;1,.23,;1,1.77,;2.33,-.54,;3.67,.23,;4.99,-.54,;6.35,.21,;6.35,1.75,;4.99,2.51,;3.66,1.77,;2.33,2.54,)|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1cccc(OC)c1)c1ccccc1
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1cccc(OC)c1F)c1ccccc1 |wD:2.1,(-3.85,-2.39,;-3.85,-.85,;-3.85,.68,;-2.54,1.46,;-1.19,.69,;.15,1.49,;.15,3.03,;1.48,.69,;1.48,-.85,;2.8,-1.62,;.15,-1.59,;.15,-3.13,;1.48,-3.9,;2.8,-3.13,;1.45,-2.36,;4.14,-3.9,;4.14,-5.44,;2.8,-6.23,;1.48,-5.44,;.14,-6.23,;-1.19,-.85,;-2.51,-1.62,;2.8,1.46,;4.14,.68,;5.46,1.46,;5.48,2.99,;4.14,3.77,;4.14,5.31,;2.8,6.08,;2.8,2.99,;1.48,3.77,;-5.2,1.46,;-5.2,2.99,;-6.53,3.77,;-7.86,2.98,;-7.86,1.42,;-6.5,.68,)|
Cc1c(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |wD:14.15,(2.9,-1.34,;1.57,-.58,;1.57,.96,;2.9,1.73,;4.22,.95,;5.56,1.71,;5.56,3.27,;4.22,4.02,;2.9,3.27,;1.57,4.04,;.23,1.73,;.23,3.27,;-1.1,.96,;-2.43,1.73,;-3.76,.95,;-3.76,-.59,;-5.11,1.72,;-5.11,3.27,;-6.45,4.02,;-7.79,3.27,;-7.78,1.71,;-6.43,.94,;-1.1,-.58,;-2.43,-1.34,;.23,-1.34,;.23,-2.88,;1.57,-3.66,;1.57,-5.2,;.22,-5.97,;2.9,-5.97,;4.22,-5.2,;4.22,-3.65,;2.9,-2.88,;1.55,-2.09,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r,wD:26.28,(6.65,3.5,;5.31,2.74,;3.98,3.51,;3.98,5.05,;2.64,5.83,;1.31,5.06,;1.31,3.52,;2.64,2.75,;2.64,1.21,;-.02,2.76,;-.02,1.22,;1.3,.46,;-1.35,.46,;-1.35,-1.08,;-.01,-1.85,;1.31,-1.08,;2.64,-.3,;2.64,-1.85,;2.65,-3.39,;1.31,-4.16,;-.02,-3.39,;-1.36,-4.16,;-2.68,1.22,;-4.01,.45,;-2.68,2.76,;-4.01,3.53,;-5.34,2.75,;-5.34,1.21,;-6.68,3.52,;-6.68,5.06,;-8.02,5.83,;-9.36,5.04,;-9.35,3.51,;-8.01,2.75,;-1.35,3.54,;-1.35,5.08,)|
Cc1c(-c2ccc3OCOc3c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl |r,wD:14.15,(32.48,-29.08,;31.15,-28.31,;31.15,-26.77,;32.48,-26,;33.81,-26.77,;35.14,-26,;35.14,-24.46,;33.8,-23.69,;32.47,-24.47,;31.13,-23.7,;29.82,-25.99,;29.82,-24.45,;28.49,-26.77,;27.15,-26.01,;25.82,-26.78,;25.83,-28.32,;24.49,-26.02,;24.49,-24.47,;23.16,-23.71,;21.82,-24.48,;21.83,-26.03,;23.17,-26.79,;28.49,-28.31,;27.16,-29.08,;29.82,-29.07,;29.82,-30.61,;31.15,-31.38,;32.47,-30.61,;31.13,-29.84,;33.81,-31.38,;33.81,-32.93,;32.48,-33.7,;31.14,-32.93,;29.81,-33.69,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1 |wD:14.15,(4.07,-1.42,;2.73,-.65,;2.73,.89,;4.07,1.67,;5.39,.88,;6.74,1.65,;6.74,3.19,;5.39,3.94,;4.07,3.19,;2.73,3.96,;1.41,1.67,;1.41,3.21,;.08,.89,;-1.26,1.67,;-2.58,.88,;-2.58,-.66,;-3.92,1.65,;-5.25,.88,;-6.57,1.63,;-6.58,3.19,;-5.25,3.96,;-3.92,3.19,;.08,-.65,;-1.26,-1.42,;1.41,-1.41,;1.41,-2.95,;.07,-3.72,;.08,-5.25,;-1.24,-6.02,;-2.58,-5.25,;-3.92,-6.03,;-2.58,-3.71,;-1.26,-2.94,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccc(F)c1 |wD:14.15,(4,-1.38,;2.64,-.61,;2.64,.93,;4,1.72,;5.3,.93,;6.66,1.7,;6.66,3.24,;5.3,4.01,;3.97,3.24,;2.64,4.01,;1.31,1.72,;1.31,3.26,;.01,.93,;-1.35,1.72,;-2.68,.93,;-2.68,-.61,;-4.01,1.7,;-4.01,3.24,;-5.34,4.01,;-6.67,3.24,;-6.67,1.68,;-5.34,.93,;.01,-.61,;-1.35,-1.38,;1.31,-1.36,;1.31,-2.9,;-.02,-3.67,;-1.35,-2.89,;-2.68,-3.66,;-2.68,-5.2,;-1.32,-5.97,;-1.32,-7.51,;.01,-5.2,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1Cl |wD:14.15,(4.04,-1.24,;2.69,-.47,;2.69,1.07,;4.04,1.84,;5.35,1.07,;6.7,1.82,;6.7,3.36,;5.35,4.13,;4.02,3.36,;2.69,4.15,;1.36,1.84,;1.36,3.38,;.05,1.07,;-1.3,1.84,;-2.63,1.07,;-2.63,-.47,;-3.96,1.84,;-3.96,3.36,;-5.29,4.13,;-6.63,3.36,;-6.62,1.82,;-5.29,1.05,;.05,-.47,;-1.3,-1.24,;1.36,-1.24,;1.36,-2.78,;.03,-3.55,;-1.3,-2.76,;-2.63,-3.52,;-2.63,-5.06,;-3.96,-5.84,;-1.28,-5.83,;.05,-5.06,;1.38,-5.83,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C(C)C)N(C)C)c1=O |wD:26.31,(2.31,6.35,;3.65,5.59,;3.65,4.05,;4.98,3.26,;4.98,1.72,;3.65,.97,;2.32,1.74,;2.31,3.28,;.99,4.04,;.99,.97,;.99,-.57,;2.32,-1.34,;-.34,-1.34,;-.34,-2.85,;.99,-3.62,;2.31,-2.85,;.96,-2.08,;3.65,-3.62,;3.65,-5.16,;2.31,-5.93,;.99,-5.16,;-.37,-5.93,;-1.67,-.57,;-3,-1.34,;-1.67,.97,;-3.03,1.74,;-4.36,.97,;-5.69,1.72,;-7.02,.95,;-5.69,3.26,;-4.33,-.57,;-4.36,-2.11,;-5.66,-1.34,;-.34,1.75,;-.34,3.29,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N(C)C)c2ccccc2)c1=O |wD:26.28,(2.92,6.11,;4.25,5.34,;4.25,3.82,;5.61,3.03,;5.61,1.49,;4.25,.72,;2.95,1.51,;2.92,3.03,;1.59,3.8,;1.59,.74,;1.59,-.8,;2.95,-1.57,;.26,-1.57,;.26,-3.1,;1.59,-3.87,;2.92,-3.09,;1.59,-2.32,;4.28,-3.86,;4.28,-5.41,;2.92,-6.18,;1.59,-5.41,;.26,-6.18,;-1.04,-.8,;-2.4,-1.57,;-1.04,.74,;-2.4,1.49,;-3.73,.72,;-3.73,-.82,;-3.73,-2.36,;-5.04,-1.59,;-5.06,1.49,;-6.39,.72,;-7.72,1.47,;-7.74,3.03,;-6.39,3.8,;-5.06,3.03,;.26,1.51,;.26,3.05,)|
Cc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:25.27,(4.09,5.41,;4.09,3.87,;5.44,3.1,;5.44,1.56,;4.09,.79,;2.76,1.58,;2.76,3.1,;1.45,3.87,;1.45,.81,;1.45,-.73,;2.76,-1.5,;.1,-1.5,;.1,-3.04,;1.45,-3.81,;2.76,-3.02,;1.43,-2.25,;4.09,-3.79,;4.09,-5.35,;2.76,-6.12,;1.45,-5.35,;.1,-6.12,;-1.23,-.73,;-2.54,-1.5,;-1.23,.81,;-2.54,1.58,;-3.89,.79,;-3.89,-.75,;-5.22,1.56,;-5.22,3.1,;-6.55,3.87,;-7.89,3.1,;-7.88,1.56,;-6.53,.79,;.1,1.58,;.1,3.12,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C(C)C)N(C)C)c1=O |wU:26.31,(2.31,6.35,;3.64,5.58,;3.64,4.04,;4.99,3.28,;4.98,1.73,;3.64,.97,;2.32,1.74,;2.31,3.28,;.98,4.04,;.98,.97,;.98,-.57,;2.32,-1.34,;-.35,-1.33,;-.35,-2.87,;.98,-3.62,;2.31,-2.85,;.98,-2.08,;3.65,-3.62,;3.65,-5.18,;2.31,-5.93,;.98,-5.18,;-.35,-5.93,;-1.67,-.57,;-3.01,-1.34,;-1.67,.97,;-3.01,1.74,;-4.34,.97,;-5.67,1.73,;-7,.97,;-5.69,3.28,;-4.34,-.58,;-4.34,-2.12,;-5.67,-1.34,;-.35,1.77,;-.35,3.29,)|
CSc1ccc(cc1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1 |wD:14.15,(3.95,-1.61,;2.61,-.84,;2.61,.7,;3.95,1.47,;5.27,.69,;6.61,1.46,;6.61,3,;5.27,3.77,;3.95,3,;2.61,3.77,;1.28,1.49,;1.28,3.03,;-.04,.7,;-1.38,1.47,;-2.7,.69,;-2.7,-.85,;-4.05,1.46,;-5.37,.69,;-6.71,1.45,;-6.71,3,;-5.38,3.77,;-4.05,3,;-.04,-.84,;-1.38,-1.61,;1.28,-1.59,;1.28,-3.13,;-.04,-3.9,;-1.38,-3.13,;-2.72,-3.9,;-2.72,-5.44,;-1.37,-6.21,;-.04,-5.44,)|
COc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:24.26,(1.22,-7.31,;1.22,-5.79,;-.12,-5.02,;-1.44,-5.79,;-2.79,-5.02,;-2.79,-3.48,;-1.46,-2.71,;-.13,-3.5,;1.2,-2.71,;1.2,-1.19,;2.53,-.43,;3.88,-1.2,;2.53,1.11,;3.88,1.91,;5.19,1.1,;6.54,1.87,;6.54,3.41,;5.19,4.17,;3.86,3.41,;2.53,4.19,;1.2,1.91,;1.2,3.45,;-.12,1.11,;-1.46,1.91,;-2.79,1.1,;-2.79,-.44,;-4.12,1.87,;-5.45,1.1,;-6.78,1.86,;-6.78,3.41,;-5.45,4.19,;-4.12,3.41,;-.12,-.43,;-1.46,-1.2,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cc(F)ccc1C(F)(F)F |wD:14.15,(3.83,-.8,;2.5,-.03,;2.5,1.51,;3.83,2.28,;5.16,1.49,;6.49,2.26,;6.49,3.8,;5.16,4.57,;3.83,3.8,;2.5,4.59,;1.17,2.28,;1.17,3.82,;-.16,1.51,;-1.49,2.28,;-2.82,1.49,;-2.82,-.05,;-4.15,2.26,;-5.48,1.49,;-6.81,2.26,;-6.83,3.8,;-5.48,4.57,;-4.15,3.8,;-.16,-.03,;-1.49,-.8,;1.17,-.8,;1.17,-2.34,;-.16,-3.11,;-1.49,-2.32,;-2.82,-3.09,;-4.15,-2.32,;-2.82,-4.63,;-1.49,-5.4,;-.16,-4.63,;1.19,-5.4,;2.4,-6.1,;1.45,-6.98,;2.68,-4.83,)|
Cc1c(-c2ccc3OCCOc3c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)NC2CCC2)c1=O |wU:26.28,(2.42,6.57,;3.73,5.82,;3.73,4.28,;5.1,3.51,;5.06,1.97,;3.73,1.2,;2.42,1.98,;2.42,3.51,;1.08,4.28,;1.08,1.23,;1.08,-.33,;2.42,-1.08,;-.23,-1.08,;-.23,-2.62,;1.08,-3.39,;1.08,-4.92,;-.23,-5.69,;2.42,-5.69,;3.73,-4.92,;3.73,-3.36,;2.42,-2.61,;1.08,-1.82,;-1.58,-.33,;-2.9,-1.08,;-1.58,1.23,;-2.9,1.98,;-4.22,1.2,;-5.56,1.97,;-4.22,-.33,;-5.56,-1.12,;-5.96,-2.61,;-7.45,-2.2,;-7.05,-.71,;-.23,1.98,;-.23,3.53,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](N)c2ccccc2)c1=O |wU:26.28,(2.69,6.02,;4.03,5.23,;4.03,3.71,;5.37,2.92,;5.37,1.39,;4.03,.62,;2.69,1.39,;2.69,2.92,;1.36,3.71,;1.36,.62,;1.36,-.9,;2.69,-1.69,;.03,-1.68,;.03,-3.21,;1.36,-3.98,;2.69,-3.21,;1.34,-2.43,;4.03,-3.98,;4.03,-5.52,;2.69,-6.29,;1.36,-5.52,;.02,-6.29,;-1.28,-.9,;-2.63,-1.69,;-1.28,.62,;-2.63,1.39,;-3.96,.62,;-3.96,-.93,;-5.32,1.39,;-5.32,2.92,;-6.65,3.71,;-7.98,2.92,;-7.98,1.37,;-6.63,.62,;.03,1.42,;.03,2.96,)|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1ccc2OCOc2c1)c1ccccc1
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1C(F)(F)F |wD:14.15,(3.73,-.86,;2.39,-.1,;2.39,1.45,;3.73,2.21,;5.04,1.42,;6.38,2.19,;6.38,3.73,;5.04,4.5,;3.72,3.73,;2.39,4.52,;1.05,2.21,;1.05,3.77,;-.27,1.45,;-1.61,2.21,;-2.94,1.42,;-2.94,-.1,;-4.26,2.21,;-4.26,3.73,;-5.6,4.5,;-6.95,3.73,;-6.92,2.19,;-5.6,1.42,;-.27,-.1,;-1.61,-.86,;1.05,-.86,;1.05,-2.4,;-.27,-3.17,;-1.61,-2.39,;-2.94,-3.15,;-2.94,-4.7,;-1.6,-5.46,;-.27,-4.7,;1.07,-5.46,;2.29,-6.16,;1.34,-7.05,;2.57,-4.88,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)N(C)Cc2ccccn2)c1=O |wU:26.28,(2.12,4.82,;3.44,4.05,;3.44,2.51,;4.79,1.73,;4.77,.19,;3.44,-.57,;2.12,.2,;2.12,1.74,;.78,2.51,;.78,-.57,;.78,-2.11,;2.12,-2.87,;-.55,-2.87,;-.55,-4.39,;.78,-5.18,;2.12,-4.39,;.78,-3.64,;3.44,-5.16,;3.44,-6.72,;2.12,-7.47,;.78,-6.72,;-.55,-7.47,;-1.87,-2.11,;-3.21,-2.87,;-1.87,-.57,;-3.21,.2,;-3.21,1.74,;-1.88,2.51,;-4.57,2.51,;-5.9,1.74,;-4.57,4.05,;-3.24,4.82,;-1.91,4.04,;-.56,4.82,;-.56,6.35,;-1.93,7.12,;-3.24,6.35,;-.55,.21,;-.55,1.77,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1SC(F)(F)F |wD:14.15,(3.78,-.51,;2.43,.26,;2.43,1.8,;3.78,2.58,;5.09,1.79,;6.44,2.56,;6.44,4.1,;5.09,4.85,;3.76,4.1,;2.43,4.87,;1.1,2.58,;1.1,4.12,;-.21,1.8,;-1.56,2.58,;-2.89,1.79,;-2.89,.25,;-4.22,2.56,;-5.55,1.79,;-6.88,2.54,;-6.88,4.1,;-5.55,4.87,;-4.22,4.1,;-.21,.26,;-1.56,-.51,;1.1,-.5,;1.1,-2.04,;-.23,-2.81,;-1.56,-2.03,;-2.89,-2.8,;-2.89,-4.34,;-1.54,-5.11,;-.21,-4.34,;1.12,-5.09,;1.13,-6.63,;1.13,-8.06,;-.12,-7.68,;2.38,-7.66,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CC1 |wD:14.15,(3.74,-2.12,;2.41,-1.34,;2.41,.19,;3.74,.97,;5.07,.18,;6.4,.93,;6.4,2.47,;5.07,3.26,;3.74,2.49,;2.41,3.26,;1.08,.97,;1.08,2.51,;-.25,.19,;-1.58,.97,;-2.91,.18,;-2.91,-1.36,;-4.24,.95,;-5.57,.18,;-6.91,.93,;-6.92,2.47,;-5.57,3.26,;-4.24,2.49,;-.25,-1.34,;-1.58,-2.12,;1.08,-2.12,;1.08,-3.65,;-.25,-4.43,;-1.79,-4.43,;-1.02,-5.75,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](N)C2CCCCC2)c1=O |wU:26.28,(2.7,6.02,;4.03,5.25,;4.03,3.71,;5.39,2.94,;5.36,1.39,;4.03,.62,;2.7,1.39,;2.7,2.94,;1.36,3.71,;1.36,.62,;1.36,-.92,;2.7,-1.69,;.03,-1.67,;.03,-3.21,;1.36,-3.98,;2.7,-3.21,;1.36,-2.44,;4.03,-3.98,;4.03,-5.53,;2.7,-6.3,;1.36,-5.53,;.03,-6.3,;-1.3,-.92,;-2.63,-1.69,;-1.3,.62,;-2.63,1.39,;-3.97,.62,;-3.97,-.92,;-5.3,1.39,;-5.32,2.94,;-6.66,3.71,;-7.99,2.94,;-7.99,1.39,;-6.66,.62,;.03,1.42,;.03,2.96,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Br |wD:14.15,(3.92,-1.42,;2.57,-.65,;2.57,.89,;3.92,1.67,;5.23,.88,;6.56,1.65,;6.56,3.19,;5.23,3.94,;3.9,3.19,;2.57,3.96,;1.24,1.67,;1.24,3.21,;-.09,.89,;-1.42,1.67,;-2.75,.88,;-2.75,-.66,;-4.08,1.65,;-5.41,.88,;-6.74,1.63,;-6.74,3.19,;-5.41,3.96,;-4.08,3.19,;-.09,-.65,;-1.42,-1.42,;1.24,-1.41,;1.24,-2.95,;-.09,-3.72,;-1.42,-2.94,;-2.75,-3.71,;-2.75,-5.25,;-1.4,-6.02,;-.09,-5.25,;1.26,-6,)|
COCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:19.20,(-1.61,-6.65,;-.27,-5.88,;-.27,-4.34,;1.05,-3.57,;1.05,-2.03,;2.39,-1.27,;3.71,-2.03,;2.39,.28,;3.71,1.05,;5.04,.27,;6.38,1.03,;6.38,2.57,;5.04,3.34,;3.71,2.58,;2.39,3.35,;1.05,1.05,;1.05,2.59,;-.27,.28,;-1.61,1.05,;-2.94,.27,;-2.94,-1.27,;-4.29,1.04,;-4.29,2.58,;-5.6,3.34,;-6.95,2.57,;-6.95,1.03,;-5.6,.26,;-.27,-1.27,;-1.61,-2.03,)|
Cc1c(-c2ccc(Oc3ccccc3)cc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccc1 |wD:14.15,(3.73,-1.08,;2.37,-.29,;2.37,1.25,;3.73,2.01,;5.03,1.24,;6.39,2,;6.39,3.55,;5.03,4.3,;3.7,3.55,;2.37,4.33,;1.04,2.03,;1.04,3.57,;-.3,1.25,;-1.63,2.01,;-2.96,1.24,;-2.96,-.29,;-4.29,2.01,;-4.29,3.55,;-5.63,4.32,;-6.96,3.55,;-6.96,1.99,;-5.63,1.23,;-.3,-.29,;-1.63,-1.08,;1.04,-1.06,;1.04,-2.6,;-.3,-3.37,;-.3,-4.92,;-1.63,-5.68,;-1.63,-7.21,;-.3,-8,;1.04,-7.21,;1.04,-5.68,)|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1ccc2OCCOc2c1)c1ccccc1
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CCCCC1 |wD:14.15,(3.95,-1.59,;2.61,-.82,;2.61,.72,;3.95,1.49,;5.27,.69,;6.6,1.46,;6.6,3,;5.27,3.77,;3.95,3,;2.61,3.77,;1.29,1.49,;1.29,3.03,;-.04,.72,;-1.38,1.49,;-2.7,.69,;-2.7,-.85,;-4.04,1.46,;-5.37,.69,;-6.7,1.46,;-6.72,3,;-5.38,3.77,;-4.04,3,;-.04,-.82,;-1.38,-1.59,;1.29,-1.59,;1.29,-3.13,;-.04,-3.9,;-1.38,-3.13,;-2.7,-3.88,;-2.72,-5.42,;-1.39,-6.19,;-.04,-5.44,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccn1 |wD:14.15,(2.95,-1.61,;1.62,-.84,;1.62,.7,;2.95,1.47,;4.29,.69,;5.62,1.47,;5.62,3.01,;4.29,3.78,;2.95,3.01,;1.62,3.78,;.29,1.49,;.29,3.03,;-1.04,.7,;-2.38,1.47,;-3.71,.69,;-3.71,-.85,;-5.07,1.47,;-6.38,.69,;-7.73,1.45,;-7.73,3.01,;-6.4,3.78,;-5.07,3.01,;-1.04,-.84,;-2.38,-1.61,;.29,-1.6,;.29,-3.14,;1.62,-3.91,;1.62,-5.46,;2.95,-6.23,;4.29,-5.46,;4.29,-3.91,;2.95,-3.14,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](CC(C)C)N(C)C)c1=O |wU:26.32,(2.43,6.15,;3.76,5.38,;3.76,3.85,;5.11,3.07,;5.11,1.53,;3.76,.76,;2.43,1.54,;2.43,3.07,;1.1,3.85,;1.1,.77,;1.1,-.77,;2.43,-1.54,;-.23,-1.52,;-.23,-3.06,;1.1,-3.83,;2.43,-3.06,;1.08,-2.29,;3.76,-3.83,;3.76,-5.37,;2.43,-6.14,;1.1,-5.37,;-.25,-6.14,;-1.56,-.77,;-2.89,-1.54,;-1.56,.77,;-2.89,1.54,;-4.22,.76,;-5.57,1.53,;-5.57,3.07,;-6.9,3.85,;-4.22,3.85,;-4.22,-.78,;-5.55,-1.55,;-4.22,-2.31,;-.23,1.56,;-.23,3.1,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](N(C)C)c2ccccc2)c1=O |wU:26.28,(2.94,6.11,;4.27,5.36,;4.27,3.82,;5.61,3.03,;5.61,1.49,;4.27,.74,;2.95,1.51,;2.94,3.05,;1.59,3.8,;1.59,.74,;1.59,-.8,;2.95,-1.57,;.28,-1.57,;.28,-3.09,;1.59,-3.86,;2.94,-3.09,;1.59,-2.32,;4.28,-3.86,;4.28,-5.4,;2.94,-6.17,;1.59,-5.4,;.26,-6.17,;-1.04,-.8,;-2.38,-1.57,;-1.04,.74,;-2.38,1.51,;-3.71,.74,;-3.71,-.8,;-3.73,-2.34,;-5.04,-1.57,;-5.06,1.51,;-6.37,.72,;-7.72,1.49,;-7.72,3.03,;-6.39,3.8,;-5.06,3.05,;.28,1.51,;.28,3.05,)|
CC(C)Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:19.20,(-.27,-5.98,;-.27,-4.44,;-1.61,-3.67,;1.05,-3.67,;1.05,-2.13,;2.39,-1.36,;3.71,-2.13,;2.39,.18,;3.71,.95,;5.04,.16,;6.38,.93,;6.38,2.47,;5.04,3.24,;3.71,2.47,;2.39,3.24,;1.05,.95,;1.05,2.49,;-.27,.18,;-1.61,.95,;-2.94,.16,;-2.94,-1.38,;-4.29,.93,;-5.6,.16,;-6.95,.93,;-6.95,2.47,;-5.6,3.24,;-4.29,2.47,;-.27,-1.36,;-1.61,-2.13,)|
Cc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:23.25,(1.26,-6,;-.09,-5.25,;-1.4,-6.02,;-2.75,-5.25,;-2.75,-3.71,;-1.42,-2.94,;-.09,-3.72,;1.24,-2.95,;1.24,-1.41,;2.57,-.65,;3.92,-1.42,;2.57,.89,;3.92,1.67,;5.23,.88,;6.56,1.65,;6.56,3.19,;5.23,3.94,;3.9,3.19,;2.57,3.96,;1.24,1.67,;1.24,3.21,;-.09,.89,;-1.42,1.67,;-2.75,.88,;-2.75,-.66,;-4.08,1.65,;-5.41,.88,;-6.74,1.63,;-6.74,3.19,;-5.41,3.96,;-4.08,3.19,;-.09,-.65,;-1.42,-1.42,)|
Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F |r,wD:14.15,(-.33,-43.25,;-1.67,-42.48,;-1.67,-40.94,;-.33,-40.17,;1,-40.94,;2.33,-40.17,;2.33,-38.63,;.98,-37.86,;-.34,-38.63,;-1.68,-37.87,;-3,-40.16,;-3,-38.62,;-4.32,-40.94,;-5.66,-40.17,;-6.99,-40.95,;-6.99,-42.49,;-8.32,-40.18,;-8.33,-38.64,;-9.66,-37.87,;-10.99,-38.65,;-10.98,-40.2,;-9.65,-40.96,;-4.32,-42.48,;-5.66,-43.25,;-3,-43.24,;-3,-44.78,;-1.66,-45.55,;-1.67,-47.09,;-.34,-47.86,;1,-47.09,;.99,-45.54,;-.34,-44.78,;-1.68,-44.01,)|
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)ccc12
COc1ccc(cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1-c1ccccc1)[N+]([O-])=O
CCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)ccc12
COc1ccc(Cl)cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C
COc1ccc(cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1C(C)C)[N+]([O-])=O
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccccn3)c12
COc1ccc(cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccncc1)[N+]([O-])=O
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCN)c12
COc1ccc(cc1CSc1nc2cc(NC(=O)C3CCC3)ccc2n1C(C)C)[N+]([O-])=O
COc1ccc(cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1CCc1ccccc1)[N+]([O-])=O
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NC)c12
CC(C)n1c(SCc2cccc(C)c2)nc2cc(NC(=O)C3CC3)ccc12
COc1ccc(cc1CSc1nc2cc(NC(=O)NC(C)C)ccc2n1C(C)C)[N+]([O-])=O
COc1ccc(cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccccn1)[N+]([O-])=O
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)C)c12
CNC(=O)Nc1ccc2n(C(C)C)c(SCc3cc(ccc3OC)[N+]([O-])=O)nc2c1
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(O)=O)c12
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3ccccn3)c12
COc1ccc(cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1C1CC1)[N+]([O-])=O
COc1ccc(cc1CSc1nc2cc(NC(=O)NC3CC3)ccc2n1C(C)C)[N+]([O-])=O
COc1ccc(cc1CSc1nc2cc(NC(=O)CC(C)(C)C)ccc2n1C(C)C)[N+]([O-])=O
CCCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)ccc12
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3cccnc3)c12
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccccc3)c12
COc1ccccc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C
CCCCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)ccc12
COc1ccc(cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccccc1)[N+]([O-])=O
COc1ccc(cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C)[N+]([O-])=O
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)N(C)C)c12
COc1ccc(cc1CSc1nc2cc(NC(=O)C(C)C)ccc2n1C(C)C)[N+]([O-])=O
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NC(C)(C)C)c12
COc1ccc(cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C)C#N
CC(C)n1c(SCc2ccccc2C)nc2cc(NC(=O)C3CC3)ccc12
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)OC)c12
COC(=O)c1ccc(OC)c(CSc2nc3cc(NC(=O)C4CC4)ccc3n2C(C)C)c1
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3cccnc3)c12
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)Cc3ccccc3)c12
COCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)ccc12
COc1ccc(cc1CSc1nc2cc(NC(=O)OC(C)(C)C)ccc2n1C(C)C)[N+]([O-])=O
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)N3CCCC3)c12
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccncc3)c12
COc1ccc(cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C)C(C)=O
COc1ccc(cc1CSc1nc2cc(NC(=O)C(C)(C)C)ccc2n1C(C)C)[N+]([O-])=O
CC(C)n1c(SCc2ccccc2Cl)nc2cc(NC(=O)C3CC3)ccc12
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3ccncc3)c12
COc1ccc(cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1cccnc1)[N+]([O-])=O
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2S(=O)(=O)N2CCOCC2)c(=O)n(C[C@H](N)c2ccccc2)c1=O
COc1cccc(c1Cl)-c1cn(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
CS(=O)(=O)c1cccc(c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c1=O)C(F)(F)F
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2F)c(=O)n(C[C@@H](N)c2ccccc2)c1=O
COc1cccc(c1Cl)-c1cn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Cc1ccc(c(Cl)c1)-c1cn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2S(=O)(=O)C(C)C)c(=O)n(C[C@H](N)c2ccccc2)c1=O
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2SC)c(=O)n(C[C@H](N)c2ccccc2)c1=O
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(O)c1F)c1ccccc1
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2F)c1=O)-c1ccccc1Cl)c1ccccc1 |r|
CC(C)Oc1cccc(c1F)-c1cn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2S(=O)(=O)N(C)C)c(=O)n(C[C@H](N)c2ccccc2)c1=O
CS(=O)(=O)c1cccc(F)c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2S(C)(=O)=O)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@@H](N)c2ccccc2)c1=O
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCC(F)(F)F)c1F)c1ccccc1
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccccc1)c1ccccc1 |r|
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2F)c1=O)-c1cccc(O)c1F)c1ccccc1
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccccc1Cl)c1ccccc1 |r|
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccccc1F)c1ccccc1
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2S(=O)(=O)CCO)c(=O)n(C[C@H](N)c2ccccc2)c1=O
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccc(cc1Cl)C(F)(F)F)c1ccccc1
CCOc1cccc(c1F)-c1cn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccccc1C(F)(F)F)c1ccccc1
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)NC(=O)[C@@H](N)CC(N)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(O)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NCC(=O)n2cc(C)c(=O)[nH]c2=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)C(N)CN)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(O)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CCC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(O)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)NC(=O)[C@H](N)CC(N)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(O)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)C(N)CCN)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(O)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)C2CCNC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)C(N)CN)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(O)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)NC(=O)[C@H](N)CCC(N)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(O)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(Nc2nnc(N)[nH]2)cc1)NC(=O)[C@H](Cc1ccc(Nc2nnc(N)[nH]2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(O)=O
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2c(F)cccc2Br)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-3.31,-3.93,;-4.64,-3.16,;-4.64,-1.61,;-3.31,-.84,;-1.96,-1.61,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;4.72,-8.54,;6.04,-7.75,;7.12,-6.66,;7.37,-8.52,;7.38,-10.06,;6.05,-10.83,;4.71,-10.08,;3.38,-10.85,;4.71,-5.46,;6.05,-6.21,)|
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2ccccc2C#N)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-3.31,-3.93,;-4.64,-3.16,;-4.64,-1.61,;-3.31,-.84,;-1.96,-1.61,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;4.72,-8.54,;4.71,-10.08,;6.05,-10.83,;7.38,-10.06,;7.37,-8.52,;6.04,-7.75,;7.12,-6.66,;8.22,-5.56,;4.71,-5.46,;6.05,-6.21,)|
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2cccnc2Cl)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-1.96,-1.61,;-3.31,-.84,;-4.64,-1.61,;-4.64,-3.16,;-3.31,-3.93,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;4.72,-8.54,;4.71,-10.08,;6.05,-10.83,;7.38,-10.06,;7.37,-8.52,;6.04,-7.75,;7.12,-6.66,;4.71,-5.46,;6.05,-6.21,)|
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2c(F)cccc2F)c1=O |r,wD:14.15,(31.35,-22.11,;30.02,-22.89,;30.02,-24.43,;31.37,-25.2,;31.37,-26.74,;30.04,-27.51,;28.71,-26.74,;28.7,-25.2,;27.36,-24.44,;27.38,-27.51,;26.05,-26.73,;26.05,-25.19,;24.72,-27.51,;23.38,-26.74,;22.05,-27.52,;22.05,-29.06,;20.72,-26.76,;20.72,-25.21,;19.38,-24.45,;18.05,-25.22,;18.06,-26.77,;19.39,-27.53,;24.72,-29.05,;23.39,-29.82,;26.06,-29.82,;26.06,-31.36,;27.4,-32.12,;28.72,-31.34,;27.38,-30.57,;30.06,-32.1,;30.07,-33.65,;28.74,-34.42,;27.4,-33.66,;26.07,-34.43,;27.38,-29.05,;28.71,-29.82,)|
COc1cccc(c1)-n1c(=O)n(CCC(N)c2ccccc2Cl)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1F)-n1c(=O)n(CC(N)c2ccccc2F)c(=O)n(Cc2c(F)cccc2F)c1=O |(8.06,2.56,;6.73,1.79,;6.73,.25,;8.07,-.52,;8.07,-2.08,;6.73,-2.85,;5.4,-2.08,;5.4,-.54,;4.07,.23,;4.07,-2.85,;2.74,-2.08,;2.74,-.54,;1.4,-2.85,;.07,-2.08,;-1.28,-2.83,;-1.28,-4.37,;-2.61,-2.06,;-3.92,-2.85,;-5.25,-2.08,;-5.27,-.54,;-3.92,.23,;-2.59,-.54,;-1.25,.23,;1.4,-4.39,;.07,-5.16,;2.74,-5.16,;2.73,-6.7,;4.07,-7.47,;5.39,-6.7,;4.04,-5.93,;6.72,-7.45,;6.73,-9.01,;5.39,-9.78,;4.06,-9.01,;2.71,-9.76,;4.07,-4.39,;5.4,-5.16,)|
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2c(F)cccc2C(F)(F)F)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-1.96,-1.61,;-3.31,-.84,;-4.64,-1.61,;-4.64,-3.16,;-3.31,-3.93,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;4.72,-8.54,;6.04,-7.75,;7.12,-6.66,;7.37,-8.52,;7.38,-10.06,;6.05,-10.83,;4.71,-10.08,;3.38,-10.85,;2.04,-10.06,;3.37,-12.39,;2.29,-11.93,;4.71,-5.46,;6.05,-6.21,)|
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2ccccc2F)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-1.96,-1.61,;-3.31,-.84,;-4.64,-1.61,;-4.64,-3.16,;-3.31,-3.93,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;4.72,-8.54,;4.71,-10.08,;6.05,-10.83,;7.38,-10.06,;7.37,-8.52,;6.04,-7.75,;7.12,-6.66,;4.71,-5.46,;6.05,-6.21,)|
COc1cccc(c1)-n1c(=O)n(CC(N)c2ccccc2F)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2ccccc2OC(F)(F)F)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-1.96,-1.61,;-3.31,-.84,;-4.64,-1.61,;-4.64,-3.16,;-3.31,-3.93,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;4.72,-8.54,;4.71,-10.08,;6.05,-10.83,;7.38,-10.06,;7.37,-8.52,;6.04,-7.75,;7.12,-6.66,;8.62,-7.05,;9.69,-5.95,;9.03,-8.52,;10.16,-7.03,;4.71,-5.46,;6.05,-6.21,)|
COc1cccc(c1)-n1c(=O)n(CCC(N)c2ccccc2)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2ccccc2Cl)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-1.96,-1.61,;-3.31,-.84,;-4.64,-1.61,;-4.64,-3.16,;-3.31,-3.93,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;4.72,-8.54,;4.71,-10.08,;6.05,-10.83,;7.38,-10.06,;7.37,-8.52,;6.04,-7.75,;7.12,-6.66,;4.71,-5.46,;6.05,-6.21,)|
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2c(Cl)cccc2C#N)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-1.96,-1.61,;-3.31,-.84,;-4.64,-1.61,;-4.64,-3.16,;-3.31,-3.93,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;4.72,-8.54,;4.71,-10.08,;3.38,-10.85,;6.05,-10.83,;7.38,-10.06,;7.37,-8.52,;6.04,-7.75,;7.12,-6.66,;8.22,-5.56,;4.71,-5.46,;6.05,-6.21,)|
COc1cccc(c1)-n1c(=O)n(CCC(N)c2cccc(F)c2)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(C(C)c2c(F)cccc2F)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-1.96,-1.61,;-3.31,-.84,;-4.64,-1.61,;-4.64,-3.16,;-3.31,-3.93,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;2.05,-8.54,;4.72,-8.54,;6.04,-7.75,;7.12,-6.66,;7.37,-8.52,;7.38,-10.06,;6.05,-10.83,;4.71,-10.08,;3.38,-10.85,;4.71,-5.46,;6.05,-6.21,)|
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(CC2CCCCC2)c1=O |wD:14.15,(9.48,1.54,;8.14,.75,;8.14,-.8,;9.5,-1.57,;9.5,-3.11,;8.17,-3.88,;6.84,-3.11,;6.83,-1.57,;5.48,-.8,;5.5,-3.89,;4.16,-3.12,;4.16,-1.57,;2.83,-3.89,;1.48,-3.12,;.15,-3.89,;-.62,-5.22,;-1.18,-3.12,;-1.18,-1.57,;-2.53,-.8,;-3.86,-1.57,;-3.86,-3.12,;-2.53,-3.89,;2.83,-5.43,;1.5,-6.2,;4.17,-6.2,;4.17,-7.75,;2.84,-8.52,;2.84,-10.06,;1.5,-10.83,;.17,-10.05,;.17,-8.51,;1.5,-7.75,;5.5,-5.43,;6.84,-6.2,)|
COc1cccc(c1)-n1c(=O)n(CCC(N)c2ccc(F)cc2)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1)-n1c(=O)n(CCC(N)c2cccs2)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1)-n1c(=O)n(CCC(N)c2ccccc2C)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2c(Cl)cccc2Cl)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-3.31,-3.93,;-4.64,-3.16,;-4.64,-1.61,;-3.31,-.84,;-1.96,-1.61,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;4.72,-8.54,;6.04,-7.75,;7.12,-6.66,;7.37,-8.52,;7.38,-10.06,;6.05,-10.83,;4.71,-10.08,;3.38,-10.85,;4.71,-5.46,;6.05,-6.21,)|
COc1cccc(c1F)-n1c(=O)n(CC[C@H](N)c2ccccc2)c(=O)n(Cc2c(F)cccc2F)c1=O |wD:15.16,(10.27,2.14,;8.94,1.37,;8.94,-.17,;10.29,-.94,;10.29,-2.48,;8.94,-3.25,;7.61,-2.48,;7.61,-.94,;6.28,-.17,;6.28,-3.25,;4.95,-2.48,;4.95,-.94,;3.62,-3.25,;2.27,-4.02,;.94,-3.23,;-.39,-4,;-.41,-5.54,;-1.72,-3.2,;-3.05,-3.97,;-4.38,-3.2,;-4.36,-1.66,;-3.03,-.89,;-1.7,-1.66,;3.62,-4.79,;2.29,-5.56,;4.95,-5.56,;4.95,-7.1,;6.28,-7.87,;6.28,-9.41,;4.93,-10.18,;7.61,-10.18,;8.94,-9.41,;8.94,-7.87,;7.61,-7.1,;6.26,-6.33,;6.28,-4.79,;7.61,-5.56,)|
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2ccccc2C)c1=O |wD:14.15,(9.48,1.54,;8.14,.75,;8.14,-.8,;9.5,-1.57,;9.5,-3.11,;8.17,-3.88,;6.84,-3.11,;6.83,-1.57,;5.48,-.8,;5.5,-3.89,;4.16,-3.12,;4.16,-1.57,;2.83,-3.89,;1.48,-3.12,;.15,-3.89,;-.62,-5.22,;-1.18,-3.12,;-1.18,-1.57,;-2.53,-.8,;-3.86,-1.57,;-3.86,-3.12,;-2.53,-3.89,;2.83,-5.43,;1.5,-6.2,;4.17,-6.2,;4.17,-7.75,;5.5,-8.52,;5.5,-10.06,;6.84,-10.83,;8.17,-10.05,;8.17,-8.5,;6.84,-7.72,;7.93,-6.64,;5.5,-5.43,;6.84,-6.2,)|
COc1cccc(c1)-n1c(=O)n(CCC(N)c2cccnc2)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1)-n1c(=O)n(CCC(N)c2ccccc2F)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1F)-n1c(=O)n(CC[C@H](N)CC(C)C)c(=O)n(Cc2c(F)cccc2F)c1=O |wD:15.16,(10.27,2.14,;8.94,1.37,;8.94,-.17,;10.29,-.94,;10.29,-2.48,;8.94,-3.25,;7.61,-2.48,;7.61,-.94,;6.28,-.17,;6.28,-3.25,;4.95,-2.48,;4.95,-.94,;3.62,-3.25,;2.27,-4.02,;.94,-3.23,;-.39,-4,;-.41,-5.54,;-1.72,-3.2,;-3.06,-3.97,;-4.39,-3.18,;-3.07,-5.51,;3.62,-4.79,;2.29,-5.56,;4.95,-5.56,;4.95,-7.1,;6.28,-7.87,;6.28,-9.41,;4.93,-10.18,;7.61,-10.18,;8.94,-9.41,;8.94,-7.87,;7.61,-7.1,;6.26,-6.33,;6.28,-4.79,;7.61,-5.56,)|
COc1cccc(c1)-n1c(=O)n(CC(CN)c2ccccc2)c(=O)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2ccccc2OC)c1=O |wD:14.15,(8.86,1.49,;7.53,.72,;7.54,-.83,;8.88,-1.6,;8.88,-3.14,;7.55,-3.91,;6.22,-3.14,;6.22,-1.61,;4.88,-.85,;4.89,-3.92,;3.56,-3.15,;3.56,-1.61,;2.23,-3.92,;.89,-3.15,;-.44,-3.93,;-1.23,-5.26,;-1.79,-3.16,;-3.12,-3.93,;-4.45,-3.16,;-4.45,-1.61,;-3.12,-.84,;-1.79,-1.61,;2.23,-5.46,;.9,-6.23,;3.56,-6.23,;3.56,-7.78,;4.9,-8.55,;4.89,-10.09,;6.23,-10.84,;7.57,-10.07,;7.55,-8.53,;6.22,-7.76,;7.32,-6.66,;8.8,-7.05,;4.89,-5.46,;6.23,-6.22,)|
COc1cccc(c1F)-n1c(=O)n(CC(N)CC(C)C)c(=O)n(Cc2c(F)cccc2F)c1=O |(8.06,2.56,;6.73,1.79,;6.73,.25,;8.07,-.52,;8.07,-2.08,;6.73,-2.85,;5.4,-2.08,;5.4,-.54,;4.07,.23,;4.07,-2.85,;2.74,-2.08,;2.74,-.54,;1.4,-2.85,;.07,-2.08,;-1.28,-2.83,;-1.28,-4.37,;-2.61,-2.06,;-3.94,-2.83,;-5.27,-2.06,;-3.94,-4.37,;1.4,-4.39,;.07,-5.16,;2.74,-5.16,;2.73,-6.7,;4.07,-7.47,;4.06,-9.01,;2.71,-9.76,;5.39,-9.78,;6.73,-9.01,;6.72,-7.45,;5.39,-6.7,;4.04,-5.93,;4.07,-4.39,;5.4,-5.16,)|
COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2c(F)cccc2Cl)c1=O |wD:14.15,(8.68,1.49,;7.35,.72,;7.36,-.82,;8.7,-1.59,;8.7,-3.13,;7.37,-3.9,;6.04,-3.13,;6.03,-1.61,;4.7,-.85,;4.71,-3.92,;3.37,-3.15,;3.37,-1.61,;2.04,-3.92,;.71,-3.15,;-.62,-3.93,;-1.4,-5.26,;-1.96,-3.16,;-3.31,-3.93,;-4.64,-3.16,;-4.64,-1.61,;-3.31,-.84,;-1.96,-1.61,;2.04,-5.46,;.71,-6.23,;3.38,-6.23,;3.38,-7.77,;4.72,-8.54,;6.04,-7.75,;7.12,-6.66,;7.37,-8.52,;7.38,-10.06,;6.05,-10.83,;4.71,-10.08,;3.38,-10.85,;4.71,-5.46,;6.05,-6.21,)|
COc1c(C)cc(cc1C)-c1[nH]c2ccc(cc2c1[C@H](C)CNCCc1ccccc1)C(C)(C)C(=O)N(CC(C)C)CC(C)C
CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](N)CCC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(O)=O |wU:54.58,30.43,12.21,4.4,wD:44.54,24.27,64.67,78.83,(20.78,-2.99,;20.78,-4.53,;22.11,-5.3,;19.45,-5.3,;19.45,-6.85,;18.11,-7.62,;16.78,-6.85,;16.78,-5.31,;15.44,-7.63,;14.11,-6.85,;12.78,-7.62,;12.78,-9.17,;11.45,-6.86,;11.45,-5.31,;12.78,-4.54,;14.1,-5.31,;15.44,-4.54,;15.43,-3,;16.77,-2.23,;14.1,-2.23,;12.77,-3,;10.11,-7.63,;8.77,-6.86,;8.77,-5.31,;7.44,-7.63,;7.44,-9.17,;8.77,-9.94,;6.12,-6.86,;4.77,-7.63,;4.77,-9.17,;3.44,-6.86,;3.44,-5.32,;4.77,-4.55,;6.17,-5.17,;7.2,-4.03,;6.43,-2.7,;6.91,-1.24,;5.87,-.1,;4.37,-.41,;3.9,-1.88,;4.94,-3.02,;2.11,-7.64,;.77,-6.87,;.77,-5.32,;-.56,-7.64,;-.56,-9.18,;.78,-9.95,;2.18,-9.32,;3.22,-10.46,;2.44,-11.79,;.95,-11.47,;-1.89,-6.87,;-3.23,-7.64,;-3.23,-9.18,;-4.57,-6.87,;-5.9,-7.64,;-4.57,-5.33,;-3.24,-4.57,;-3.24,-3.02,;-4.57,-2.25,;-1.89,-2.25,;20.78,-7.61,;20.78,-9.15,;22.12,-6.84,;23.44,-7.61,;23.44,-9.14,;22.12,-9.92,;22.12,-11.46,;20.79,-12.23,;19.46,-11.46,;19.46,-9.92,;18.12,-12.23,;24.78,-6.84,;24.78,-5.3,;26.12,-7.6,;26.43,-9.25,;28.08,-9.48,;28.81,-7.98,;27.53,-7.1,;27.73,-5.57,;26.5,-4.64,;29.15,-4.98,;30.38,-5.91,;31.8,-5.32,;33.03,-6.25,;32,-3.79,)|
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](N)CCC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(O)=O |wU:60.65,36.50,20.28,8.17,4.4,84.90,wD:50.61,30.34,70.74,(19.39,.66,;19.39,-.89,;20.72,-1.65,;18.05,-1.65,;18.05,-3.2,;16.72,-3.97,;15.39,-3.2,;15.39,-1.66,;14.05,-3.97,;14.05,-5.51,;15.39,-6.28,;16.72,-5.5,;18.06,-6.27,;18.06,-7.81,;19.39,-8.58,;16.73,-8.58,;15.4,-7.82,;12.73,-3.2,;11.39,-3.97,;11.39,-5.51,;10.07,-3.21,;10.07,-1.66,;11.39,-.9,;12.8,-1.52,;13.82,-.37,;13.06,.96,;11.55,.64,;8.74,-3.98,;7.4,-3.21,;7.4,-1.67,;6.07,-3.98,;6.07,-5.52,;7.4,-6.29,;4.73,-3.21,;3.4,-3.98,;3.4,-5.52,;2.06,-3.21,;2.06,-1.67,;3.4,-.9,;4.8,-1.53,;5.84,-.38,;5.05,.95,;5.54,2.42,;4.5,3.56,;2.99,3.24,;2.53,1.77,;3.55,.63,;.73,-3.99,;-.59,-3.22,;-.59,-1.68,;-1.94,-3.99,;-1.94,-5.53,;-.59,-6.3,;.81,-5.67,;1.84,-6.81,;1.07,-8.14,;-.43,-7.83,;-3.26,-3.22,;-4.6,-3.99,;-4.6,-5.53,;-5.93,-3.22,;-7.26,-3.99,;-5.93,-1.69,;-4.59,-.92,;-4.59,.62,;-5.94,1.4,;-3.27,1.39,;19.39,-3.97,;19.39,-5.5,;20.72,-3.19,;22.05,-3.96,;22.05,-5.49,;23.39,-6.27,;23.39,-7.8,;24.73,-8.57,;24.73,-10.11,;23.39,-10.88,;26.06,-10.88,;23.39,-3.19,;24.72,-3.95,;23.39,-1.64,;22.11,-.56,;22.74,1,;24.41,.88,;24.53,-.67,;25.95,-1.26,;26.16,-2.79,;27.23,-.4,;28.61,-1.07,;29.88,-.21,;31.27,-.89,;29.78,1.32,)|
COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(CCC3(C)C)cc2C)o1
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(NC(=O)c2ccccc2)cc1)Cc1ccccc1
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(NC(=O)NCc2ccccc2)cc1)Cc1ccccc1
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(NC2=NCCN2)cc1)Cc1ccccc1 |t:38|
CC(C)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)SC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)S(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CS[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
CS[C@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)S(=O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)S(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CS[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)S(=O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)SC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)SC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(Nc2nnc(N)[nH]2)cc1)NC(=O)[C@H](Cc1ccc(Nc2nnc(N)[nH]2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)S(=O)(=O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)SC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](NC(C)=O)Sc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CS[C@@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(N)=O)S(C)=O
CC(C)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)S(=O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)S(=O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)S(=O)(=O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(N)=O)S(C)=O
C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)c1ccccc1
C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)C12CC3CC(CC(C3)C1)C2 |TLB:40:31:38:34.35.36,THB:40:35:38:31.32.39,29:31:38:34.35.36,39:31:34:38.37.36,39:37:34:40.31.32|
C[C@H](CNCc1ccc(cc1)-c1nnn[nH]1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
C[C@H](CNCCc1cnc2nn[nH]c2c1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)C1C(C)(C)C1(C)C
C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(C)=O
C[C@H](CNCCC1CCOCC1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1ccccc1C(F)(F)F
C[C@H](CNCCc1ccc(cc1)C(O)=O)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
C[C@H](CNCCc1cc2[nH]nnc2cc1F)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
C[C@H](CNCCc1ccc2nn[nH]c2c1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
C[C@H](CNCCOc1ccc(cc1)-c1nnn[nH]1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
COc1ccccc1CC(=O)N1CCc2[nH]c(c([C@H](C)CNCCc3ccncc3)c2C1)-c1cc(C)cc(C)c1
C[C@H](CNCCc1ccc2nc(C)[nH]c2c1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
C[C@H](CNCCc1ccc(nc1)-c1nnn[nH]1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
C[C@H](CNCCc1ccc(cc1)-c1nnn[nH]1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F |r|
C[C@H](CNCCc1ccc(=O)n(C)c1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1ccccc1Cl
C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1ccccc1F
C[C@H](CNCCc1ccncc1)c1c2CNCCc2[nH]c1-c1cc(C)cc(C)c1
CCn1c(=O)[nH]c2cc(CCNC[C@@H](C)c3c4CN(CCc4[nH]c3-c3cc(C)cc(C)c3)C(=O)Cc3c(F)cccc3C(F)(F)F)ccc2c1=O
C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1ccccc1C(F)(F)F
C[C@H](CNCCc1ccc2nccnc2c1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1ccccc1
C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)C1CCCC1
C[C@H](CN)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
CCSc1ccc(CN2CCc3c(C2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n3Cc2c(F)cccc2F)cc1
CC(C)CN1CCCC(Cn2c(=O)c3CN(Cc4ccc(C)cc4C)CCc3n(Cc3c(F)cccc3F)c2=O)C1 |w:8.8|
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3nc4ccccc4n3C)CCc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(Cc2c(F)cccc2C(F)(F)F)c1=O
Fc1cccc(F)c1Cn1c2CCN(Cc3ccc(Cl)cc3)Cc2c(=O)n(C[C@H]2CCCN2)c1=O
CCc1ccc(CN2CCc3c(C2)c(=O)n(CCN(C)C)c(=O)n3Cc2c(F)cccc2F)cc1
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(Cc2ccccc2)c1=O
COc1ccc(CN2CCc3c(C2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n3Cc2c(F)cccc2F)cc1
COc1cccc(c1)-n1c(=O)c2CCN(Cc3ccncc3)Cc2n(Cc2c(F)cccc2F)c1=O
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCN(Cc4ccccn4)C2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
CN(C)[C@@H](Cn1c(=O)c2CN(Cc3ccc(Cl)cc3)CCc2n(Cc2c(F)cccc2F)c1=O)c1ccccc1
COc1cccc(c1)-n1c(=O)c2CCN(Cc3ccc(C)cc3)Cc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(Cc2ccccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(CCc3c[nH]c4ccccc34)CCc2n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1)-n1c(=O)c2CCN(Cc3ccccc3)Cc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(cc3)C(F)(F)F)CCc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(cc3)-n3ccnc3)CCc2n(Cc2c(F)cccc2F)c1=O
CN1CCCC(Cn2c(=O)c3CN(Cc4ccc(C)cc4C)CCc3n(Cc3c(F)cccc3F)c2=O)C1 |w:5.5|
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(cc3)S(C)(=O)=O)CCc2n(Cc2c(F)cccc2F)c1=O
CN(CCn1c(=O)c2CN(Cc3ccc(C)cc3C)CCc2n(Cc2c(F)cccc2F)c1=O)Cc1ccccn1
Fc1cccc(F)c1Cn1c2CCN(Cc3ccc(Cl)cc3)Cc2c(=O)n(C[C@H]2CCCN2CCc2ccccn2)c1=O
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCCN2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccncc3)CCc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CNCCc2n(Cc2c(F)cccc2F)c1=O
Fc1cccc(F)c1Cn1c2CCN(Cc3ccc(Cl)cc3)Cc2c(=O)n(C[C@H]2CCCN2C2CCCC2)c1=O
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCCN2Cc2ccccn2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
COc1cccc(c1)-n1c(=O)c2CCN(Cc3ccc(cc3)-n3ccnc3)Cc2n(Cc2c(F)cccc2F)c1=O
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCN(Cc4ccccc4)C2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
COc1cccc(c1)-n1c(=O)c2CCN(Cc3ccccc3OC)Cc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccccc3)CCc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(C)cc3)CCc2n(Cc2c(F)cccc2F)c1=O
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCCN2Cc2ccccc2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCN(C2)C2CCCC2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
COc1cccc(c1)-n1c(=O)c2CCNCc2n(Cc2c(F)cccc2F)c1=O
CC(C)CN(C)CCn1c(=O)c2CN(Cc3ccc(C)cc3C)CCc2n(Cc2c(F)cccc2F)c1=O
Fc1cccc(F)c1Cn1c2CCN(Cc3ccc(Cl)cc3)Cc2c(=O)n(C[C@@H]2CCCCN2CCc2ccccn2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(C)c1=O
CN(CCc1ccccn1)CCn1c(=O)[nH]c2CCN(Cc3sc4ccccc4c3C)Cc2c1=O
CC(C)CN1CCCCC1Cn1c(=O)c2CN(Cc3ccc(C)cc3C)CCc2n(Cc2c(F)cccc2F)c1=O |w:9.10|
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(Cl)cc3C)CCc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(C)cc3C)CCc2n(Cc2c(F)cccc2F)c1=O
CCc1ccc(CN2CCc3c(C2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n3Cc2c(F)cccc2F)cc1
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCCN2C2CCCC2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
CN1CCCCC1Cn1c(=O)c2CN(Cc3ccc(C)cc3C)CCc2n(Cc2c(F)cccc2F)c1=O |w:6.7|
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3cccc(Cl)c3)CCc2n(Cc2c(F)cccc2F)c1=O
Fc1cccc(F)c1Cn1c2CCN(Cc3ccc(Cl)cc3)Cc2c(=O)n(C[C@H]2CCCCN2CCc2ccccn2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(CC2CCCCC2)c1=O
Fc1cccc(F)c1Cn1c2CCN(Cc3ccc(Cl)cc3)Cc2c(=O)n(C[C@@H]2CCCN(C[C@@H]3CCCN3Cc3ccccn3)C2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(Cl)cc3)CCc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccccc3C)CCc2n(Cc2c(F)cccc2F)c1=O
Fc1cccc(F)c1Cn1c2CCN(Cc3ccc(Cl)cc3)Cc2c(=O)n(C[C@H]2CCCN2Cc2ccccn2)c1=O
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCN(CCc4ccccn4)C2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
COc1cccc(c1)-n1c(=O)c2CCN(CCc3c[nH]c4ccccc34)Cc2n(Cc2c(F)cccc2F)c1=O
CN[C@@H](Cn1c(=O)c2CN(Cc3ccc(Cl)cc3)CCc2n(Cc2c(F)cccc2F)c1=O)c1ccccc1
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCNC2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(cc3)C(C)(C)C)CCc2n(Cc2c(F)cccc2F)c1=O
CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(Cl)c(Cl)c3)CCc2n(Cc2c(F)cccc2F)c1=O
CSc1ccc(CN2CCc3c(C2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n3Cc2c(F)cccc2F)cc1
Cc1cc(C)cc(c1)-c1[nH]c2sc(cc2c1CCN1CCN(CC1)C(=O)N1CCCC1)C(C)(C)C(=O)N1C2CCC1CC2 |THB:34:36:38.39:41.42|
COc1cccc(c1)-c1c(F)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNCc2ccccc2OC)c1=O |r,wU:25.27,(21.58,4.68,;20.25,3.91,;20.25,2.37,;21.59,1.59,;21.59,.05,;20.25,-.71,;18.92,.06,;18.92,1.6,;17.59,2.37,;17.59,-.7,;17.59,-2.24,;18.92,-3.01,;16.26,-3,;16.26,-4.54,;17.6,-5.31,;18.92,-4.54,;17.58,-3.77,;20.25,-5.31,;20.26,-6.85,;18.92,-7.62,;17.59,-6.85,;16.25,-7.62,;14.93,-2.24,;13.6,-3.01,;14.93,-.7,;13.6,.07,;13.59,1.61,;12.27,-.71,;10.93,.06,;10.93,1.6,;9.59,2.36,;8.27,1.59,;6.93,2.35,;6.92,3.9,;8.26,4.67,;9.59,3.91,;10.92,4.68,;12.26,3.91,;16.26,.08,;16.26,1.62,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)NCc2ccccn2)c1=O |r,wU:26.28,(4.78,5.66,;3.45,4.89,;3.45,3.35,;4.79,2.58,;4.79,1.04,;3.45,.27,;2.12,1.05,;2.12,2.58,;.79,3.35,;.79,.29,;.79,-1.25,;2.12,-2.02,;-.54,-2.01,;-.54,-3.55,;.8,-4.32,;2.12,-3.56,;.78,-2.78,;3.45,-4.32,;3.46,-5.87,;2.12,-6.64,;.79,-5.87,;-.55,-6.63,;-1.87,-1.25,;-3.2,-2.02,;-1.87,.29,;-3.2,1.05,;-4.53,.28,;-4.53,-1.26,;-5.87,1.05,;-7.2,.27,;-8.54,1.04,;-9.86,.26,;-11.19,1.02,;-11.21,2.57,;-9.87,3.34,;-8.53,2.58,;-.54,1.07,;-.54,2.61,)|
Cc1c(C2=CC=C(Cl)C2=C)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r,t:3,5|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r,wD:29.31,(2.33,6.39,;1,5.62,;1.01,4.08,;2.35,3.31,;2.35,1.77,;1.02,.99,;-.31,1.77,;-.32,3.3,;-1.66,4.06,;-1.64,1,;-1.64,-.54,;-.31,-1.32,;-2.97,-1.31,;-2.97,-2.85,;-1.64,-3.62,;-.32,-2.85,;-1.66,-2.08,;1.02,-3.61,;1.02,-5.16,;-.31,-5.93,;-1.65,-5.16,;-2.98,-5.92,;-4.32,-6.68,;-2.22,-7.26,;-3.74,-4.59,;-4.3,-.54,;-5.63,-1.32,;-4.3,1,;-5.64,1.76,;-6.97,.99,;-6.96,-.55,;-8.3,1.75,;-8.3,3.29,;-9.64,4.06,;-10.97,3.28,;-10.96,1.74,;-9.62,.98,;-2.97,1.77,;-2.97,3.31,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2S(C)(=O)=O)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r,wD:29.31,(31.4,-35.83,;30.07,-36.61,;30.08,-38.15,;31.42,-38.92,;31.42,-40.46,;30.09,-41.23,;28.76,-40.46,;28.75,-38.92,;27.41,-38.16,;27.43,-41.23,;27.43,-42.77,;28.76,-43.54,;26.1,-43.53,;26.1,-45.07,;27.43,-45.84,;28.76,-45.07,;27.42,-44.3,;30.09,-45.84,;30.09,-47.38,;28.76,-48.15,;27.43,-47.38,;26.09,-48.15,;24.75,-48.91,;26.85,-49.49,;25.33,-46.81,;24.77,-42.77,;23.44,-43.54,;24.77,-41.23,;23.44,-40.46,;22.1,-41.24,;22.11,-42.78,;20.77,-40.48,;20.77,-38.93,;19.44,-38.17,;18.1,-38.94,;18.11,-40.49,;19.45,-41.25,;26.1,-40.45,;26.1,-38.91,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2S(C)=O)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r,wD:28.30,(16.59,-35.83,;15.26,-36.6,;15.26,-38.14,;16.61,-38.91,;16.61,-40.45,;15.28,-41.22,;13.95,-40.45,;13.94,-38.92,;12.6,-38.16,;12.61,-41.22,;12.61,-42.76,;13.95,-43.53,;11.28,-43.52,;11.28,-45.06,;12.62,-45.83,;13.94,-45.07,;12.6,-44.29,;15.27,-45.83,;15.28,-47.38,;13.94,-48.15,;12.61,-47.38,;11.27,-48.14,;11.27,-49.68,;9.94,-47.37,;9.96,-42.76,;8.62,-43.53,;9.96,-41.22,;8.62,-40.46,;7.29,-41.23,;7.29,-42.77,;5.96,-40.47,;5.96,-38.93,;4.62,-38.16,;3.29,-38.93,;3.3,-40.48,;4.63,-41.24,;11.28,-40.44,;11.28,-38.9,)|
N[C@@H](Cn1c(=O)c(c2OCC(c3ccccc3F)n2c1=O)-c1ccccc1F)c1ccccc1 |r,wD:1.0,(7.85,.67,;7.85,2.21,;9.18,2.98,;10.52,2.22,;11.85,3,;11.85,4.54,;13.18,2.22,;13.18,.68,;14.31,-.34,;13.7,-1.74,;12.18,-1.58,;11.16,-2.72,;9.65,-2.4,;8.62,-3.55,;9.1,-5.01,;10.62,-5.33,;11.64,-4.18,;13.15,-4.49,;11.86,-.09,;10.52,.68,;9.19,-.1,;14.51,2.99,;15.84,2.22,;17.17,2.99,;17.17,4.53,;15.83,5.3,;14.5,4.52,;13.16,5.29,;6.52,2.97,;6.52,4.51,;5.18,5.28,;3.85,4.51,;3.86,2.96,;5.19,2.2,)|
N[C@@H](Cn1c(=O)c(c2SC[C@H](c3ccccc3)n2c1=O)-c1ccccc1F)c1ccccc1 |r,wD:1.0,10.10,(-6.59,-28.2,;-6.6,-26.66,;-5.26,-25.89,;-3.93,-26.65,;-2.6,-25.88,;-2.6,-24.34,;-1.27,-26.65,;-1.27,-28.19,;-.13,-29.21,;-.75,-30.61,;-2.27,-30.45,;-3.29,-31.59,;-4.8,-31.27,;-5.83,-32.42,;-5.35,-33.89,;-3.83,-34.2,;-2.81,-33.05,;-2.59,-28.96,;-3.93,-28.19,;-5.26,-28.97,;.06,-25.88,;1.39,-26.65,;2.73,-25.88,;2.72,-24.34,;1.38,-23.57,;.05,-24.35,;-1.29,-23.59,;-7.93,-25.9,;-7.93,-24.36,;-9.26,-23.59,;-10.6,-24.36,;-10.59,-25.91,;-9.25,-26.67,)|
COc1cccc(c1Cl)-c1c2SCC(c3ccccc3F)n2c(=O)n(C[C@H](N)c2ccccc2)c1=O |r,wD:26.29,(32.15,-7.13,;30.82,-7.9,;30.82,-9.44,;32.16,-10.21,;32.16,-11.75,;30.82,-12.52,;29.49,-11.74,;29.49,-10.21,;28.15,-9.44,;28.16,-12.51,;28.16,-14.05,;29.3,-15.08,;28.68,-16.48,;27.15,-16.32,;26.12,-17.46,;24.61,-17.14,;23.58,-18.29,;24.06,-19.75,;25.58,-20.07,;26.6,-18.92,;28.11,-19.24,;26.83,-14.82,;25.49,-14.05,;24.16,-14.82,;25.5,-12.51,;24.16,-11.74,;22.83,-12.52,;22.83,-14.06,;21.5,-11.75,;20.16,-12.52,;18.83,-11.75,;18.83,-10.2,;20.16,-9.43,;21.49,-10.2,;26.82,-11.73,;26.82,-10.19,)|
COc1cccc(c1F)-c1c2SCC(c3ccccc3F)n2c(=O)n(C[C@H](N)c2ccccc2)c1=O |r,wD:26.29,(16.83,-7.23,;15.49,-8.01,;15.5,-9.55,;16.84,-10.32,;16.83,-11.86,;15.5,-12.63,;14.17,-11.85,;14.17,-10.32,;12.83,-9.55,;12.84,-12.62,;12.84,-14.16,;13.98,-15.19,;13.36,-16.59,;11.83,-16.43,;10.8,-17.57,;9.29,-17.25,;8.26,-18.4,;8.74,-19.86,;10.26,-20.18,;11.28,-19.03,;12.78,-19.34,;11.51,-14.93,;10.17,-14.16,;8.84,-14.92,;10.18,-12.62,;8.84,-11.85,;7.51,-12.62,;7.51,-14.16,;6.17,-11.86,;4.84,-12.63,;3.5,-11.86,;3.51,-10.31,;4.83,-9.54,;6.17,-10.31,;11.5,-11.84,;11.5,-10.3,)|
N[C@@H](Cn1c(=O)c(c2SCC(c3ccccc3F)n2c1=O)-c1ccccc1F)c1ccccc1 |r,wD:1.0,(22.56,.15,;22.55,1.69,;23.89,2.46,;25.22,1.7,;26.55,2.47,;26.55,4.01,;27.88,1.7,;27.88,.16,;29.02,-.86,;28.4,-2.26,;26.88,-2.1,;25.86,-3.24,;24.35,-2.92,;23.32,-4.07,;23.8,-5.54,;25.32,-5.85,;26.34,-4.7,;27.85,-5.01,;26.56,-.61,;25.22,.16,;23.89,-.62,;29.21,2.47,;30.54,1.7,;31.88,2.47,;31.88,4.01,;30.53,4.78,;29.2,4,;27.86,4.76,;21.22,2.45,;21.22,3.99,;19.89,4.76,;18.55,3.98,;18.56,2.44,;19.9,1.68,)|
COc1cccc(c1)-n1c(=O)c(Cc2c(F)cccc2F)nn(C[C@H](N)c2ccccc2)c1=O |r|
COc1cccc(c1Cl)-c1nn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
COc1cccc(c1F)-c1nn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
N[C@@H](Cn1c(=O)c(Cc2c(F)cccc2F)nn(-c2ccccc2F)c1=O)c1ccccc1 |r|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(C)(N)c2ccccc2)c1=O |(17.15,-7.98,;15.83,-8.78,;15.86,-10.31,;17.22,-11.06,;17.24,-12.6,;15.92,-13.39,;14.58,-12.64,;14.55,-11.11,;13.2,-10.37,;13.26,-13.43,;13.29,-14.98,;14.63,-15.73,;11.96,-15.77,;11.98,-17.31,;13.32,-18.06,;14.64,-17.27,;13.28,-16.52,;15.98,-18.01,;16,-19.56,;14.68,-20.35,;13.34,-19.59,;12.01,-20.38,;10.62,-15.02,;9.3,-15.8,;10.6,-13.47,;9.26,-12.72,;7.94,-13.5,;8.74,-14.82,;7.15,-12.18,;6.62,-14.3,;6.64,-15.84,;5.32,-16.63,;3.97,-15.87,;3.95,-14.34,;5.26,-13.54,;11.92,-12.69,;11.89,-11.15,)|
CCSc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccccc1OC
CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(O)NC)c12
CCSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C
FC(F)(F)c1nc2c(cccc2[nH]1)N1CCN(CCOc2cccc3[nH]c(=S)[nH]c23)CC1
CCn1cc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c(=O)[nH]c1=O
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2ccnc(n2)S(C)(=O)=O)CC1
CCc1nc(C)c(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)[nH]1
CS(=O)(=O)c1cccc(F)c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c1=O |r|
OC(=O)CCCN[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2F)c1=O)-c1ccccc1Cl)c1ccccc1 |r|
OC(=O)CCCN[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccccc1Cl)c1ccccc1 |r|
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2S(C)(=O)=O)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c1=O |r|
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2F)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c1=O |r|
COc1cccc(c1F)-c1cn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c1=O |r|
COC(=O)CCCN[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccccc1Cl)c1ccccc1 |r|
COC(=O)CCCN[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OC)c1F)c1ccccc1 |r|
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccc(CNCCC(O)=O)cc1)c1ccccc1 |r|
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccc(CNCC(O)=O)cc1)c1ccccc1 |r|
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccc(CSCC(O)=O)cc1)c1ccccc1 |r|
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccc(COCC(O)=O)cc1)c1ccccc1 |r|
CCOC(=O)CNCc1ccc(cc1)-c1cn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
NCC(=O)OCc1ccc(cc1)-c1cn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccc(COC(=O)CO)cc1)c1ccccc1 |r|
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccc(COC(=O)C2CC2)cc1)c1ccccc1 |r|
NCc1ccc(cc1)-c1cn(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1ccc(CO)cc1)c1ccccc1 |r|
CCc1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(CCOc2cccc3nc([nH]c23)C(F)(F)F)CC1
FC(F)(F)C(F)(F)c1nc2c(cccc2[nH]1)N1CCN(CCOc2cccc3[nH]c(=S)[nH]c23)CC1
CCc1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(CCOc2cccc3[nH]c(=S)[nH]c23)CC1
Cc1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(CCOc2cccc3[nH]c(=S)[nH]c23)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(CCOc2cccc3nc([nH]c23)C(F)(F)F)CC1
CC(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(CCOc2cccc3nc([nH]c23)C(F)(F)F)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2cccc3[nH]c(=S)[nH]c23)CC1
FC(F)(F)c1nc2cccc(OCCN3CCN(CC3)c3cccc4[nH]c(nc34)C(F)(F)F)c2[nH]1
FC(F)(F)c1nc2c(cccc2[nH]1)N1CCN(CCCOc2cccc3[nH]c(=S)[nH]c23)CC1
FC(F)(F)c1nc2cccc(CN3CCN(CC3)c3cccc4nc([nH]c34)C(F)(F)F)c2[nH]1
FC(F)(F)c1nc2cccc(N3CCN(Cc4cccc5[nH]c(=S)[nH]c45)CC3)c2[nH]1
FC(F)(F)c1nc2c(cccc2[nH]1)N1CCN(CCOc2ccc3[nH]c(=S)[nH]c3c2)CC1
S=c1[nH]c2cccc(OCCN3CCN(CC3)c3cccc4[nH]c(nc34)-c3ccccc3)c2[nH]1
Cc1ccc(-c2nc3c(cccc3[nH]2)N2CCN(CCOc3cccc4[nH]c(=S)[nH]c34)CC2)c(C)c1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2c[nH]c(=O)[nH]c2=O)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2ccc3[nH]c(=O)c(=O)[nH]c3c2)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2cccc3[nH]c(=O)c(=O)[nH]c23)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2cccc3[nH]c(=O)[nH]c23)CC1
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCCCC(O)=O)c1F)c1ccccc1 |r|
CN(C)[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCCCC(O)=O)c1F)c1ccccc1 |r,wD:3.2,(-6.99,-28.14,;-5.66,-27.37,;-5.67,-28.91,;-5.66,-25.83,;-4.33,-25.06,;-2.99,-25.82,;-1.67,-25.04,;-1.67,-23.5,;-.34,-25.82,;-.34,-27.36,;1,-28.13,;-1.67,-28.12,;-1.67,-29.66,;-.96,-31.03,;.57,-31.01,;1.32,-29.67,;1.35,-32.33,;.6,-33.68,;-.95,-33.7,;-1.73,-32.37,;-3.27,-32.38,;-4.81,-32.38,;-3.26,-33.92,;-3.27,-30.84,;-2.99,-27.36,;-4.33,-28.13,;.99,-25.06,;2.32,-25.84,;3.66,-25.07,;3.67,-23.53,;2.32,-22.76,;2.32,-21.22,;3.66,-20.45,;3.66,-18.91,;4.99,-18.14,;4.99,-16.6,;6.32,-15.82,;7.66,-16.59,;6.32,-14.28,;.99,-23.53,;-.34,-22.76,;-7,-25.06,;-6.99,-23.53,;-8.33,-22.76,;-9.66,-23.53,;-9.65,-25.08,;-8.32,-25.84,)|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCCCC(O)=O)c1F)c1ccccc1 |r,wD:2.1,(29.55,-7.07,;30.88,-6.3,;30.88,-4.76,;32.21,-3.99,;33.55,-4.75,;34.87,-3.97,;34.87,-2.43,;36.2,-4.75,;36.2,-6.29,;37.54,-7.06,;34.87,-7.05,;34.87,-8.59,;34.09,-9.92,;34.92,-11.21,;36.46,-11.13,;34.23,-12.58,;32.68,-12.66,;31.85,-11.36,;32.55,-9.99,;31.72,-8.7,;30.9,-7.39,;30.42,-9.52,;33.02,-7.87,;33.55,-6.29,;32.21,-7.06,;37.53,-3.99,;38.86,-4.77,;40.2,-4,;40.21,-2.46,;38.86,-1.69,;38.86,-.15,;40.2,.62,;40.2,2.16,;41.53,2.93,;41.53,4.47,;42.86,5.25,;44.2,4.48,;42.86,6.79,;37.53,-2.46,;36.2,-1.69,;29.54,-3.99,;29.55,-2.46,;28.21,-1.69,;26.88,-2.46,;26.89,-4.01,;28.22,-4.77,)|
Cc1c(-c2cccc(OCCC(O)=O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r,wD:20.21,(1.09,-6.13,;-.24,-5.36,;-.24,-3.82,;1.09,-3.06,;2.42,-3.83,;3.75,-3.07,;3.76,-1.53,;2.42,-.75,;2.42,.79,;3.75,1.56,;3.75,3.1,;5.08,3.87,;6.42,3.1,;5.09,5.41,;1.09,-1.52,;-.25,-.75,;-1.57,-3.04,;-1.57,-1.5,;-2.9,-3.82,;-4.24,-3.05,;-5.57,-3.83,;-5.56,-5.37,;-6.9,-3.06,;-6.9,-1.52,;-8.24,-.76,;-9.57,-1.53,;-9.56,-3.08,;-8.22,-3.84,;-2.9,-5.36,;-4.23,-6.13,;-1.57,-6.12,;-1.57,-7.66,;-2.36,-8.99,;-1.52,-10.27,;.01,-10.19,;-2.22,-11.64,;-3.77,-11.72,;-4.6,-10.43,;-3.9,-9.06,;-4.73,-7.76,;-5.55,-6.46,;-6.03,-8.59,;-3.43,-6.94,)|
Cc1c(-c2cccc(OCCCC(O)=O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r,wD:21.22,(33.83,-41.56,;32.49,-40.79,;32.49,-39.25,;33.82,-38.48,;35.15,-39.26,;36.49,-38.5,;36.5,-36.96,;35.15,-36.18,;35.15,-34.64,;36.49,-33.87,;36.49,-32.33,;37.82,-31.56,;37.82,-30.02,;39.15,-29.25,;36.49,-29.25,;33.82,-36.95,;32.49,-36.18,;31.16,-38.47,;31.16,-36.93,;29.84,-39.25,;28.5,-38.48,;27.17,-39.25,;27.17,-40.79,;25.83,-38.49,;25.84,-36.95,;24.5,-36.18,;23.17,-36.96,;23.18,-38.51,;24.51,-39.27,;29.84,-40.79,;28.5,-41.56,;31.16,-41.55,;31.16,-43.09,;30.38,-44.42,;31.21,-45.7,;32.75,-45.62,;30.52,-47.07,;28.97,-47.15,;28.14,-45.86,;28.84,-44.49,;28.01,-43.19,;27.19,-41.89,;26.71,-44.02,;29.31,-42.36,)|
Cc1c(-c2cccc(OCCCCC(O)=O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r,wD:22.23,(32.43,-44.71,;31.09,-43.94,;31.09,-42.4,;32.42,-41.63,;33.75,-42.41,;35.09,-41.65,;35.1,-40.11,;33.75,-39.33,;33.75,-37.79,;35.09,-37.02,;35.09,-35.48,;36.42,-34.71,;36.42,-33.17,;37.75,-32.4,;39.09,-33.17,;37.75,-30.86,;32.42,-40.1,;31.09,-39.33,;29.76,-41.62,;29.76,-40.08,;28.44,-42.4,;27.1,-41.63,;25.77,-42.4,;25.77,-43.94,;24.43,-41.64,;24.44,-40.1,;23.1,-39.33,;21.77,-40.11,;21.78,-41.66,;23.11,-42.42,;28.44,-43.94,;27.1,-44.71,;29.76,-44.7,;29.76,-46.24,;28.98,-47.57,;29.81,-48.85,;31.35,-48.77,;29.12,-50.22,;27.57,-50.3,;26.74,-49.01,;27.44,-47.64,;26.61,-46.34,;25.79,-45.04,;25.31,-47.17,;27.91,-45.51,)|
Cc1c(-c2cccc(OCCCCCC(O)=O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r,wD:23.24,(33.36,-44.3,;32.03,-43.53,;32.03,-41.99,;33.36,-41.23,;34.69,-42.01,;36.02,-41.24,;36.03,-39.7,;34.69,-38.93,;34.69,-37.39,;36.02,-36.62,;36.02,-35.08,;37.35,-34.31,;37.35,-32.77,;38.68,-31.99,;38.68,-30.45,;40.02,-29.68,;37.35,-29.68,;33.36,-39.7,;32.02,-38.93,;30.7,-41.21,;30.7,-39.67,;29.37,-41.99,;28.03,-41.23,;26.7,-42,;26.71,-43.54,;25.37,-41.23,;25.37,-39.7,;24.03,-38.93,;22.7,-39.7,;22.71,-41.25,;24.05,-42.01,;29.37,-43.53,;28.04,-44.3,;30.7,-44.29,;30.7,-45.83,;29.91,-47.16,;30.75,-48.45,;32.28,-48.37,;30.05,-49.82,;28.5,-49.9,;27.67,-48.6,;28.37,-47.23,;27.54,-45.94,;26.72,-44.63,;26.24,-46.76,;28.84,-45.11,)|
Cc1c(-c2cccc(OCCCC(O)=O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(-c2cccc(OCCCCC(O)=O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(-c2cccc(OCCCCCC(O)=O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
N[C@@H](Cn1c(=O)c(cn(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCCCCC(O)=O)c1F)c1ccccc1 |r|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCNCC(O)=O)c1F)c1ccccc1 |r,wD:2.1,(12.22,-28.79,;13.55,-28.02,;13.55,-26.48,;14.88,-25.7,;16.22,-26.47,;17.55,-25.69,;17.55,-24.15,;18.87,-26.47,;18.87,-28.01,;20.21,-28.78,;17.55,-28.77,;17.55,-30.31,;16.76,-31.64,;17.59,-32.92,;19.13,-32.84,;16.9,-34.29,;15.35,-34.37,;14.52,-33.08,;15.22,-31.71,;14.39,-30.41,;13.57,-29.11,;13.09,-31.24,;15.69,-29.59,;16.22,-28.01,;14.88,-28.78,;20.2,-25.71,;21.54,-26.48,;22.87,-25.72,;22.88,-24.18,;21.54,-23.4,;21.53,-21.86,;22.87,-21.09,;22.87,-19.55,;24.2,-18.78,;24.2,-17.24,;25.53,-16.47,;26.87,-17.24,;25.54,-14.93,;20.21,-24.17,;18.87,-23.4,;12.21,-25.71,;12.22,-24.17,;10.88,-23.41,;9.55,-24.18,;9.56,-25.73,;10.89,-26.49,)|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCC(C)(C)CC(O)=O)c1F)c1ccccc1 |r,wD:2.1,(12.04,-31.6,;13.37,-30.82,;13.37,-29.28,;14.7,-28.51,;16.04,-29.28,;17.37,-28.5,;17.37,-26.96,;18.7,-29.28,;18.7,-30.82,;20.03,-31.59,;17.37,-31.58,;17.37,-33.12,;16.58,-34.45,;17.42,-35.73,;18.95,-35.65,;16.72,-37.1,;15.17,-37.18,;14.34,-35.88,;15.04,-34.52,;14.21,-33.22,;13.39,-31.92,;12.91,-34.05,;15.51,-32.39,;16.04,-30.82,;14.71,-31.59,;20.03,-28.51,;21.36,-29.29,;22.69,-28.53,;22.7,-26.98,;21.36,-26.21,;21.36,-24.67,;22.69,-23.9,;22.69,-22.36,;24.02,-21.59,;24.8,-22.92,;23.24,-20.26,;25.35,-20.81,;26.69,-21.56,;26.71,-23.1,;28.02,-20.78,;20.03,-26.98,;18.69,-26.21,;12.03,-28.52,;12.04,-26.98,;10.7,-26.21,;9.37,-26.99,;9.38,-28.54,;10.71,-29.29,)|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCCOCC(O)=O)c1F)c1ccccc1 |r,wD:2.1,(-8.75,-49.23,;-7.42,-48.46,;-7.42,-46.92,;-6.09,-46.14,;-4.75,-46.91,;-3.42,-46.13,;-3.42,-44.59,;-2.09,-46.91,;-2.09,-48.45,;-.76,-49.22,;-3.42,-49.21,;-3.42,-50.75,;-4.21,-52.08,;-3.37,-53.36,;-1.84,-53.28,;-4.07,-54.73,;-5.62,-54.81,;-6.45,-53.52,;-5.75,-52.15,;-6.58,-50.85,;-7.4,-49.55,;-7.88,-51.68,;-5.28,-50.03,;-4.75,-48.45,;-6.08,-49.22,;-.76,-46.15,;.57,-46.92,;1.9,-46.16,;1.91,-44.62,;.57,-43.84,;.57,-42.3,;1.9,-41.53,;1.9,-39.99,;3.23,-39.22,;3.23,-37.68,;4.56,-36.91,;5.9,-37.68,;5.9,-39.22,;7.23,-36.91,;-.76,-44.61,;-2.1,-43.84,;-8.76,-46.15,;-8.75,-44.61,;-10.09,-43.85,;-11.43,-44.62,;-11.42,-46.17,;-10.08,-46.93,)|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCOCC(O)=O)c1F)c1ccccc1 |r,wD:2.1,(11.14,-32.73,;12.47,-31.95,;12.47,-30.41,;13.8,-29.64,;15.14,-30.4,;16.46,-29.63,;16.46,-28.09,;17.79,-30.4,;17.79,-31.94,;19.13,-32.72,;16.46,-32.71,;16.46,-34.25,;15.68,-35.58,;16.51,-36.86,;18.05,-36.78,;15.82,-38.23,;14.27,-38.31,;13.44,-37.01,;14.14,-35.64,;13.31,-34.35,;12.49,-33.04,;12.01,-35.17,;14.61,-33.52,;15.14,-31.94,;13.8,-32.72,;19.12,-29.64,;20.45,-30.42,;21.79,-29.65,;21.8,-28.11,;20.45,-27.34,;20.45,-25.8,;21.79,-25.03,;21.79,-23.49,;23.12,-22.72,;23.12,-21.18,;24.45,-20.41,;25.79,-21.17,;24.45,-18.86,;19.12,-28.11,;17.79,-27.34,;11.13,-29.65,;11.14,-28.11,;9.8,-27.34,;8.47,-28.11,;8.48,-29.66,;9.81,-30.42,)|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCCN(C)CC(O)=O)c1F)c1ccccc1 |r,wD:2.1,(13.5,-50.05,;14.83,-49.28,;14.82,-47.74,;16.16,-46.97,;17.49,-47.73,;18.82,-46.95,;18.82,-45.41,;20.15,-47.73,;20.15,-49.27,;21.48,-50.04,;18.82,-50.03,;18.82,-51.57,;18.04,-52.9,;18.87,-54.19,;20.41,-54.11,;18.17,-55.56,;16.63,-55.64,;15.79,-54.34,;16.5,-52.97,;15.67,-51.68,;14.84,-50.37,;14.37,-52.5,;16.97,-50.85,;17.49,-49.27,;16.16,-50.04,;21.48,-46.97,;22.81,-47.75,;24.15,-46.98,;24.15,-45.44,;22.81,-44.67,;22.81,-43.13,;24.14,-42.36,;24.14,-40.82,;25.48,-40.05,;25.47,-38.51,;24.14,-37.74,;26.81,-37.73,;28.14,-38.5,;28.14,-40.05,;29.48,-37.74,;21.48,-45.44,;20.15,-44.67,;13.49,-46.97,;13.49,-45.44,;12.16,-44.67,;10.82,-45.44,;10.83,-46.99,;12.17,-47.75,)|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCCNCC(O)=O)c1F)c1ccccc1 |r,wD:2.1,(-8.75,-49.23,;-7.42,-48.46,;-7.42,-46.92,;-6.09,-46.14,;-4.75,-46.91,;-3.42,-46.13,;-3.42,-44.59,;-2.09,-46.91,;-2.09,-48.45,;-.76,-49.22,;-3.42,-49.21,;-3.42,-50.75,;-4.21,-52.08,;-3.37,-53.36,;-1.84,-53.28,;-4.07,-54.73,;-5.62,-54.81,;-6.45,-53.52,;-5.75,-52.15,;-6.58,-50.85,;-7.4,-49.55,;-7.88,-51.68,;-5.28,-50.03,;-4.75,-48.45,;-6.08,-49.22,;-.76,-46.15,;.57,-46.92,;1.9,-46.16,;1.91,-44.62,;.57,-43.84,;.57,-42.3,;1.9,-41.53,;1.9,-39.99,;3.23,-39.22,;3.23,-37.68,;4.56,-36.91,;5.9,-37.68,;5.9,-39.22,;7.23,-36.91,;-.76,-44.61,;-2.1,-43.84,;-8.76,-46.15,;-8.75,-44.61,;-10.09,-43.85,;-11.43,-44.62,;-11.42,-46.17,;-10.08,-46.93,)|
CN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OCCN(C)CC(O)=O)c1F)c1ccccc1 |r,wD:2.1,(32.28,-29.82,;33.61,-29.04,;33.61,-27.5,;34.94,-26.73,;36.28,-27.49,;37.6,-26.72,;37.6,-25.18,;38.93,-27.49,;38.93,-29.03,;40.27,-29.81,;37.6,-29.8,;37.6,-31.34,;36.82,-32.67,;37.65,-33.95,;39.19,-33.87,;36.96,-35.32,;35.41,-35.4,;34.58,-34.1,;35.28,-32.73,;34.45,-31.44,;33.63,-30.13,;33.15,-32.26,;35.75,-30.61,;36.28,-29.03,;34.94,-29.81,;40.26,-26.73,;41.59,-27.51,;42.93,-26.74,;42.94,-25.2,;41.59,-24.43,;41.59,-22.89,;42.93,-22.12,;42.93,-20.58,;44.26,-19.81,;45.59,-20.58,;44.26,-18.27,;45.59,-17.5,;46.93,-18.26,;45.59,-15.95,;40.26,-25.2,;38.93,-24.43,;32.27,-26.74,;32.28,-25.2,;30.94,-24.43,;29.61,-25.21,;29.62,-26.75,;30.95,-27.51,)|
Cc1c(-c2cccc(OCC(O)=O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r,wD:19.20,(20.6,-4.91,;19.26,-4.14,;19.26,-2.6,;20.59,-1.84,;21.92,-2.61,;23.26,-1.85,;23.27,-.31,;21.92,.47,;21.92,2.01,;23.26,2.78,;23.26,4.32,;24.59,5.1,;21.92,5.09,;20.59,-.3,;19.26,.47,;17.93,-1.82,;17.93,-.28,;16.61,-2.6,;15.27,-1.83,;13.94,-2.61,;13.94,-4.15,;12.6,-1.84,;12.61,-.3,;11.27,.46,;9.94,-.31,;9.95,-1.86,;11.28,-2.62,;16.61,-4.14,;15.27,-4.91,;17.93,-4.9,;17.93,-6.44,;17.15,-7.77,;17.98,-9.05,;19.52,-8.97,;17.29,-10.42,;15.74,-10.5,;14.91,-9.21,;15.61,-7.84,;14.78,-6.54,;13.96,-5.24,;13.48,-7.37,;16.08,-5.72,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N(C)CCCC(O)=O)c2ccccc2)c1=O |r,wD:29.31,(12.56,-11.76,;11.23,-12.52,;9.89,-11.75,;9.9,-10.21,;8.56,-9.43,;7.23,-10.2,;7.23,-11.74,;8.56,-12.51,;8.56,-14.05,;5.9,-12.5,;5.9,-14.04,;7.23,-14.81,;4.57,-14.81,;4.57,-16.35,;5.9,-17.11,;7.23,-16.35,;8.56,-15.56,;8.56,-17.11,;8.57,-18.66,;7.23,-19.43,;5.9,-18.66,;4.56,-19.43,;3.21,-20.18,;5.32,-20.77,;3.8,-18.09,;3.24,-14.04,;1.9,-14.81,;3.24,-12.5,;1.9,-11.73,;.57,-12.51,;.57,-14.05,;.97,-15.53,;-.76,-14.82,;-.75,-16.37,;-2.08,-17.14,;-2.08,-18.68,;-3.41,-19.46,;-.74,-19.45,;-.76,-11.74,;-.77,-10.2,;-2.11,-9.43,;-3.44,-10.22,;-3.43,-11.75,;-2.1,-12.51,;4.57,-11.72,;4.57,-10.18,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](NCCCCC(O)=O)c2ccccc2)c1=O |r,wD:29.31,(15.29,-11.17,;13.95,-11.93,;12.62,-11.16,;12.63,-9.62,;11.28,-8.84,;9.95,-9.61,;9.95,-11.15,;11.28,-11.92,;11.28,-13.46,;8.62,-11.91,;8.62,-13.45,;9.96,-14.22,;7.29,-14.21,;7.29,-15.75,;8.63,-16.52,;9.95,-15.75,;11.28,-14.97,;11.28,-16.51,;11.29,-18.06,;9.95,-18.83,;8.62,-18.06,;7.28,-18.83,;5.94,-19.58,;8.05,-20.17,;6.52,-17.49,;5.97,-13.45,;4.63,-14.22,;5.97,-11.91,;4.63,-11.14,;3.3,-11.92,;3.3,-13.46,;1.97,-14.23,;1.98,-15.77,;.64,-16.54,;.65,-18.08,;-.68,-18.86,;-2.02,-18.09,;-.68,-20.4,;1.96,-11.15,;1.96,-9.61,;.62,-8.84,;-.71,-9.63,;-.7,-11.16,;.63,-11.92,;7.29,-11.13,;7.29,-9.59,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2Cl)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c1=O |r,wD:26.28,(8.1,-10.47,;6.76,-11.23,;5.43,-10.46,;5.44,-8.92,;4.1,-8.14,;2.77,-8.91,;2.77,-10.45,;4.1,-11.22,;4.09,-12.76,;1.44,-11.21,;1.44,-12.75,;2.77,-13.52,;.11,-13.51,;.11,-15.05,;1.44,-15.82,;2.76,-15.05,;4.09,-14.27,;4.1,-15.81,;4.1,-17.36,;2.77,-18.13,;1.43,-17.36,;.1,-18.13,;-1.22,-12.75,;-2.55,-13.52,;-1.22,-11.21,;-2.56,-10.44,;-3.89,-11.22,;-3.88,-12.76,;-5.22,-13.53,;-5.21,-15.07,;-6.54,-15.84,;-6.54,-17.38,;-7.87,-18.16,;-5.2,-18.15,;-5.22,-10.45,;-5.23,-8.91,;-6.57,-8.14,;-7.9,-8.93,;-7.89,-10.46,;-6.56,-11.22,;.11,-10.43,;.11,-8.89,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](NCCCC([O-])=O)c2ccccc2)c1=O |r,wD:29.31,(30.28,-13.89,;28.95,-14.65,;27.62,-13.88,;27.62,-12.34,;26.28,-11.56,;24.95,-12.33,;24.95,-13.87,;26.28,-14.64,;26.27,-16.18,;23.62,-14.63,;23.62,-16.17,;24.95,-16.94,;22.29,-16.93,;22.29,-18.47,;23.62,-19.24,;24.95,-18.47,;26.27,-17.69,;26.28,-19.24,;26.28,-20.78,;24.95,-21.55,;23.62,-20.78,;22.28,-21.55,;20.94,-22.31,;23.04,-22.89,;21.52,-20.21,;20.96,-16.17,;19.63,-16.94,;20.96,-14.63,;19.63,-13.86,;18.29,-14.64,;18.3,-16.18,;16.97,-16.95,;16.97,-18.49,;15.64,-19.27,;15.64,-20.81,;14.31,-21.58,;16.98,-21.57,;16.96,-13.87,;16.95,-12.33,;15.62,-11.57,;14.28,-12.35,;14.29,-13.88,;15.63,-14.64,;22.29,-13.85,;22.29,-12.31,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c1=O |r,wD:26.28,(8.92,-11.98,;7.58,-12.75,;6.25,-11.97,;6.26,-10.43,;4.91,-9.66,;3.58,-10.43,;3.58,-11.96,;4.91,-12.74,;4.91,-14.28,;2.25,-12.72,;2.25,-14.26,;3.59,-15.04,;.92,-15.03,;.92,-16.57,;2.26,-17.34,;3.58,-16.57,;4.91,-15.79,;4.91,-17.33,;4.92,-18.88,;3.58,-19.65,;2.25,-18.88,;.91,-19.64,;-.4,-14.26,;-1.74,-15.04,;-.4,-12.72,;-1.74,-11.96,;-3.07,-12.73,;-3.07,-14.27,;-4.4,-15.05,;-4.39,-16.59,;-5.73,-17.36,;-5.72,-18.9,;-7.05,-19.67,;-4.38,-19.67,;-4.41,-11.97,;-4.41,-10.43,;-5.75,-9.66,;-7.08,-10.44,;-7.07,-11.98,;-5.74,-12.74,;.92,-11.95,;.92,-10.41,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](NCCC(O)=O)c2ccccc2)c1=O |r,wD:29.31,(16.08,-10.54,;14.74,-11.3,;13.41,-10.53,;13.42,-8.99,;12.08,-8.21,;10.75,-8.98,;10.75,-10.52,;12.08,-11.29,;12.07,-12.83,;9.42,-11.28,;9.42,-12.82,;10.75,-13.59,;8.09,-13.58,;8.09,-15.12,;9.42,-15.89,;10.74,-15.12,;12.07,-14.34,;12.08,-15.88,;12.08,-17.43,;10.75,-18.2,;9.41,-17.43,;8.08,-18.2,;6.74,-18.95,;8.84,-19.54,;7.32,-16.86,;6.76,-12.82,;5.43,-13.59,;6.76,-11.28,;5.42,-10.51,;4.09,-11.29,;4.1,-12.83,;2.76,-13.6,;2.77,-15.14,;1.44,-15.91,;.1,-15.15,;1.44,-17.46,;2.76,-10.52,;2.75,-8.98,;1.41,-8.21,;.08,-9,;.09,-10.53,;1.42,-11.29,;8.09,-10.5,;8.09,-8.96,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](NCC(O)=O)c2ccccc2)c1=O |r,wD:29.31,(15.42,-11.27,;14.08,-12.03,;12.75,-11.26,;12.76,-9.72,;11.42,-8.94,;10.09,-9.71,;10.09,-11.25,;11.42,-12.02,;11.41,-13.56,;8.76,-12.01,;8.76,-13.55,;10.09,-14.32,;7.43,-14.31,;7.43,-15.85,;8.76,-16.62,;10.08,-15.85,;11.41,-15.07,;11.42,-16.61,;11.42,-18.16,;10.08,-18.93,;8.75,-18.16,;7.42,-18.93,;6.07,-19.69,;8.18,-20.27,;6.66,-17.59,;6.1,-13.55,;4.77,-14.32,;6.1,-12.01,;4.76,-11.24,;3.43,-12.02,;3.43,-13.56,;2.1,-14.33,;2.11,-15.87,;.78,-16.65,;3.45,-16.64,;2.09,-11.25,;2.09,-9.71,;.75,-8.94,;-.58,-9.73,;-.57,-11.26,;.76,-12.02,;7.43,-11.23,;7.43,-9.69,)|
COC(=O)CCCN[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OC)c1F)c1ccccc1 |r,wD:8.7,(-4.95,-18.43,;-3.61,-19.19,;-2.28,-18.42,;-.95,-19.18,;-2.29,-16.88,;-.96,-16.1,;-.96,-14.56,;.37,-13.79,;.37,-12.25,;1.7,-11.48,;3.03,-12.24,;4.36,-11.46,;4.36,-9.92,;5.69,-12.24,;5.69,-13.78,;7.02,-14.55,;4.36,-14.54,;4.36,-16.08,;5.7,-16.85,;7.02,-16.09,;8.35,-15.31,;8.35,-16.85,;8.36,-18.4,;7.02,-19.17,;5.69,-18.4,;4.35,-19.16,;3.01,-19.92,;5.11,-20.5,;3.59,-17.82,;3.03,-13.78,;1.7,-14.55,;7.02,-11.48,;7.02,-9.95,;8.35,-9.18,;9.69,-9.95,;9.69,-11.49,;11.02,-12.27,;12.35,-11.5,;8.35,-12.26,;8.35,-13.8,;-.97,-11.48,;-.97,-9.95,;-2.31,-9.18,;-3.65,-9.96,;-3.64,-11.5,;-2.3,-12.25,)|
CCCn1c(CC)nc(C)c1CN1CCN(CC1)c1cccc2[nH]c(nc12)-c1ccc(cc1)C(C)(C)C
CCCn1c(CC)nc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c1C
CCc1nc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c(C)n1CC
CCc1nc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)cn1CC
CCCn1cc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)nc1C
CCn1cc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)nc1C
CCCCc1nc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)cn1C
CCc1nc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)cn1C
Cc1nc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)cn1C
CCCCn1cnc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c1C
CC(C)n1cnc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c1C
CCCn1cnc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c1C
CCn1cnc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c1C
CCc1cc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)nn1C
Cc1nn(C)c(C)c1CN1CCN(CC1)c1cccc2[nH]c(nc12)-c1ccc(cc1)C(C)(C)C
CCc1cc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)n(C)n1
Cc1cc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)n(C)n1
CCc1nc(C)c(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)s1
CCc1nc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c(C)o1
CCc1nc(C)c(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)o1
Cc1nc(C)c(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)o1
Cc1ncoc1CN1CCN(CC1)c1cccc2[nH]c(nc12)-c1ccc(cc1)C(C)(C)C
Cc1ncc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)[nH]1
Cn1cnc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2cnc[nH]2)CC1
Cc1cc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)nn1C
Cc1n[nH]c(C)c1CN1CCN(CC1)c1cccc2[nH]c(nc12)-c1ccc(cc1)C(C)(C)C
Cc1nc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c(C)s1
Cc1nc(C)c(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)s1
Cc1ccc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)o1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2cccc3nccnc23)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2ccc3cccnc3c2)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2ccc3ncccc3c2)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2ccc3nccnc3c2)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2ccc3NC(=O)CNc3c2)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2cnc3[nH]c(=O)c(=O)[nH]c3c2)CC1
CC(C)(C)c1ccc(cc1)-c1nc2c(cccc2[nH]1)N1CCN(Cc2ccc3[nH]c(=O)c(=O)n(Cc4cccnc4)c3c2)CC1
Cn1c2cc(CN3CCN(CC3)c3cccc4[nH]c(nc34)-c3ccc(cc3)C(C)(C)C)ccc2[nH]c(=O)c1=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)N(C)C(=O)c1ccc(Cl)cc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)C(N)=O
CCc1nc(C)c(CN2CCN(CC2)c2cncc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)[nH]1
CCc1nc(C)c(CN2CCN(CC2)c2cccn3cc(nc23)-c2ccc(cc2)C(C)(C)C)[nH]1
CCc1nc(C)c(CN2CCN(CC2)c2cccc3nc(cn23)-c2ccc(cc2)C(C)(C)C)[nH]1
CCc1nc(C)c(CN2CCN(CC2)c2cccc3nc(oc23)-c2ccc(cc2)C(C)(C)C)[nH]1
CCc1nc(C)c(CN2CCN(CC2)c2cccc3nc(sc23)-c2ccc(cc2)C(C)(C)C)[nH]1
CCn1cnc(CN2CCN(CC2)c2cccn3cc(nc23)-c2ccc(cc2)C(C)(C)C)c1C
CC(C)(C)c1ccc(cc1)-c1cn2cccc(N3CCN(Cc4c[nH]c(=O)[nH]c4=O)CC3)c2n1
CCn1cc(CN2CCN(CC2)c2cccn3cc(nc23)-c2ccc(cc2)C(C)(C)C)c(=O)[nH]c1=O
CC(C)(C)c1ccc(cc1)-c1cn2cccc(N3CCN(Cc4cnc5ccccc5n4)CC3)c2n1
CC(C)(C)c1ccc(cc1)-c1cn2cccc(N3CCN(Cc4ccc5nccnc5c4)CC3)c2n1
CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2[C@@H](C)COC2=O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)CC2CC2)[C@](C)(C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C)OC
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@H](NC)[C@H]3O)[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)cc1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(C)CC3CC3)[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)cc1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(CC3CC3)CC3CC3)[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(F)c(Cl)c1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(C)C3CCCC3)[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)cc1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(CC3CC3)C(C)CC)[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)cc1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(CC3CC3)CC3CC3)[C@@H](C)[C@H](OC(=O)N3[C@@H](C)COC3=O)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)c(Cl)c1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(C)CC3CC3)[C@@H](C)[C@H](OC(=O)N3[C@@H](C)COC3=O)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)cc1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(C)C3CCCC3)[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)c(Cl)c1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)cc1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(C)C3CCCCC3)[C@@H](C)[C@H](OC(=O)N3[C@@H](C)COC3=O)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)c(Cl)c1
[H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(C)C3CCCCC3)[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)cc1
[#6]-[#6]-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1cccc2ccccc12
Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(c(Cl)cc2[nH]c1=O)-c1ccncn1
Cc1cc(C)cc(c1)-c1cnc2cc(Cl)c(cc2c1OCC[C@H]1CCCCN1)C(=O)Nc1ccncn1 |r|
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)nc3)c(=O)c2c1CN(C)C
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)nn3)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)nc3)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)cc3)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(C)cn3)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(F)cn3)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
CCOCCn1c(=O)n(Cc2c(F)cccc2F)c2sc(c(CN(C)CCOC)c2c1=O)-c1ccc(NC(=O)NOC)cc1
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(CCOC)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)CCN(C)S(C)(=O)=O
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)CCN1CCCC1=O
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1cccc(CO)n1
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)CCc1ccccn1
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccn1
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(CC(C)(C)O)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
COCCN(C)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(CCO)c(=O)c12)-c1ccc(NC(=O)NOC)cc1
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)CCn1ccnn1
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1cccnc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(N)cc1
CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(c(CNC)c2c1=O)-c1ccc(OC)cc1
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@@H](Cc1ccc(CNC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)C2CNC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(CNC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(CNC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)CO
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CNC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(CNC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(CNC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NCC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(CNC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](CCCNC(N)=O)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)c2cc(=O)[nH]c(=O)[nH]2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(CNC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)CO
CC(C)C[C@H](NC(=O)[C@@H](CCC(=O)NC(Cc1ccc2ccccc2c1)C(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CNC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CCNC(NCCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(NCC)=NCC)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)=NCC |w:91.96,109.115|
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)C(NC(N)=O)NC(N)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)Cc2[nH]c(=O)[nH]c2O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(CNC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
[#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#6]-[#6]-[#6]-[#7]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@@H](-[#6]-c1cccnc1)-[#7]-[#6](=O)-[#6@@H](-[#6]-c1ccc(Cl)cc1)-[#7]-[#6](=O)-[#6@@H](-[#6]-c1ccc2ccccc2c1)-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@H](-[#6])-[#6](-[#7])=O |r|
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(CNC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)c2c[nH]c(=O)[nH]c2=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
COc1cccc(c1)-n1c(=O)n(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(N)cc1
COc1cccc(c1)-n1c(=O)n(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)C(C)C)cc1
COc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC)c3)c(=O)c2c1CN(C)Cc1ccccc1
CCC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC)c3)c(=O)c2c1CN(C)Cc1ccccc1
CC(C)NC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CC(C)ONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
COc1cccc(c1)-n1c(=O)n(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(cc1)[N+]([O-])=O
COc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3OC)c(=O)c2c1CN(C)Cc1ccccc1 |(1.97,-9.34,;2.75,-8.01,;4.28,-8.02,;5.05,-9.36,;6.58,-9.36,;7.35,-8.05,;6.6,-6.7,;5.06,-6.69,;8.89,-8.05,;9.8,-9.31,;11.27,-8.84,;12.58,-9.62,;12.58,-11.15,;11.8,-12.48,;12.56,-13.79,;14.09,-13.81,;11.78,-15.12,;10.22,-15.12,;9.48,-13.77,;10.25,-12.45,;9.5,-11.11,;13.92,-8.85,;14.86,-9.38,;13.93,-7.31,;15.26,-6.55,;15.26,-5.02,;16.61,-4.25,;17.94,-5.05,;17.92,-6.58,;16.58,-7.33,;16.57,-8.87,;17.89,-9.66,;12.6,-6.51,;12.6,-4.99,;11.27,-7.3,;9.8,-6.82,;9.34,-5.35,;7.84,-5.02,;6.79,-6.16,;7.37,-3.55,;8.4,-2.41,;7.94,-.96,;8.96,.18,;10.48,-.15,;10.95,-1.62,;9.91,-2.75,)|
COc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(C3CCCCC3)c(=O)c2c1CN(C)Cc1ccccc1
COc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(Cl)cc3)c(=O)c2c1CN(C)Cc1ccccc1
COc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3Cl)c(=O)c2c1CN(C)Cc1ccccc1 |(1.97,-9.34,;2.75,-8.01,;4.28,-8.02,;5.06,-6.69,;6.6,-6.7,;7.35,-8.05,;6.58,-9.36,;5.05,-9.36,;8.89,-8.05,;9.8,-9.31,;11.27,-8.84,;12.58,-9.62,;12.58,-11.15,;11.8,-12.48,;12.56,-13.79,;14.09,-13.81,;11.78,-15.12,;10.22,-15.12,;9.48,-13.77,;10.25,-12.45,;9.5,-11.11,;13.92,-8.85,;14.86,-9.38,;13.93,-7.31,;15.26,-6.55,;15.26,-5.02,;16.61,-4.25,;17.94,-5.05,;17.92,-6.58,;16.58,-7.33,;16.56,-8.87,;12.6,-6.51,;12.6,-4.99,;11.27,-7.3,;9.8,-6.82,;9.34,-5.35,;7.84,-5.02,;6.79,-6.16,;7.37,-3.55,;8.4,-2.41,;9.91,-2.75,;10.95,-1.62,;10.48,-.15,;8.96,.18,;7.94,-.96,)|
COc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(Cc3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CCONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CN(Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(NC(=O)NO)cc1)Cc1ccccc1
CCC(=O)N(C)c1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC)c3)c(=O)c2c1CN(C)Cc1ccccc1
COc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(Cl)c3)c(=O)c2c1CN(C)Cc1ccccc1
COc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)cc3)c(=O)c2c1CN(C)Cc1ccccc1
COc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
COc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(CC(C)C)c(=O)c2c1CN(C)Cc1ccccc1
CCc1ccc(CN[C@@H](C)Cn2c(=O)c(c(C)n(Cc3c(F)cccc3F)c2=O)-c2cccc(OC)c2F)o1 |wU:8.8,(-3.22,3.89,;-3.88,2.48,;-2.99,1.2,;-3.49,-.27,;-2.26,-1.2,;-.98,-.31,;.5,-.83,;.5,-2.39,;1.85,-3.16,;3.19,-2.38,;1.85,-4.72,;3.17,-5.48,;4.49,-4.7,;4.48,-3.17,;5.83,-5.46,;5.83,-7.01,;7.17,-7.77,;4.51,-7.77,;4.51,-9.3,;3.18,-10.08,;1.86,-9.3,;.76,-8.22,;.53,-10.08,;.53,-11.61,;1.87,-12.37,;3.19,-11.6,;4.28,-12.69,;3.17,-7.01,;1.85,-7.78,;7.15,-4.68,;8.48,-5.46,;9.8,-4.68,;9.77,-3.14,;8.44,-2.39,;8.43,-.83,;9.77,-.03,;7.13,-3.16,;6.01,-2.05,;-1.43,1.17,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O |(7.94,4.31,;6.59,3.52,;6.62,1.96,;7.97,1.2,;7.98,-.34,;6.64,-1.12,;5.31,-.36,;5.29,1.18,;4.18,2.29,;3.99,-1.15,;3.99,-2.69,;5.34,-3.44,;2.66,-3.46,;2.68,-5,;1.33,-5.78,;1.35,-7.31,;2.42,-8.39,;.03,-8.09,;-1.32,-7.32,;-1.33,-5.78,;.01,-5.01,;-1.11,-3.89,;1.33,-2.7,;,-3.47,;1.33,-1.16,;,-.39,;-1.34,-1.17,;-2.67,-.4,;-2.68,1.14,;-4,-1.18,;-5.35,-.41,;-6.67,-1.19,;-8.01,-.41,;-9.33,-1.19,;-9.33,-2.73,;-8.01,-3.51,;-6.67,-2.73,;2.65,-.38,;2.64,1.16,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)NCc2nccs2)c1=O |wD:26.28,(4.83,2.23,;3.49,1.44,;3.5,-.13,;4.84,-.88,;4.86,-2.42,;3.54,-3.2,;2.2,-2.44,;2.19,-.91,;1.07,.21,;.88,-3.22,;.88,-4.77,;2.23,-5.52,;-.44,-5.54,;-.44,-7.08,;-1.78,-7.86,;-3.1,-7.08,;-4.21,-5.97,;-4.44,-7.86,;-4.44,-9.4,;-3.09,-10.16,;-1.77,-9.38,;-.68,-10.47,;-1.79,-4.78,;-3.12,-5.55,;-1.79,-3.24,;-3.12,-2.47,;-3.12,-.91,;-1.77,-.13,;-4.47,-.13,;-4.47,1.44,;-5.96,1.94,;-7.24,1.06,;-8.47,2,;-7.97,3.47,;-6.41,3.45,;-.47,-2.46,;-.47,-.92,)|
COc1cc(cc(OC)c1OC)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)NCc2sccc2C)c1=O |wU:26.28,(9.6,-.48,;8.26,-1.28,;8.28,-2.84,;9.61,-3.59,;9.63,-5.13,;8.31,-5.91,;6.98,-5.14,;6.96,-3.6,;5.84,-2.49,;5.65,-5.92,;5.66,-7.46,;7,-8.23,;4.34,-8.24,;4.34,-9.77,;3,-10.56,;1.68,-9.77,;.58,-8.68,;.34,-10.56,;.34,-12.09,;1.69,-12.85,;3.01,-12.07,;4.1,-13.16,;2.99,-7.48,;1.66,-8.24,;2.99,-5.94,;1.66,-5.16,;1.66,-3.6,;3.01,-2.82,;.31,-2.84,;.31,-1.28,;-1.17,-.76,;-1.62,.73,;-3.18,.77,;-3.69,-.71,;-2.45,-1.64,;-2.45,-3.2,;4.31,-5.16,;4.3,-3.63,)|
CSc1ccc(cc1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(C)NC2CCC2)c1=O |(-.51,5.44,;.83,4.67,;.83,3.13,;-.51,2.35,;-.51,.8,;.83,.04,;2.16,.81,;2.16,2.35,;3.51,3.13,;3.49,.04,;3.49,-1.52,;2.16,-2.29,;4.84,-2.29,;4.85,-3.83,;6.18,-4.61,;6.18,-6.15,;4.85,-6.92,;7.51,-6.91,;8.85,-6.13,;8.85,-4.59,;7.51,-3.82,;8.93,-3.02,;6.17,-1.5,;7.51,-2.28,;6.16,.04,;7.49,.82,;8.84,.05,;10.17,.83,;10.11,-1.22,;11.44,-.43,;12.21,-1.76,;13.55,-.99,;12.77,.35,;4.82,.81,;4.82,2.35,)|
COCc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1ccccc1F |(-2.68,1.14,;-2.67,-.4,;-4,-1.18,;-5.35,-.41,;-6.67,-1.19,;-8.01,-.41,;-9.33,-1.19,;-9.33,-2.73,;-8.01,-3.51,;-6.67,-2.73,;-1.34,-1.17,;,-.39,;1.33,-1.16,;2.65,-.38,;2.64,1.16,;3.99,-1.15,;3.99,-2.69,;5.34,-3.44,;2.66,-3.46,;2.68,-5,;1.33,-5.78,;.01,-5.01,;-1.11,-3.89,;-1.33,-5.78,;-1.32,-7.32,;.03,-8.09,;1.35,-7.31,;2.42,-8.39,;1.33,-2.7,;,-3.47,;5.31,-.36,;6.64,-1.12,;7.98,-.34,;7.97,1.2,;6.62,1.96,;5.29,1.18,;4.18,2.29,)|
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1ccc(C=C)cc1
CC(C)c1cccc(c1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1ccc(C)cc1
CCC(CC)N[C@@H](C)Cn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1cccc(OC)c1F |wU:6.6,(3.77,-1.23,;5.13,-.45,;6.48,-1.23,;7.83,-.43,;9.18,-1.22,;6.48,-2.8,;7.83,-3.56,;9.18,-2.78,;7.83,-5.13,;9.17,-5.91,;10.49,-5.13,;10.48,-3.59,;11.83,-5.88,;11.83,-7.42,;13.18,-8.18,;10.5,-8.2,;10.5,-9.74,;9.18,-10.53,;9.19,-12.04,;10.27,-13.13,;7.87,-12.82,;6.51,-12.07,;6.51,-10.53,;7.85,-9.74,;6.74,-8.65,;9.17,-7.45,;7.84,-8.2,;13.16,-5.1,;14.48,-5.88,;15.81,-5.09,;15.8,-3.55,;14.46,-2.8,;14.44,-1.23,;15.79,-.43,;13.13,-3.56,;11.78,-2.78,)|
COCc1ccc(cc1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1ccc2ccccc2c1
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n([C@H](C)CNCc2ccccc2C)c1=O |wD:25.27,(8.37,1.48,;7.04,.68,;7.05,-.88,;8.38,-1.64,;8.41,-3.17,;7.08,-3.95,;5.76,-3.17,;5.74,-1.65,;4.37,-.87,;4.43,-3.95,;4.44,-5.5,;5.78,-6.26,;3.12,-6.26,;3.12,-7.79,;1.79,-8.57,;.47,-7.79,;-.63,-6.71,;-.86,-8.57,;-.86,-10.1,;.48,-10.86,;1.8,-10.1,;2.89,-11.18,;1.78,-5.5,;.46,-6.27,;1.78,-3.97,;.46,-3.21,;-.89,-3.99,;.46,-1.65,;-.9,-.88,;-.9,.68,;.46,1.46,;1.79,.68,;3.14,1.45,;3.14,3.01,;1.78,3.79,;.43,3.01,;-.91,3.79,;3.1,-3.19,;3.09,-1.66,)|
CN(CCc1ccccn1)CCn1c(=O)c(-c2ccc3OC(F)(F)Oc3c2)c(C)n(Cc2c(F)cccc2F)c1=O
COc1ccc(cc1OC)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1cccc(F)c1
CC(C)c1ccc(cc1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
CCOc1ccc(cc1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CCN(C)CCc2ccccn2)c1=O
CN(CCc1ccccn1)CCn1c(=O)c(c(C)n(Cc2c(F)cccc2F)c1=O)-c1cccc(Cl)c1
CN(CCc1ccccn1)CCn1c(=O)c(-c2ccc3oc4ccccc4c3c2)c(C)n(Cc2c(F)cccc2F)c1=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CN(C)CCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCNC(C1CCCCC1)C(O)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCN(c1ccccn1)c1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC1CCCCC1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CNCc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](CC(=O)N(C)C)NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCNc1ncc[nH]1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CNc1ccc2ccccc2n1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CN(Cc1ccccn1)Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)N(C)C(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N(C)[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)C(NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C#C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](N(C)C(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCNC(=O)[C@H]1CC(=O)NC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCNCc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)NCCCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CNCCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CNC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCNc1ccc2ccccc2n1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](C(=O)NC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CNc1ncc[nH]1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CNC(C1CCCCC1)C(O)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CC(=O)NC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCOCCOCCNC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CONC(=O)NCC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CONC(=O)NCC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(=O)NO)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NCCOCCOCC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CONC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NOC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CONC(=O)NCCOCCOCCOCCOCCOCCOCCC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)NOC)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CCOCCOCCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CONC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CONC(=O)NC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NCCOCCOCC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NCCOCCOCC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](CNC(=O)NO)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NCCOCCOCC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CONC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)NOC)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=O)CNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](CCNC(=O)NO)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCOCCOCCNC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)NCCOCCOCC)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)NO)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CONC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CONC(=O)NCCOCCOCCOCCC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CONC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)NOC)cc2)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CONC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)NOC)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1
CCC(O)C(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)cc(C(=O)C(C)C)c(=O)c2c1CN(C)Cc1ccccc1
CCOC(=O)c1cn(Cc2ccccc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)Nc2ccccc2)cc1
CCOC(=O)c1cn(Cc2ccccc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CC(C)C(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)cc(C(=O)c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
CNC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)cc(C(=O)C(C)C)c(=O)c2c1CN(C)Cc1ccccc1
CCOC(=O)c1cn(Cc2ccccc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccccc1OC
CCOC(=O)c1cn(Cc2ccccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CC(C)C(=O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)CO)cc1
CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(N)=O |wU:12.21,44.54,wD:30.43,4.4,54.57,63.67,24.27,77.83,(.86,.61,;2.37,.33,;2.89,-1.12,;3.37,1.5,;4.88,1.23,;5.88,2.4,;5.36,3.85,;3.85,4.13,;6.36,5.02,;5.85,6.47,;6.84,7.66,;8.36,7.37,;6.33,9.1,;7.32,10.28,;8.84,10,;9.35,8.55,;10.86,8.27,;11.86,9.45,;13.38,9.16,;11.34,10.9,;9.83,11.17,;4.81,9.39,;4.3,10.83,;5.29,12,;2.78,11.11,;1.78,9.93,;.27,10.22,;2.26,12.57,;.75,12.83,;-.25,11.67,;.23,14.29,;-1.28,14.58,;-2.28,13.4,;-3.82,13.5,;-4.4,12.09,;-5.85,11.56,;-6.12,10.06,;-4.94,9.06,;-3.5,9.58,;-3.23,11.09,;-1.92,11.9,;1.23,15.47,;.71,16.91,;-.8,17.19,;1.71,18.09,;3.23,17.81,;4.22,18.98,;3.86,20.47,;5.17,21.28,;6.35,20.29,;5.76,18.87,;1.2,19.53,;-.32,19.81,;-1.32,18.64,;-.84,21.27,;-2.31,21.71,;-2.36,23.25,;-.91,23.76,;-.47,25.24,;.03,22.54,;5.4,-.22,;4.4,-1.4,;6.91,-.5,;7.43,-1.95,;6.43,-3.13,;6.95,-4.58,;5.95,-5.75,;6.47,-7.2,;5.47,-8.37,;5.99,-9.82,;3.96,-8.1,;8.95,-2.23,;9.94,-1.06,;9.46,-3.68,;8.6,-4.96,;9.54,-6.18,;10.99,-5.66,;10.95,-4.12,;12.17,-3.18,;13.59,-3.77,;11.96,-1.66,)|
CCOC(=O)c1cn(Cc2ccccc2C#N)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccc(OC)cc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CC(C)C(=O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)CN)cc1
CCOC(=O)c1cn(Cc2ccccc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)CC)cc1
CCC(=O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)C(C)C)cc1
CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(c(CNCc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)NC)cc1
CCOC(=O)c1cn(Cc2ccccc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1cccc(OC)c1
CCOC(=O)c1cn(Cc2ccccc2[N+]([O-])=O)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2cccc(OC)c2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CC(C)C(=O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)C(C)(C)O)cc1
CCOC(=O)c1cn(C)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2cccc(F)c2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(c(CN(C)C)c2c1=O)-c1ccc(OC)cc1
CC(C)C(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)cc(C(=O)C(C)C)c(=O)c2c1CN(C)Cc1ccccc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)C(C)C)cc1
CCOC(=O)c1cn(Cc2ccccc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(N)cc1
CCOC(=O)c1cn(Cc2ccccc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(cc1)N(C)C(=O)NC
CCOC(=O)c1cn(Cc2ccccc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(C)=O)cc1
CCOC(=O)c1cn(Cc2ccc(F)cc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)NC)cc1
CCOC(=O)c1cnc2sc(c(CN(C)Cc3ccccc3)c2c1O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)CC)cc1
CCOC(=O)c1cn(Cc2ccccc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)c2ccccc2)cc1
CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(c(CN(CC)Cc3ccccc3)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(c(C)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccccc1
CCC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)cc(C(=O)NC(C)C)c(=O)c2c1CN(C)Cc1ccccc1
CC(C)C(O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)C(C)C)cc1
CCOC(=O)c1cn(Cc2ccccc2)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)C(C)C)cc1
CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(c(CN(Cc3ccccc3)C(C)=O)c2c1=O)-c1ccc(OC)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2cc(c(CN(C)Cc3ccccc3)cc2c1=O)-c1ccc(NC(=O)CC)cc1
CC(CNCCCCc1ccnnc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CC2)-c1cc(C)cc(C)c1 |w:1.0,THB:26:28:30.31:33.34|
CNCCNc1nc(OC)c(NC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)OC4(C)C)o2)c(OC)n1
COc1ccc(CN2CC3CC(N4C(=O)N(CCN5CCOCC5)C(=O)C34C2)c2ccc(N(C)C)c3ccccc23)cc1NC(C)=O |w:9.9,11.31,26.29|
CC(CCN1CCc2c(C1)c(=O)n(CCN1CCCCC1)c(=O)n2Cc1c(F)cccc1F)CC(C)(C)C |w:1.0|
NC(CC1CCCCC1)Cn1c(=O)c2CN(Cc3ccc(Cl)cc3)CCc2n(Cc2c(F)cccc2F)c1=O |w:1.0|
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCNCC2)c(=O)n3Cc2c(F)cccc2F)c(C)c1
CNC(Cn1c(=O)c2CN(Cc3ccc(C)cc3C)CCc2n(Cc2c(F)cccc2F)c1=O)c1ccccc1 |w:2.1|
Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2NCCc4ccccc24)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
CC(C)CN(C)CCn1c(=O)c2CN(Cc3ccc(OC(F)(F)F)cc3)CCc2n(Cc2c(F)cccc2F)c1=O
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N1CCC(CC1)C(=O)NCC#Cc1ccc(cc1)C#CCNC(=O)C1CCN(CC1)C(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N1CCC[C@H]1C(=O)NCC#Cc1ccc(cc1)C#CCNC(=O)[C@@H]1CCCN1C(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCCCCCC(=O)NCC#Cc1ccc(cc1)C#CCNC(=O)CCCCCNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N[C@@H](C(C)C)C(=O)NCC#Cc1ccc(cc1)C#CCNC(=O)[C@@H](NC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)C(C)C)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc1ccc(cc1)C#CCNC(=O)[C@H](C)NC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N1CCC(CC1)C(=O)NCC#Cc1cccc(c1)C#CCNC(=O)C1CCN(CC1)C(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N1CCC[C@H]1C(=O)NCC#Cc1cccc(c1)C#CCNC(=O)[C@@H]1CCCN1C(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCCCC(=O)NCC#Cc1cccc(c1)C#CCNC(=O)CCCNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N[C@@H](C(C)C)C(=O)NCC#Cc1cccc(c1)C#CCNC(=O)[C@@H](NC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)C(C)C)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc1cccc(c1)C#CCNC(=O)[C@H](C)NC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)ccc(=O)n2c1CN(CC(=O)NCC(=O)N1CCC(CC1)C(=O)NCC#Cc1ccccc1C#CCNC(=O)C1CCN(CC1)C(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)ccc(=O)n2c1CN(CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NCC#Cc1ccccc1C#CCNC(=O)[C@@H]1CCCN1C(=O)CNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)ccc(=O)n2c1CN(CC(=O)NCCCC(=O)NCC#Cc1ccccc1C#CCNC(=O)CCCNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)ccc(=O)n2c1CN(CC(=O)N[C@@H](C(C)C)C(=O)NCC#Cc1ccccc1C#CCNC(=O)[C@@H](NC(=O)CNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)C(C)C)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)ccc(=O)n2c1CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc1ccccc1C#CCNC(=O)[C@H](C)NC(=O)CNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N1CCC(CC1)C(=O)NCC#Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N1CCC[C@H]1C(=O)NCC#Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCCCC(=O)NCC#Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N[C@@H](C(C)C)C(=O)NCC#Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCC(=O)NCC#Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCCCCCC(=O)NCC#Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCCCC(=O)NCC#Cc1ccc(cc1)C#CCNC(=O)CCCNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCC(=O)NCC#Cc1ccc(cc1)C#CCNC(=O)CNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCCCCCC(=O)NCC#Cc1cccc(c1)C#CCNC(=O)CCCCCNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCC(=O)NCC#Cc1cccc(c1)C#CCNC(=O)CNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)ccc(=O)n2c1CN(CC(=O)NCCCCCC(=O)NCC#Cc1ccccc1C#CCNC(=O)CCCCCNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)ccc(=O)n2c1CN(CC(=O)NCC(=O)NCC#Cc1ccccc1C#CCNC(=O)CNC(=O)CN(Cc1c(nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12)-c1ccc(NC(=O)NCC)cc1)Cc1ccccc1)Cc1ccccc1
CC[C@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OC)c1Cl)NC1CCCC1 |wU:2.36,(.02,-19.97,;1.36,-19.2,;1.37,-17.66,;2.7,-16.9,;4.03,-17.67,;5.36,-16.91,;5.37,-15.37,;6.69,-17.69,;6.68,-19.23,;8.01,-20.01,;5.34,-19.99,;5.33,-21.53,;4.55,-22.87,;3.01,-22.86,;2.24,-21.52,;2.24,-24.19,;3.01,-25.53,;4.56,-25.52,;5.32,-24.19,;6.86,-24.18,;8.4,-24.17,;6.85,-22.64,;6.87,-25.72,;4.02,-19.22,;2.68,-19.98,;8.03,-16.93,;9.35,-17.71,;10.69,-16.95,;10.7,-15.41,;9.37,-14.63,;9.37,-13.09,;10.71,-12.33,;8.03,-15.4,;6.7,-14.62,;.03,-16.89,;.04,-15.35,;1.29,-14.44,;.82,-12.98,;-.72,-12.97,;-1.2,-14.43,)|
CC[C@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OC)c1F)NC1CCCC1 |wU:2.36,(25.73,-5.25,;27.07,-4.49,;27.08,-2.95,;28.41,-2.19,;29.75,-2.96,;31.07,-2.2,;31.08,-.66,;32.41,-2.98,;32.4,-4.52,;33.73,-5.3,;31.06,-5.28,;31.05,-6.82,;30.26,-8.16,;28.72,-8.15,;27.95,-6.82,;27.95,-9.48,;28.72,-10.82,;30.27,-10.81,;31.03,-9.48,;32.57,-9.47,;34.11,-9.47,;32.57,-7.93,;32.58,-11.01,;29.73,-4.51,;28.39,-5.27,;33.74,-2.22,;35.07,-3,;36.41,-2.24,;36.42,-.7,;35.08,.08,;35.08,1.62,;36.42,2.38,;33.75,-.69,;32.41,.08,;25.75,-2.18,;25.75,-.64,;27,.27,;26.53,1.73,;24.99,1.74,;24.51,.27,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@@H](C)NC2CCCC2)c1=O |wU:29.31,(18.88,4.4,;17.55,3.63,;17.54,2.09,;18.88,1.31,;18.87,-.23,;17.53,-.99,;16.21,-.21,;16.21,1.33,;14.88,2.1,;14.87,-.97,;14.86,-2.51,;16.19,-3.29,;13.52,-3.27,;13.51,-4.81,;12.72,-6.14,;11.18,-6.14,;10.42,-4.8,;10.41,-7.47,;11.19,-8.8,;12.73,-8.8,;13.49,-7.46,;15.03,-7.46,;16.57,-7.45,;15.03,-5.92,;15.04,-9,;12.19,-2.49,;10.85,-3.25,;12.21,-.95,;10.88,-.17,;9.54,-.94,;9.53,-2.48,;8.21,-.17,;8.21,1.37,;9.46,2.28,;8.99,3.75,;7.45,3.75,;6.97,2.29,;13.54,-.18,;13.54,1.35,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](C)NC2CCCC2)c1=O |wU:26.28,(3.89,4.41,;2.56,3.64,;2.56,2.1,;3.9,1.32,;3.9,-.22,;2.56,-.98,;1.24,-.21,;1.23,1.33,;-.1,2.09,;-.1,-.97,;-.1,-2.52,;1.23,-3.29,;-1.44,-3.28,;-1.44,-4.82,;-2.26,-6.14,;-1.52,-7.48,;.02,-7.51,;-2.32,-8.79,;-3.86,-8.76,;-4.6,-7.4,;-3.8,-6.09,;-4.53,-4.73,;-2.76,-2.51,;-4.1,-3.28,;-2.76,-.97,;-4.09,-.2,;-5.42,-.97,;-5.42,-2.51,;-6.76,-.21,;-6.76,1.33,;-5.52,2.25,;-6,3.71,;-7.54,3.71,;-8.01,2.24,;-1.43,-.2,;-1.43,1.34,)|
COc1cccc(c1Cl)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(CC(CO)NC2CCCC2)c1=O
COc1cccc(c1Cl)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](CO)NC2CCCC2)c1=O |wD:29.33,(30.31,-45.9,;30.31,-44.36,;28.98,-43.59,;28.99,-42.04,;27.64,-41.27,;26.32,-42.04,;26.32,-43.58,;27.65,-44.35,;27.64,-45.89,;24.99,-44.34,;24.98,-45.89,;26.32,-46.66,;23.65,-46.65,;23.64,-48.19,;22.83,-49.5,;21.29,-49.46,;20.55,-48.1,;20.48,-50.77,;21.22,-52.12,;22.77,-52.16,;23.56,-50.85,;25.1,-50.88,;26.64,-50.87,;25.09,-52.42,;25.12,-49.34,;22.32,-45.88,;20.99,-46.65,;22.33,-44.34,;20.99,-43.57,;19.66,-44.34,;19.66,-45.88,;18.33,-46.65,;18.32,-43.57,;18.32,-42.03,;19.57,-41.12,;19.09,-39.66,;17.55,-39.66,;17.07,-41.13,;23.65,-43.57,;23.65,-42.03,)|
CC[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OC)c1Cl)NC1CCCC1 |wD:2.36,(-9.28,-47.28,;-7.95,-46.5,;-7.95,-44.96,;-6.62,-44.19,;-5.29,-44.96,;-3.96,-44.19,;-3.96,-42.65,;-2.62,-44.97,;-2.63,-46.51,;-1.29,-47.28,;-3.96,-47.27,;-3.97,-48.81,;-4.79,-50.13,;-6.32,-50.08,;-7.06,-48.73,;-7.13,-51.39,;-6.39,-52.75,;-4.84,-52.78,;-4.05,-51.47,;-2.51,-51.5,;-.97,-51.5,;-2.52,-53.04,;-2.49,-49.96,;-5.29,-46.51,;-6.63,-47.27,;-1.29,-44.2,;.04,-44.97,;1.37,-44.21,;1.37,-42.67,;.03,-41.89,;.03,-40.35,;1.36,-39.58,;-1.3,-42.67,;-2.63,-41.9,;-9.29,-44.2,;-9.29,-42.66,;-8.04,-41.74,;-8.52,-40.28,;-10.06,-40.28,;-10.54,-41.75,)|
COc1cccc(c1Cl)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](C)NC2CCCC2)c1=O |wD:29.31,(31.26,-23.84,;29.93,-24.61,;29.93,-26.15,;31.27,-26.92,;31.27,-28.47,;29.93,-29.23,;28.61,-28.46,;28.6,-26.92,;27.27,-26.16,;27.27,-29.22,;27.27,-30.77,;28.6,-31.54,;25.93,-31.53,;25.93,-33.07,;25.11,-34.38,;23.57,-34.34,;22.84,-32.98,;22.77,-35.65,;23.51,-37,;25.05,-37.04,;25.85,-35.73,;27.39,-35.76,;28.93,-35.75,;27.38,-37.3,;27.41,-34.22,;24.61,-30.76,;23.27,-31.53,;24.61,-29.22,;23.28,-28.45,;21.95,-29.22,;21.95,-30.76,;20.61,-28.45,;20.61,-26.91,;21.85,-26,;21.37,-24.54,;19.83,-24.54,;19.36,-26.01,;25.94,-28.45,;25.94,-26.91,)|
CC[C@@H](Cn1c(=O)c(c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)-c1cccc(OC)c1F)NC1CCCC1 |wD:2.36,(5.57,-31.33,;6.91,-30.56,;6.9,-29.02,;8.24,-28.25,;9.57,-29.02,;10.89,-28.25,;10.89,-26.71,;12.23,-29.02,;12.23,-30.56,;13.56,-31.34,;10.89,-31.33,;10.89,-32.87,;10.07,-34.18,;8.53,-34.14,;7.8,-32.78,;7.73,-35.45,;8.46,-36.8,;10.01,-36.84,;10.81,-35.52,;12.35,-35.56,;13.88,-35.55,;12.33,-37.1,;12.37,-34.02,;9.56,-30.56,;8.23,-31.33,;13.57,-28.25,;14.89,-29.03,;16.23,-28.26,;16.23,-26.72,;14.89,-25.95,;14.89,-24.41,;16.22,-23.64,;13.56,-26.72,;12.22,-25.95,;5.57,-28.25,;5.57,-26.71,;6.81,-25.8,;6.33,-24.34,;4.79,-24.34,;4.32,-25.8,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](C)NC2CCCC2)c1=O |wD:29.31,(1.43,-22.95,;.1,-23.72,;.1,-25.26,;1.44,-26.03,;1.44,-27.57,;.11,-28.34,;-1.22,-27.56,;-1.23,-26.03,;-2.56,-25.26,;-2.55,-28.33,;-2.56,-29.87,;-1.22,-30.64,;-3.89,-30.64,;-3.9,-32.18,;-4.72,-33.49,;-6.25,-33.44,;-6.99,-32.09,;-7.06,-34.76,;-6.32,-36.11,;-4.77,-36.15,;-3.98,-34.83,;-2.44,-34.86,;-.9,-34.86,;-2.45,-36.4,;-2.42,-33.32,;-5.22,-29.87,;-6.56,-30.64,;-5.22,-28.32,;-6.55,-27.56,;-7.88,-28.33,;-7.88,-29.87,;-9.22,-27.56,;-9.22,-26.02,;-7.97,-25.11,;-8.45,-23.64,;-9.99,-23.65,;-10.47,-25.11,;-3.89,-27.55,;-3.89,-26.01,)|
COc1cccc(c1)-c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](C)NC2CCCC2)c1=O
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](CO)NC2CCCC2)c1=O |wD:26.30,(17.71,-8.61,;16.38,-9.38,;16.38,-10.92,;17.72,-11.7,;17.72,-13.24,;16.39,-14,;15.06,-13.23,;15.05,-11.69,;13.72,-10.93,;13.72,-13.99,;13.72,-15.54,;15.05,-16.31,;12.39,-16.3,;12.38,-17.84,;11.56,-19.16,;12.3,-20.5,;13.84,-20.53,;11.5,-21.81,;9.96,-21.78,;9.22,-20.42,;10.02,-19.11,;9.29,-17.75,;11.06,-15.53,;9.72,-16.3,;11.06,-13.99,;9.73,-13.22,;8.4,-13.99,;8.4,-15.53,;7.07,-16.31,;7.06,-13.23,;7.06,-11.69,;8.3,-10.77,;7.83,-9.31,;6.29,-9.31,;5.81,-10.78,;12.39,-13.22,;12.39,-11.68,)|
Cc1cc(C)cc(c1)-c1c(OCC[C@@H]2CCC[C@H](CCCc3ccccc3)N2)c2cc(c(Cl)cc2[nH]c1=O)[N+]([O-])=O
CCC1CCCC(CCOc2c(-c3cc(C)cc(C)c3)c(=[OH+])[n-]c3cc(Cl)c(cc23)[N+]([O-])=O)N1
CC1CCCC(CCOc2c(-c3cc(C)cc(C)c3)c(=[OH+])[n-]c3cc(Cl)c(cc23)[N+]([O-])=O)N1
CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
CNC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c2c1CN(C)Cc1ccccc1
COc1cccc(c1)N1CN(Cc2c(F)cccc2F)C(=O)N(C[C@H](N)c2ccccc2)C1=O
CC(C)(C)CNC(=O)NCCc1nc2cc(ccc2n1Cc1ccccc1)S(=O)(=O)NCc1ccc(F)cc1
COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(\C)=N\OCC(=O)NCCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r,wU:93.101,69.87,51.65,47.52,102.111,14.39,19.18,wD:25.25,23.23,21.21,14.14,83.98,63.71,110.119,124.135,17.17,(18.46,-22.62,;18.47,-21.08,;17.14,-20.3,;15.81,-21.06,;14.48,-20.28,;14.49,-18.74,;15.83,-17.98,;15.84,-16.44,;14.51,-15.66,;17.18,-15.69,;17.19,-14.15,;15.86,-13.37,;18.52,-13.39,;18.52,-11.86,;19.86,-11.1,;21.34,-10.69,;21.19,-11.86,;21.19,-13.41,;22.52,-14.18,;23.86,-13.42,;23.86,-11.88,;25.2,-11.12,;25.21,-9.57,;26.53,-11.89,;27.87,-11.13,;26.52,-13.44,;27.85,-14.22,;25.19,-14.2,;19.85,-14.18,;19.84,-15.71,;21.17,-16.49,;18.51,-16.47,;18.5,-18.01,;19.83,-18.79,;17.15,-18.77,;19.86,-9.56,;21.19,-8.79,;18.52,-8.79,;18.52,-7.25,;17.19,-6.47,;15.85,-7.25,;15.85,-8.79,;14.52,-6.47,;14.52,-4.93,;15.85,-4.16,;15.85,-2.62,;17.18,-1.84,;17.18,-.3,;15.85,.47,;14.51,-.31,;14.51,-1.84,;13.18,.46,;13.18,2.01,;14.52,2.78,;15.85,2,;17.18,2.77,;17.18,4.31,;18.52,5.09,;15.84,5.08,;14.51,4.31,;11.84,-.31,;10.52,.46,;10.52,2,;9.17,-.32,;9.17,-1.85,;10.52,-2.63,;7.84,.46,;6.51,-.31,;6.51,-1.86,;5.18,.45,;5.18,2,;6.51,2.77,;7.91,2.15,;8.94,3.29,;8.17,4.62,;8.64,6.08,;7.61,7.22,;6.11,6.9,;5.63,5.44,;6.66,4.3,;3.83,-.32,;2.5,.45,;2.5,2,;1.17,-.32,;1.17,-1.86,;2.5,-2.63,;3.92,-2.01,;4.94,-3.14,;4.18,-4.48,;2.67,-4.16,;-.17,.45,;-1.51,-.32,;-1.51,-1.87,;-2.83,.45,;-2.83,1.99,;-4.3,2.46,;-5.2,1.21,;-6.74,1.2,;-4.29,-.03,;18.52,.47,;18.52,2.01,;19.85,-.3,;21.19,.47,;21.19,2.02,;22.52,2.78,;22.52,4.33,;23.86,2.02,;22.52,-.3,;22.52,-1.84,;23.86,.47,;25.19,-.29,;25.19,-1.83,;23.86,-2.6,;23.86,-4.15,;22.52,-4.91,;21.2,-4.15,;21.2,-2.61,;19.86,-4.92,;26.53,.48,;26.53,2.03,;27.86,-.29,;28.17,-1.94,;29.83,-2.17,;30.56,-.66,;29.28,.21,;29.48,1.74,;28.25,2.68,;30.89,2.34,;31,3.88,;32.39,4.56,;32.49,6.09,;33.66,3.7,)|
COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(\C)=N\OCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r|
COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(\C)=N\OCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCNC(C)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r|
CCCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CO\N=C(/C)[C@@]1(O)C[C@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)c2c(O)c3C(=O)c4c(OC)cccc4C(=O)c3c(O)c2C1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r|
Cc1cccc(F)c1Cn1c(C)c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c1=O |r|
COc1cccc(c1F)-c1c(C)n(Cc2c(C)cccc2F)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c1=O |r,wD:26.28,(15.67,-2.45,;14.34,-3.22,;14.34,-4.76,;15.68,-5.53,;15.68,-7.07,;14.34,-7.84,;13.01,-7.06,;13.01,-5.53,;11.68,-4.76,;11.68,-7.82,;11.68,-9.36,;13.01,-10.14,;10.35,-10.13,;10.35,-11.67,;11.14,-12.98,;10.4,-14.32,;8.86,-14.35,;11.2,-15.64,;12.74,-15.61,;13.48,-14.25,;12.67,-12.94,;13.41,-11.58,;9.02,-9.36,;7.69,-10.14,;9.02,-7.82,;7.69,-7.06,;6.36,-7.83,;6.36,-9.37,;5.03,-10.15,;5.03,-11.69,;3.7,-12.46,;3.71,-14,;5.04,-14.77,;2.37,-14.77,;5.02,-7.07,;5.02,-5.53,;3.69,-4.76,;2.35,-5.54,;2.36,-7.08,;3.7,-7.84,;10.35,-7.05,;10.35,-5.51,)|
Cc1cc(F)cc(c1)[C@H](Cn1c(=O)c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(C)n(Cc2c(F)cccc2F)c1=O)NCCCC(O)=O |r|
COc1ccc(F)cc1[C@H](Cn1c(=O)c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(C)n(Cc2c(F)cccc2F)c1=O)NCCCC(O)=O |r|
COc1ccccc1[C@H](Cn1c(=O)c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(C)n(Cc2c(F)cccc2F)c1=O)NCCCC(O)=O |r|
Cc1c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1F |r|
Cc1cc(F)cc(c1)[C@@H](N)Cn1c(=O)c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(C)n(Cc2c(F)cccc2F)c1=O |r|
COc1ccc(F)cc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(C)n(Cc2c(F)cccc2F)c1=O |r|
COc1ccccc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(C)n(Cc2c(F)cccc2F)c1=O |r|
Cc1c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1cc(F)cc(c1)[C@@H](N)Cn1c(=O)c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(C)n(Cc2c(F)cccc2F)c1=O |r|
COc1ccc(F)cc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(C)n(Cc2c(F)cccc2F)c1=O |r|
Cc1c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(=O)n(CC(N)c2cccc(F)c2)c(=O)n1Cc1c(F)cccc1F
Cc1c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(=O)n(C[C@H](N)c2ccc(F)cc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1cccc(c1)C(N)Cn1c(=O)c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(C)n(Cc2c(F)cccc2F)c1=O
Cc1c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(=O)n(CC(N)c2ccccc2F)c(=O)n1Cc1c(F)cccc1F
Cc1c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1F |r|
COc1ccccc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(C)n(Cc2c(F)cccc2F)c1=O |r|
Cc1ccccc1C(N)Cn1c(=O)c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(C)n(Cc2c(F)cccc2F)c1=O
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)Cc2cccs2)c1=O |(53.48,-34.15,;52.15,-33.38,;50.82,-34.15,;50.82,-35.69,;49.49,-36.45,;48.16,-35.69,;48.16,-34.15,;49.49,-33.38,;49.49,-31.85,;46.83,-33.38,;45.5,-34.15,;45.5,-35.69,;44.17,-33.38,;42.82,-34.16,;42.13,-35.55,;40.57,-35.64,;39.72,-34.33,;39.88,-37.02,;40.74,-38.32,;42.3,-38.22,;42.99,-36.83,;44.54,-36.73,;44.17,-31.85,;42.85,-31.08,;45.5,-31.08,;45.5,-29.55,;44.17,-28.78,;44.17,-27.25,;42.85,-29.55,;41.51,-28.78,;41.35,-27.22,;39.81,-26.89,;39.03,-28.25,;40.08,-29.42,;46.83,-31.85,;48.16,-31.08,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)Cc2cc(F)cc(F)c2)c1=O |(53.49,-34.16,;52.17,-33.39,;50.83,-34.16,;50.83,-35.7,;49.51,-36.46,;48.17,-35.7,;48.17,-34.16,;49.51,-33.39,;49.51,-31.86,;46.85,-33.39,;45.51,-34.16,;45.51,-35.7,;44.18,-33.39,;42.84,-34.17,;42.14,-35.56,;40.59,-35.65,;39.73,-34.34,;39.89,-37.04,;40.75,-38.34,;42.31,-38.24,;43,-36.85,;44.55,-36.74,;44.18,-31.86,;42.86,-31.09,;45.51,-31.09,;45.51,-29.56,;44.18,-28.79,;44.18,-27.25,;42.86,-29.56,;41.52,-28.79,;41.52,-27.25,;40.2,-26.48,;40.2,-24.91,;38.86,-27.25,;38.86,-28.79,;37.5,-29.57,;40.2,-29.56,;46.85,-31.86,;48.17,-31.09,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)Cc2cccc(c2)C(F)(F)F)c1=O |(53.49,-34.16,;52.17,-33.39,;50.83,-34.16,;50.83,-35.7,;49.51,-36.46,;48.17,-35.7,;48.17,-34.16,;49.51,-33.39,;49.51,-31.86,;46.85,-33.39,;45.51,-34.16,;45.51,-35.7,;44.18,-33.39,;42.84,-34.17,;42.14,-35.56,;40.59,-35.65,;39.73,-34.34,;39.89,-37.04,;40.75,-38.34,;42.31,-38.24,;43,-36.85,;44.55,-36.74,;44.18,-31.86,;42.86,-31.09,;45.51,-31.09,;45.51,-29.56,;44.18,-28.79,;44.18,-27.25,;42.86,-29.56,;41.52,-28.79,;41.52,-27.25,;40.2,-26.48,;38.86,-27.25,;38.86,-28.79,;40.2,-29.56,;37.5,-29.57,;36.14,-28.79,;37.5,-31.14,;36.14,-30.36,;46.85,-31.86,;48.17,-31.09,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)Cc2ccc(cc2F)C(F)(F)F)c1=O |(53.49,-34.16,;52.17,-33.39,;50.83,-34.16,;50.83,-35.7,;49.51,-36.46,;48.17,-35.7,;48.17,-34.16,;49.51,-33.39,;49.51,-31.86,;46.85,-33.39,;45.51,-34.16,;45.51,-35.7,;44.18,-33.39,;42.84,-34.17,;42.14,-35.56,;40.59,-35.65,;39.73,-34.34,;39.89,-37.04,;40.75,-38.34,;42.31,-38.24,;43,-36.85,;44.55,-36.74,;44.18,-31.86,;42.86,-31.09,;45.51,-31.09,;45.51,-29.56,;44.18,-28.79,;44.18,-27.25,;42.86,-29.56,;41.52,-28.79,;41.52,-27.25,;40.2,-26.48,;38.86,-27.25,;38.86,-28.79,;40.2,-29.56,;40.2,-31.09,;37.5,-26.47,;37.5,-24.9,;36.14,-27.25,;36.14,-25.68,;46.85,-31.86,;48.17,-31.09,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)Cc2ccc(F)cc2Cl)c1=O |(53.49,-34.16,;52.17,-33.39,;50.83,-34.16,;50.83,-35.7,;49.51,-36.46,;48.17,-35.7,;48.17,-34.16,;49.51,-33.39,;49.51,-31.86,;46.85,-33.39,;45.51,-34.16,;45.51,-35.7,;44.18,-33.39,;42.84,-34.17,;42.14,-35.56,;40.59,-35.65,;39.73,-34.34,;39.89,-37.04,;40.75,-38.34,;42.31,-38.24,;43,-36.85,;44.55,-36.74,;44.18,-31.86,;42.86,-31.09,;45.51,-31.09,;45.51,-29.56,;44.18,-28.79,;44.18,-27.25,;42.86,-29.56,;41.52,-28.79,;41.52,-27.25,;40.2,-26.48,;38.86,-27.25,;37.5,-26.47,;38.86,-28.79,;40.2,-29.56,;40.2,-31.09,;46.85,-31.86,;48.17,-31.09,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)Cc2cccc(F)c2)c1=O |(53.49,-34.16,;52.17,-33.39,;50.83,-34.16,;50.83,-35.7,;49.51,-36.46,;48.17,-35.7,;48.17,-34.16,;49.51,-33.39,;49.51,-31.86,;46.85,-33.39,;45.51,-34.16,;45.51,-35.7,;44.18,-33.39,;42.84,-34.17,;42.14,-35.56,;40.59,-35.65,;39.73,-34.34,;39.89,-37.04,;40.75,-38.34,;42.31,-38.24,;43,-36.85,;44.55,-36.74,;44.18,-31.86,;42.86,-31.09,;45.51,-31.09,;45.51,-29.56,;44.18,-28.79,;44.18,-27.25,;42.86,-29.56,;41.52,-28.79,;41.52,-27.25,;40.2,-26.48,;38.86,-27.25,;38.86,-28.79,;37.5,-29.57,;40.2,-29.56,;46.85,-31.86,;48.17,-31.09,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)Cc2c(F)cccc2Cl)c1=O |(53.49,-34.16,;52.17,-33.39,;50.83,-34.16,;50.83,-35.7,;49.51,-36.46,;48.17,-35.7,;48.17,-34.16,;49.51,-33.39,;49.51,-31.86,;46.85,-33.39,;45.51,-34.16,;45.51,-35.7,;44.18,-33.39,;42.84,-34.17,;42.14,-35.56,;40.59,-35.65,;39.73,-34.34,;39.89,-37.04,;40.75,-38.34,;42.31,-38.24,;43,-36.85,;44.55,-36.74,;44.18,-31.86,;42.86,-31.09,;45.51,-31.09,;45.51,-29.56,;44.18,-28.79,;44.18,-27.25,;42.86,-29.56,;41.52,-28.79,;41.52,-27.25,;42.86,-26.48,;40.2,-26.48,;38.86,-27.25,;38.86,-28.79,;40.2,-29.56,;40.2,-31.09,;46.85,-31.86,;48.17,-31.09,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)c2cccc(OC(F)(F)F)c2)c1=O |(29.19,-32.96,;27.87,-32.2,;26.54,-32.96,;26.54,-34.5,;25.22,-35.25,;23.9,-34.5,;23.9,-32.96,;25.22,-32.2,;25.22,-30.67,;22.57,-32.2,;21.25,-32.96,;21.25,-34.5,;19.92,-32.2,;18.58,-32.98,;17.82,-34.32,;18.6,-35.65,;20.15,-35.63,;17.85,-36.99,;16.29,-37.01,;15.51,-35.67,;16.27,-34.33,;15.49,-32.99,;19.92,-30.67,;18.6,-29.9,;21.25,-29.9,;21.25,-28.38,;19.92,-27.61,;18.6,-28.38,;19.92,-26.09,;21.28,-25.31,;21.28,-23.74,;19.92,-22.96,;18.57,-23.74,;17.21,-22.96,;15.86,-23.74,;14.51,-22.96,;15.86,-25.31,;14.51,-24.52,;18.57,-25.31,;22.57,-30.67,;23.9,-29.9,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)c2ccccc2C(F)(F)F)c1=O |(29.19,-32.96,;27.87,-32.2,;26.54,-32.96,;26.54,-34.5,;25.22,-35.25,;23.9,-34.5,;23.9,-32.96,;25.22,-32.2,;25.22,-30.67,;22.57,-32.2,;21.25,-32.96,;21.25,-34.5,;19.92,-32.2,;18.58,-32.98,;17.82,-34.32,;18.6,-35.65,;20.15,-35.63,;17.85,-36.99,;16.29,-37.01,;15.51,-35.67,;16.27,-34.33,;15.49,-32.99,;19.92,-30.67,;18.6,-29.9,;21.25,-29.9,;21.25,-28.38,;19.92,-27.61,;18.6,-28.38,;19.92,-26.09,;18.57,-25.31,;18.57,-23.74,;19.92,-22.96,;21.28,-23.74,;21.28,-25.31,;22.63,-26.09,;23.98,-25.31,;22.63,-27.65,;23.98,-26.87,;22.57,-30.67,;23.9,-29.9,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)c2ccccc2Cl)c1=O |(29.31,-33.1,;27.99,-32.34,;26.65,-33.1,;26.65,-34.64,;25.33,-35.41,;24,-34.64,;24,-33.1,;25.33,-32.34,;25.33,-30.8,;22.67,-32.34,;21.34,-33.1,;21.34,-34.64,;20.01,-32.34,;18.66,-33.12,;17.89,-34.47,;18.68,-35.8,;20.24,-35.78,;17.92,-37.15,;16.36,-37.17,;15.57,-35.82,;16.34,-34.47,;15.56,-33.13,;20.01,-30.8,;18.68,-30.03,;21.34,-30.03,;21.34,-28.5,;20.01,-27.73,;18.68,-28.5,;20.01,-26.2,;18.65,-25.42,;18.65,-23.85,;20.01,-23.06,;21.37,-23.85,;21.37,-25.42,;22.73,-26.2,;22.67,-30.8,;24,-30.03,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)c2ccc(C)cc2C)c1=O |(29.19,-32.96,;27.87,-32.2,;26.54,-32.96,;26.54,-34.5,;25.22,-35.25,;23.9,-34.5,;23.9,-32.96,;25.22,-32.2,;25.22,-30.67,;22.57,-32.2,;21.25,-32.96,;21.25,-34.5,;19.92,-32.2,;18.58,-32.98,;17.82,-34.32,;18.6,-35.65,;20.15,-35.63,;17.85,-36.99,;16.29,-37.01,;15.51,-35.67,;16.27,-34.33,;15.49,-32.99,;19.92,-30.67,;18.6,-29.9,;21.25,-29.9,;21.25,-28.38,;19.92,-27.61,;18.6,-28.38,;19.92,-26.09,;18.57,-25.31,;18.57,-23.74,;19.92,-22.96,;19.92,-21.4,;21.28,-23.74,;21.28,-25.31,;22.63,-26.09,;22.57,-30.67,;23.9,-29.9,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)c2ccc(SC)cc2)c1=O |(29.31,-33.1,;27.99,-32.34,;26.65,-33.1,;26.65,-34.64,;25.33,-35.41,;24,-34.64,;24,-33.1,;25.33,-32.34,;25.33,-30.8,;22.67,-32.34,;21.34,-33.1,;21.34,-34.64,;20.01,-32.34,;18.66,-33.12,;17.89,-34.47,;18.68,-35.8,;20.24,-35.78,;17.92,-37.15,;16.36,-37.17,;15.57,-35.82,;16.34,-34.47,;15.56,-33.13,;20.01,-30.8,;18.68,-30.03,;21.34,-30.03,;21.34,-28.5,;20.01,-27.73,;18.68,-28.5,;20.01,-26.2,;21.37,-25.42,;21.37,-23.85,;20.01,-23.06,;20.01,-21.49,;18.65,-20.71,;18.65,-23.85,;18.65,-25.42,;22.67,-30.8,;24,-30.03,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)c2cc(C)cc(F)c2)c1=O |(29.19,-32.96,;27.87,-32.2,;26.54,-32.96,;26.54,-34.5,;25.22,-35.25,;23.9,-34.5,;23.9,-32.96,;25.22,-32.2,;25.22,-30.67,;22.57,-32.2,;21.25,-32.96,;21.25,-34.5,;19.92,-32.2,;18.58,-32.98,;17.82,-34.32,;18.6,-35.65,;20.15,-35.63,;17.85,-36.99,;16.29,-37.01,;15.51,-35.67,;16.27,-34.33,;15.49,-32.99,;19.92,-30.67,;18.6,-29.9,;21.25,-29.9,;21.25,-28.38,;19.92,-27.61,;18.6,-28.38,;19.92,-26.09,;21.28,-25.31,;21.28,-23.74,;22.63,-22.96,;19.92,-22.96,;18.57,-23.74,;17.21,-22.96,;18.57,-25.31,;22.57,-30.67,;23.9,-29.9,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)c2cc(F)ccc2OC)c1=O |(29.31,-33.1,;27.99,-32.34,;26.65,-33.1,;26.65,-34.64,;25.33,-35.41,;24,-34.64,;24,-33.1,;25.33,-32.34,;25.33,-30.8,;22.67,-32.34,;21.34,-33.1,;21.34,-34.64,;20.01,-32.34,;18.66,-33.12,;17.89,-34.47,;18.68,-35.8,;20.24,-35.78,;17.92,-37.15,;16.36,-37.17,;15.57,-35.82,;16.34,-34.47,;15.56,-33.13,;20.01,-30.8,;18.68,-30.03,;21.34,-30.03,;21.34,-28.5,;20.01,-27.73,;18.68,-28.5,;20.01,-26.2,;18.65,-25.42,;18.65,-23.85,;17.29,-23.06,;20.01,-23.06,;21.37,-23.85,;21.37,-25.42,;22.73,-26.2,;24.09,-25.42,;22.67,-30.8,;24,-30.03,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)c2cc(Cl)cc(Cl)c2)c1=O |(29.31,-33.1,;27.99,-32.34,;26.65,-33.1,;26.65,-34.64,;25.33,-35.41,;24,-34.64,;24,-33.1,;25.33,-32.34,;25.33,-30.8,;22.67,-32.34,;21.34,-33.1,;21.34,-34.64,;20.01,-32.34,;18.66,-33.12,;17.89,-34.47,;18.68,-35.8,;20.24,-35.78,;17.92,-37.15,;16.36,-37.17,;15.57,-35.82,;16.34,-34.47,;15.56,-33.13,;20.01,-30.8,;18.68,-30.03,;21.34,-30.03,;21.34,-28.5,;20.01,-27.73,;18.68,-28.5,;20.01,-26.2,;21.37,-25.42,;21.37,-23.85,;22.73,-23.06,;20.01,-23.06,;18.65,-23.85,;17.29,-23.06,;18.65,-25.42,;22.67,-30.8,;24,-30.03,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@@H](N)c2ccco2)c1=O |r,wU:26.28,(29.32,-33.11,;27.99,-32.35,;26.66,-33.11,;26.66,-34.65,;25.33,-35.42,;24.01,-34.65,;24.01,-33.11,;25.33,-32.35,;25.33,-30.81,;22.67,-32.35,;21.35,-33.11,;21.35,-34.65,;20.01,-32.35,;18.67,-33.13,;17.9,-34.48,;18.69,-35.81,;20.25,-35.79,;17.93,-37.16,;16.37,-37.18,;15.58,-35.84,;16.35,-34.48,;15.56,-33.14,;20.01,-30.81,;18.69,-30.04,;21.35,-30.04,;21.35,-28.51,;20.01,-27.74,;18.69,-28.51,;20.01,-26.21,;21.28,-25.29,;20.8,-23.79,;19.23,-23.79,;18.74,-25.29,;22.67,-30.81,;24.01,-30.04,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)c2cccnc2)c1=O |(29.31,-33.11,;27.99,-32.34,;26.65,-33.11,;26.65,-34.65,;25.33,-35.41,;24,-34.65,;24,-33.11,;25.33,-32.34,;25.33,-30.8,;22.67,-32.34,;21.34,-33.11,;21.34,-34.65,;20.01,-32.34,;18.66,-33.12,;17.9,-34.47,;18.69,-35.8,;20.24,-35.79,;17.92,-37.16,;16.36,-37.17,;15.57,-35.83,;16.34,-34.48,;15.56,-33.13,;20.01,-30.8,;18.68,-30.03,;21.34,-30.03,;21.34,-28.5,;20.01,-27.73,;18.68,-28.5,;20.01,-26.2,;18.65,-25.42,;18.65,-23.85,;20.01,-23.06,;21.37,-23.85,;21.37,-25.42,;22.67,-30.8,;24,-30.03,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)C2CCN(C)CC2)c1=O |(29.31,-33.1,;27.99,-32.34,;26.65,-33.1,;26.65,-34.64,;25.33,-35.41,;24,-34.64,;24,-33.1,;25.33,-32.34,;25.33,-30.8,;22.67,-32.34,;21.34,-33.1,;21.34,-34.64,;20.01,-32.34,;18.66,-33.12,;17.89,-34.47,;18.68,-35.8,;20.24,-35.78,;17.92,-37.15,;16.36,-37.17,;15.57,-35.82,;16.34,-34.47,;15.56,-33.13,;20.01,-30.8,;18.68,-30.03,;21.34,-30.03,;21.34,-28.5,;20.01,-27.73,;18.68,-28.5,;20.01,-26.2,;21.37,-25.42,;21.37,-23.85,;20.01,-23.06,;20.01,-21.49,;18.65,-23.85,;18.65,-25.42,;22.67,-30.8,;24,-30.03,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(CC(N)C2CCSCC2)c1=O |(29.31,-33.11,;27.99,-32.34,;26.65,-33.11,;26.65,-34.65,;25.33,-35.41,;24,-34.65,;24,-33.11,;25.33,-32.34,;25.33,-30.8,;22.67,-32.34,;21.34,-33.11,;21.34,-34.65,;20.01,-32.34,;18.66,-33.12,;17.9,-34.47,;18.69,-35.8,;20.24,-35.79,;17.92,-37.16,;16.36,-37.17,;15.57,-35.83,;16.34,-34.48,;15.56,-33.13,;20.01,-30.8,;18.68,-30.03,;21.34,-30.03,;21.34,-28.5,;20.01,-27.73,;18.68,-28.5,;20.01,-26.2,;21.37,-25.42,;21.37,-23.85,;20.01,-23.06,;18.65,-23.85,;18.65,-25.42,;22.67,-30.8,;24,-30.03,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)C2CCOCC2)c1=O |r,wD:26.28,(29.31,-33.1,;27.99,-32.34,;26.65,-33.1,;26.65,-34.64,;25.33,-35.41,;24,-34.64,;24,-33.1,;25.33,-32.34,;25.33,-30.8,;22.67,-32.34,;21.34,-33.1,;21.34,-34.64,;20.01,-32.34,;18.66,-33.12,;17.89,-34.47,;18.68,-35.8,;20.24,-35.78,;17.92,-37.15,;16.36,-37.17,;15.57,-35.82,;16.34,-34.47,;15.56,-33.13,;20.01,-30.8,;18.68,-30.03,;21.34,-30.03,;21.34,-28.5,;20.01,-27.73,;18.68,-28.5,;20,-26.16,;21.36,-25.38,;21.36,-23.81,;20,-23.02,;18.64,-23.81,;18.64,-25.38,;22.67,-30.8,;24,-30.03,)|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)C2CCOC2)c1=O |r,wD:26.28,(29.32,-33.11,;27.99,-32.35,;26.66,-33.11,;26.66,-34.65,;25.33,-35.42,;24.01,-34.65,;24.01,-33.11,;25.33,-32.35,;25.33,-30.81,;22.67,-32.35,;21.35,-33.11,;21.35,-34.65,;20.01,-32.35,;18.67,-33.13,;17.9,-34.48,;18.69,-35.81,;20.25,-35.79,;17.93,-37.16,;16.37,-37.18,;15.58,-35.84,;16.35,-34.48,;15.56,-33.14,;20.01,-30.81,;18.69,-30.04,;21.35,-30.04,;21.35,-28.51,;20.01,-27.74,;18.69,-28.51,;20.01,-26.21,;21.26,-25.3,;20.78,-23.85,;19.25,-23.85,;18.77,-25.3,;22.67,-30.81,;24.01,-30.04,)|
Cc1c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccco2)c1=O |r,wD:26.28,(29.32,-33.11,;27.99,-32.35,;26.66,-33.11,;26.66,-34.65,;25.33,-35.42,;24.01,-34.65,;24.01,-33.11,;25.33,-32.35,;25.33,-30.81,;22.67,-32.35,;21.35,-33.11,;21.35,-34.65,;20.01,-32.35,;18.67,-33.13,;17.9,-34.48,;18.69,-35.81,;20.25,-35.79,;17.93,-37.16,;16.37,-37.18,;15.58,-35.84,;16.35,-34.48,;15.56,-33.14,;20.01,-30.81,;18.69,-30.04,;21.35,-30.04,;21.35,-28.51,;20.01,-27.74,;18.69,-28.51,;20.01,-26.21,;21.28,-25.29,;20.8,-23.79,;19.23,-23.79,;18.74,-25.29,;22.67,-30.81,;24.01,-30.04,)|
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCc2cn(CCOCCOCCn3cc(CNC(=O)Nc4ccc(cc4)-c4nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n5c4CN(C)Cc4ccccc4)nn3)nn2)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCc2cn(CCOCCOCCOCCN=[N+]=[N-])nn2)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCc2cn(CCOCCOCCOCCOCCN=[N+]=[N-])nn2)cc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCc1cn(CCn2cc(CNC(=O)CN(Cc3c(nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)-c3ccc(NC(=O)NCC)cc3)Cc3ccccc3)nn2)nn1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)NCC#C)c(=O)n2c1CN(C)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCc1cn(CCOCCOCCOCCn2cc(CNC(=O)CN(Cc3c(nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)-c3ccc(NC(=O)NCC)cc3)Cc3ccccc3)nn2)nn1)Cc1ccccc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCc2cn(CCOCCOCCN=[N+]=[N-])nn2)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCc2cn(CCOCCOCCOCCn3cc(CNC(=O)Nc4ccc(cc4)-c4nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n5c4CN(C)Cc4ccccc4)nn3)nn2)cc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCc1cn(CCOCCOCCN=[N+]=[N-])nn1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCC#C)Cc1ccccc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCc2cn(CCn3cc(CNC(=O)Nc4ccc(cc4)-c4nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n5c4CN(C)Cc4ccccc4)nn3)nn2)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCc2cn(CCOCCN=[N+]=[N-])nn2)cc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCc1cn(CCOCCOCCn2cc(CNC(=O)CN(Cc3c(nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)-c3ccc(NC(=O)NCC)cc3)Cc3ccccc3)nn2)nn1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCc1cn(CCOCCOCCOCCOCCN=[N+]=[N-])nn1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCc1cn(CCOCCN=[N+]=[N-])nn1)Cc1ccccc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCc2cn(CCOCCn3cc(CNC(=O)Nc4ccc(cc4)-c4nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n5c4CN(C)Cc4ccccc4)nn3)nn2)cc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCc2cn(CCOCCOCCOCCOCCn3cc(CNC(=O)Nc4ccc(cc4)-c4nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n5c4CN(C)Cc4ccccc4)nn3)nn2)cc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCc1cn(CCOCCn2cc(CNC(=O)CN(Cc3c(nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)-c3ccc(NC(=O)NCC)cc3)Cc3ccccc3)nn2)nn1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCc1cn(CCOCCOCCOCCN=[N+]=[N-])nn1)Cc1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCc1cn(CCOCCOCCOCCOCCn2cc(CNC(=O)CN(Cc3c(nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)-c3ccc(NC(=O)NCC)cc3)Cc3ccccc3)nn2)nn1)Cc1ccccc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCc2cn(CCN=[N+]=[N-])nn2)cc1
CCNC(=O)Nc1ccc(cc1)-c1nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n2c1CN(CC(=O)NCc1cn(CCN=[N+]=[N-])nn1)Cc1ccccc1
CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(c(CN(C)Cc3ccccc3)n2c1=O)-c1ccc(NC(=O)NCC#C)cc1
CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCCCCCCCCNC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r,c:65,82,85,87,97,t:60,62,79,95|
CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCCCCCNC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r,c:62,79,82,84,94,t:57,59,76,92|
CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCNC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r,c:58,75,78,80,90,t:53,55,72,88|
CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCCCNC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r,c:60,77,80,82,92,t:55,57,74,90|
[#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1csc2ccccc12)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(Cl)cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(Cl)cc1)-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](-[#7])=O
[#6]-[#8]-c1ccc(cc1)-[#6](=O)-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1cccnc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(Cl)cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc2ccccc2c1)-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](-[#7])=O
[#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7](-[#6])-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1csc2ccccc12)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(Cl)cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(Cl)cc1)-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](-[#7])=O
CC(C)C[C@H](NC(=O)[C@H](CCCC(N)C(=O)c1ccncc1)NC(=O)[C@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCC(N)C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCC(N)C(=O)c1cccnc1)NC(=O)[C@H](CCCC(N)C(=O)c1cccnc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCC(N)C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O
[#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#7]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1cccnc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(Cl)cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc2ccccc2c1)-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](-[#7])=O
[#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#7]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7](-[#6])-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1cccnc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(Cl)cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc2ccccc2c1)-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](-[#7])=O
[#6]-[#8]-c1ccc(cc1)-[#6](=O)-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1cccnc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(Cl)cc1)-[#7]-[#6](=O)-[#6@@H](-[#6]-c1ccc2ccccc2c1)-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](-[#7])=O
CCNC(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCc1ccc(F)cc1 |wU:58.64,12.20,wD:31.44,23.28,5.4,64.68,45.48,(26.52,-7.4,;26.53,-8.93,;25.21,-9.72,;23.86,-8.96,;22.57,-9.72,;23.83,-7.45,;25.05,-6.57,;24.54,-5.13,;23.01,-5.13,;22.57,-6.58,;21.25,-7.32,;21.24,-8.86,;19.92,-6.57,;19.93,-5.02,;21.28,-4.26,;21.29,-2.71,;22.63,-1.96,;22.64,-.43,;23.96,.34,;21.31,.35,;18.58,-7.32,;17.26,-6.54,;17.26,-5,;15.91,-7.28,;15.91,-8.83,;17.23,-9.62,;18.57,-8.85,;17.22,-11.15,;14.59,-6.51,;13.26,-7.27,;13.24,-8.8,;11.94,-6.5,;11.95,-4.97,;11.47,-3.51,;10.02,-3.03,;10.02,-1.48,;11.49,-1.01,;12.11,.39,;13.65,.55,;14.55,-.69,;13.92,-2.1,;12.37,-2.26,;10.6,-7.25,;9.27,-6.48,;9.27,-4.94,;7.93,-7.24,;7.92,-8.77,;9.24,-9.56,;10.59,-8.8,;11.92,-9.57,;11.91,-11.12,;13.23,-11.89,;10.57,-11.88,;9.24,-11.1,;6.61,-6.45,;6.61,-4.9,;5.28,-7.21,;5.26,-8.77,;3.94,-6.44,;3.96,-4.9,;5.29,-4.15,;2.61,-7.19,;1.27,-6.42,;1.3,-4.89,;-.06,-7.18,;-.09,-8.72,;1.26,-9.51,;2.67,-8.88,;3.68,-10.02,;2.91,-11.36,;3.36,-12.82,;2.33,-13.95,;.84,-13.63,;.36,-12.17,;1.39,-11.04,;-1.38,-6.42,;-2.73,-7.16,;-2.73,-8.69,;-4.08,-6.42,;-5.53,-7.35,;-7.05,-6.58,;-8.49,-7.51,;-10.03,-6.74,;-10.13,-5.02,;-11.64,-4.16,;-8.68,-4.09,;-7.15,-4.87,)|
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CCNC(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1ccc(Cl)cc1 |wU:57.63,12.20,wD:45.57,31.44,23.28,5.4,63.79,(31.85,-10.83,;31.87,-12.36,;30.53,-13.14,;29.19,-12.37,;27.9,-13.14,;29.16,-10.87,;30.37,-9.97,;29.86,-8.53,;28.35,-8.53,;27.91,-9.99,;26.56,-10.74,;26.56,-12.28,;25.25,-9.97,;25.25,-8.43,;26.59,-7.67,;26.59,-6.13,;27.94,-5.36,;27.96,-3.82,;29.28,-3.07,;26.63,-3.05,;23.9,-10.74,;22.58,-9.96,;22.59,-8.4,;21.23,-10.71,;21.21,-12.25,;22.56,-13.05,;22.53,-14.58,;23.89,-12.28,;19.9,-9.94,;18.56,-10.7,;18.56,-12.23,;17.24,-9.91,;17.24,-8.37,;16.78,-6.92,;15.32,-6.44,;15.32,-4.88,;16.79,-4.42,;17.4,-3.02,;18.94,-2.86,;19.86,-4.11,;19.23,-5.52,;17.69,-5.68,;15.9,-10.68,;14.57,-9.9,;14.57,-8.36,;13.23,-10.67,;13.23,-12.2,;14.55,-12.98,;14.54,-14.52,;15.86,-15.31,;17.21,-14.55,;18.52,-15.32,;17.21,-13,;15.89,-12.21,;11.89,-9.88,;10.57,-10.63,;10.55,-12.18,;9.23,-9.84,;9.23,-8.33,;10.58,-7.57,;7.89,-10.61,;6.54,-9.84,;6.58,-8.31,;5.22,-10.58,;5.2,-12.15,;6.53,-12.92,;7.95,-12.31,;8.98,-13.46,;8.2,-14.78,;8.66,-16.25,;7.62,-17.39,;6.1,-17.07,;5.65,-15.6,;6.69,-14.46,;3.89,-9.83,;2.54,-10.58,;2.51,-12.14,;1.23,-9.78,;-.15,-10.52,;-.18,-12.07,;-1.53,-12.81,;-2.84,-12.02,;-4.2,-12.76,;-2.81,-10.45,;-1.44,-9.74,)|
CCNC(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](CO)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)CCc1ccc(F)cc1 |wU:58.64,12.20,wD:31.44,23.28,5.4,64.81,45.48,(29.62,-3.96,;29.63,-5.48,;28.31,-6.27,;26.96,-5.51,;25.67,-6.27,;26.93,-4,;28.15,-3.12,;27.64,-1.68,;26.09,-1.68,;25.67,-3.13,;24.36,-3.87,;24.35,-5.41,;23.03,-3.12,;23.04,-1.58,;24.38,-.81,;24.39,.73,;25.73,1.48,;25.74,3.01,;27.06,3.78,;24.41,3.79,;21.69,-3.87,;20.37,-3.1,;20.37,-1.55,;19.02,-3.84,;19.02,-5.38,;20.34,-6.17,;21.68,-5.4,;20.33,-7.7,;17.7,-3.07,;16.37,-3.83,;16.35,-5.35,;15.05,-3.06,;15.06,-1.52,;14.58,-.06,;13.13,.42,;13.13,1.96,;14.6,2.43,;15.22,3.83,;16.76,3.99,;17.66,2.75,;17.02,1.34,;15.48,1.18,;13.71,-3.81,;12.38,-3.03,;12.38,-1.49,;11.04,-3.79,;11.04,-5.32,;12.36,-6.11,;13.7,-5.35,;15.03,-6.12,;15.02,-7.66,;16.34,-8.44,;13.68,-8.43,;12.35,-7.65,;9.72,-3,;9.72,-1.46,;8.39,-3.76,;8.37,-5.32,;7.05,-2.99,;7.08,-1.46,;8.4,-.71,;5.72,-3.74,;4.38,-2.97,;4.42,-1.45,;3.06,-3.73,;3.06,-5.27,;4.37,-6.08,;5.74,-5.34,;7.05,-6.12,;6.99,-7.66,;5.64,-8.4,;5.64,-9.95,;4.29,-10.69,;2.97,-9.91,;2.99,-8.36,;4.34,-7.62,;1.74,-2.97,;.4,-3.71,;.43,-5.24,;-.99,-3,;-2.4,-3.97,;-3.94,-3.23,;-5.36,-4.19,;-6.9,-3.45,;-7.03,-1.74,;-8.55,-.91,;-5.62,-.77,;-4.07,-1.51,)|
CCNC(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1ccc(O)cc1 |wU:57.63,12.20,wD:45.57,31.44,23.28,5.4,63.79,(30.69,-11.38,;30.69,-12.94,;29.38,-13.72,;28.04,-12.95,;26.72,-13.72,;28,-11.44,;29.22,-10.55,;28.71,-9.11,;27.17,-9.13,;26.74,-10.57,;25.41,-11.32,;25.4,-12.85,;24.09,-10.55,;24.1,-9.01,;25.43,-8.24,;25.44,-6.7,;26.79,-5.94,;26.79,-4.4,;28.13,-3.65,;25.46,-3.63,;22.75,-11.32,;21.41,-10.54,;21.43,-8.98,;20.06,-11.28,;20.06,-12.84,;21.4,-13.62,;21.37,-15.16,;22.72,-12.85,;18.74,-10.52,;17.4,-11.27,;17.39,-12.81,;16.08,-10.48,;16.09,-8.95,;15.61,-7.49,;14.16,-7.01,;14.16,-5.46,;15.63,-5,;16.25,-3.6,;17.79,-3.44,;18.68,-4.69,;18.06,-6.1,;16.53,-6.26,;14.74,-11.25,;13.4,-10.47,;13.4,-8.94,;12.05,-11.22,;12.05,-12.78,;13.39,-13.56,;14.71,-12.79,;16.06,-13.58,;16.05,-15.13,;17.37,-15.9,;14.7,-15.89,;13.37,-15.1,;10.74,-10.45,;9.4,-11.21,;9.38,-12.76,;8.07,-10.42,;8.08,-8.9,;9.42,-8.15,;6.73,-11.19,;5.39,-10.42,;5.41,-8.88,;4.05,-11.18,;4.05,-12.73,;5.36,-13.49,;6.79,-12.89,;7.81,-14.04,;7.03,-15.35,;7.49,-16.83,;6.45,-17.97,;4.94,-17.65,;4.48,-16.17,;5.52,-15.03,;2.73,-10.41,;1.39,-11.18,;1.36,-12.73,;.06,-10.38,;-1.3,-11.09,;-2.59,-10.32,;-3.96,-11.05,;-3.99,-12.62,;-5.35,-13.36,;-2.68,-13.4,;-1.33,-12.66,)|
CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC(=O)N1 |wU:88.94,63.67,31.32,45.48,23.24,wD:5.4,77.83,57.61,12.13,(36.44,8.14,;34.94,7.83,;34.46,6.38,;32.95,6.07,;31.92,7.22,;32.47,4.61,;33.37,3.36,;32.44,2.11,;30.99,2.61,;30.99,4.14,;29.68,4.91,;29.62,6.47,;28.37,4.08,;28.43,2.53,;29.81,1.83,;29.87,.29,;31.25,-.44,;31.32,-1.99,;32.69,-2.69,;30.02,-2.82,;26.99,4.81,;25.69,3.97,;25.76,2.41,;24.33,4.68,;24.25,6.23,;25.54,7.06,;26.92,6.35,;25.48,8.6,;23.01,3.84,;21.63,4.56,;21.57,6.12,;20.32,3.73,;20.41,2.18,;21.76,1.47,;23.3,1.54,;23.85,.09,;22.66,-.87,;22.56,-2.4,;21.21,-3.08,;19.9,-2.25,;20,-.71,;21.38,-.02,;18.96,4.45,;17.66,3.62,;17.72,2.06,;16.28,4.33,;16.22,5.86,;17.52,6.71,;18.9,5.99,;20.19,6.83,;20.13,8.36,;21.44,9.2,;18.75,9.08,;17.43,8.25,;14.97,3.49,;13.59,4.21,;13.52,5.75,;12.3,3.37,;12.37,1.83,;13.74,1.12,;10.92,4.1,;9.61,3.27,;9.68,1.71,;8.23,3.97,;8.17,5.51,;7.08,6.61,;5.53,6.54,;4.97,7.98,;6.17,8.95,;6.25,10.48,;7.62,11.19,;8.91,10.35,;8.83,8.81,;7.47,8.11,;6.94,3.14,;5.56,3.84,;5.48,5.38,;4.26,3.01,;4.32,1.47,;5.7,.77,;6.98,1.6,;8.35,.9,;8.43,-.64,;7.13,-1.48,;5.77,-.77,;2.88,3.73,;1.57,2.89,;1.63,1.34,;.22,3.62,;.21,5.16,;-1.26,5.62,;-2.16,4.37,;-3.7,4.36,;-1.25,3.14,)|
[H][C@]1(CCC(=O)N1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r|
CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r|
CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)O[C@@H]1[C@@H](CO)O[C@@H](n2ccc(N)nc2=O)C1(F)F)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r|
CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCCCNC(=O)CCC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CCCCNC(=O)CCCC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O |r|
Cc1cc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c(o1)C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccoc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc4cnoc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccccc3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
COc1cccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 |r|
CC1CCCN(C1)c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
Cc1c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(=O)n(C[C@H](N)c2ccccc2OCC(O)=O)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1cncc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 |r|
Cc1c(N2CCN(Cc3ccncc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc(cc3)C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(n3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1ccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cn1 |r|
Cc1c(N2CCN(Cc3cccc(c3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
COc1cccc(N2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(O)=O)c3ccccc3)c2=O)c1F |r|
Cc1c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(=O)n(C[C@H](NCCCP(O)(O)=O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
COC(=O)c1ccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)o1 |r|
Cc1c(N2CCN(Cc3cscn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(CC2)c2ccccc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3cccc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc(O)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccc(cc3)[N+]([O-])=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1ccccc1CN1CCN(CC1)c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
Cc1c(N2CCCC(C2)c2ccccc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(=O)n(C[C@H](N)c2ccccc2OCCCC(O)=O)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
CCOP(O)(=O)CCCN[C@@H](Cn1c(=O)c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 |r|
Cc1c(N2CCN(Cc3ccco3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(c3)C(=O)NCCC(O)=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(=O)n(C[C@H](NCCCS(O)(=O)=O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc(Cl)nc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3nccs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3nc4ccccc4s3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCNCC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(CC2)c2ccccn2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccccn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3cccnc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccc(=O)[nH]c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccncn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cnccn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc(nc3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccnc3C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccnc3Cl)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cncc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccnc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccnc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(C(N)=O)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(C#N)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(c3F)[N+]([O-])=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(c3)S(C)(=O)=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
C[S+]([O-])c1cccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 |r|
CCNC(=O)c1cccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 |r|
Cc1c(N2CCN(Cc3cccc(c3)C(N)=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
COC(=O)c1cccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 |r|
Cc1c(N2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccccc3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(c3)C(=O)NCC(O)=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(CC2)S(=O)(=O)c2ccccc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(CCCc3ccccc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(CC(=O)c3ccccc3Cl)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(CC2)C(=O)OCc2ccccc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCNC(C2)c2ccccc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3cccc(c3)C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccccc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(F)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
COc1ccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 |r|
Cc1c(N2CCN(Cc3ccc(cc3)C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1ccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 |r|
Cc1c(N2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3cccc(Cl)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3cccc(c3)C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3cccc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccccc3C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccccc3Cl)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
COc1ccccc1CN1CCN(CC1)c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
Cc1c(N2CCN(Cc3ccccc3[N+]([O-])=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCC(Cc3ccccc3)C2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCc3ccccc3C2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCC(Cc3ccccc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
CC1CCN(CC1)c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
Cc1c(N2CCCCC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCNC(CCO)C2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN[C@H](Cc3ccccc3)C2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3cccc(c3)C(=O)NCCCC(O)=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3nnc(o3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cc(co3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc(o3)C(N)=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc(Cl)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc(o3)C(C)(C)C)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1ccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)o1 |r|
Cc1c(N2CCN(Cc3cocn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccon3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(c3)C(F)(F)F)CC2)c(=O)n(C[C@H](NCCCC(O)=O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc(o3)C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc(o3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc4cccnc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc4nonc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc4ccsc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccc[nH]c3=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1ncccc1CN1CCN(CC1)c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
Cc1c(N2CCN(Cc3cccc(c3)C(O)=O)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
CC(=O)c1cccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 |r|
Cc1c(N2CCN(Cc3ccc(F)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3cccc(c3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccccc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCC(C2)c2ccccc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
CC1CCCCN1c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
Cc1c(N2CCN[C@@H](Cc3ccccc3)C2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccc(s3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cncs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc4occc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(CC3CCCCC3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(CCc3ccccc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(CC3COc4ccccc4O3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
COC(=O)c1ccccc1CN1CCN(CC1)c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |r|
Cc1c(N2CCN(Cc3cccc(c3F)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccccc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccc(Cl)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3ccccc3OC(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCCC(Cc3ccccc3)C2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1c(N2CCN(Cc3cccc(=O)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(c3)-c3ncco3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3ccnc(c3)C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(F)c3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
Cc1c(N2CCN(Cc3cccc(F)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r|
CNC(=O)c1cccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 |r|
Cc1c(N2CCN(CC2)C(=O)c2ccccc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |r|
Cc1cccc(CN2CCN(CC2)c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 |r|
COc1ccc(cc1)S(=O)(=O)N1C(C)C(C)(C)c2cc(ccc12)C(=O)NCc1ccccc1Cl
Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncccc1Cl
Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ccccn1
Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(cc1F)C(F)(F)F
Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(F)cc1Cl
Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ccc(cn1)C(F)(F)F
Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(cc1Cl)C(F)(F)F
CC1N(c2ccc(NC(=O)c3cccnc3)cc2C11CCOCC1)S(=O)(=O)c1ccc(F)cc1
Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCSCC2)c2cc(NC(=O)c3cccnc3)ccc12
OC1(CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1)C(F)(F)F |(57.14,-3.38,;56.05,-4.48,;57.14,-5.57,;56.75,-7.05,;55.26,-7.46,;54.16,-6.38,;54.56,-4.89,;56.19,-8.7,;57.73,-8.68,;59.07,-9.43,;59.05,-7.89,;55.29,-9.96,;53.81,-9.5,;52.47,-10.28,;51.14,-9.51,;51.14,-7.98,;49.8,-7.21,;48.47,-7.99,;48.48,-9.53,;47.13,-7.22,;47.13,-5.69,;45.8,-4.92,;44.47,-5.7,;44.48,-7.25,;45.82,-8.01,;52.46,-7.2,;53.8,-7.96,;55.78,-11.42,;57.27,-11.01,;56.87,-12.5,;54.77,-12.58,;53.26,-12.28,;52.24,-13.44,;52.74,-14.9,;51.73,-16.06,;54.27,-15.19,;55.27,-14.03,;55.64,-2.99,;56.73,-1.89,;54.15,-2.59,;55.24,-1.49,)|
OC1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1 |(36.16,-32.54,;35.77,-34.03,;36.86,-35.12,;36.47,-36.6,;34.98,-37.01,;33.89,-35.93,;34.29,-34.44,;35.91,-38.25,;37.45,-38.23,;38.8,-38.98,;38.77,-37.44,;35.02,-39.51,;33.54,-39.05,;32.2,-39.83,;30.86,-39.06,;30.86,-37.52,;29.53,-36.76,;28.2,-37.54,;28.2,-39.08,;26.86,-36.77,;26.86,-35.24,;25.52,-34.47,;24.19,-35.25,;24.2,-36.8,;25.54,-37.55,;32.18,-36.75,;33.52,-37.5,;35.51,-40.97,;36.99,-40.56,;36.6,-42.05,;34.49,-42.13,;32.98,-41.83,;31.97,-42.99,;32.47,-44.45,;31.46,-45.61,;33.99,-44.74,;35,-43.58,)|
Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(NC(=O)c3cccnc3)ccc12
[O-][S+]1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1 |(35.81,-1.68,;35.41,-3.17,;36.5,-4.27,;36.11,-5.75,;34.63,-6.15,;33.53,-5.08,;33.93,-3.59,;35.55,-7.39,;37.09,-7.37,;38.44,-8.13,;38.42,-6.58,;34.66,-8.66,;33.18,-8.2,;31.84,-8.97,;30.51,-8.21,;30.51,-6.67,;29.17,-5.91,;27.84,-6.68,;27.85,-8.22,;26.5,-5.92,;26.5,-4.38,;25.17,-3.62,;23.83,-4.39,;23.85,-5.94,;25.18,-6.7,;31.83,-5.89,;33.16,-6.65,;35.15,-10.11,;36.63,-9.71,;36.24,-11.2,;34.14,-11.27,;32.63,-10.97,;31.61,-12.13,;32.11,-13.59,;31.1,-14.76,;33.63,-13.89,;34.64,-12.72,)|
Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=N)(=O)CC2)c2cc(NC(=O)c3cccnc3)ccc12
CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ncccc1Cl)S(=O)(=O)c1ccc(F)cc1
COc1ccc(cc1)S(=O)(=O)N1C(C)C2(CCN(CC2)C(C)=O)c2cc(ccc12)C(=O)NCc1ccccc1Cl
CC1N(c2ccc(cc2C11CCNCC1)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1
CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccc(F)c3)cc21)S(=O)(=O)c1ccc(F)cc1
CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NC1(CC1)c1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NC1(CC1)c1ccc(Cl)cc1)S(=O)(=O)c1ccc(F)cc1
CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NCc1ccc(F)cc1Cl)S(=O)(=O)c1ccc(F)cc1
CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NCc1ccccc1)S(=O)(=O)c1ccc(F)cc1
CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(cc1)C(F)(F)F
CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1cccnc1
CC1N(Cc2ccc(F)cc2)c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ccccc1Cl
CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccccc1
CC(=O)N1CCC2(CC1)C(CCO)N(c1ccc(cc21)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
CC(=O)N1CCC2(CC1)C(CC=C)N(c1ccc(cc21)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
CC(=O)N1CCC2(CN(c3ccc(cc23)C(=O)NCc2ccccc2Cl)S(=O)(=O)c2ccc(F)cc2)CC1
CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
COc1ccc(cc1)S(=O)(=O)N1C(C)Cc2cc(ccc12)C(=O)NCc1ccccc1Cl
CC1N(c2ccc(cc2C1(C)C)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccccc1
CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ccccc1Cl)S(C)(=O)=O
CC1N(C(=O)c2ccc(F)cc2)c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ccccc1Cl
Fc1ccc(cc1)S(=O)(=O)N1[C@@H](C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(cc1Cl)C(F)(F)F
CC(C)CC(NC(=O)C(CCCCNC(=O)\C=N\OCC(=O)OCC1OC(n2ccc(N)nc2=O)C(F)(F)C1O)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)C(Cc1cc2ccccc2[nH]1)NC(=O)C(Cc1c[nH]cn1)NC(=O)C1CCC(=O)N1)C(=O)NC(CCCNC(N)=N)C(=O)N1CCCC1C(=O)NCC(N)=O
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3cccc(OC)c3F)c(=O)c2c1CN(C)C |(11.24,-3.73,;9.7,-3.73,;8.93,-2.39,;7.39,-2.39,;6.62,-3.73,;6.62,-1.06,;5.08,-1.06,;4.31,.27,;2.77,.27,;2,-1.06,;2.77,-2.39,;4.31,-2.39,;.46,-1.06,;-.44,.19,;-1.91,-.29,;-3.24,.48,;-3.24,2.02,;-2.15,3.11,;-.66,2.71,;-.26,1.22,;.42,3.8,;.02,5.28,;-1.46,5.68,;-2.55,4.6,;-4.04,4.99,;-4.57,-.29,;-5.91,.48,;-4.57,-1.83,;-5.91,-2.6,;-5.91,-4.14,;-7.24,-4.91,;-8.57,-4.14,;-8.58,-2.61,;-9.91,-1.84,;-11.24,-2.61,;-7.25,-1.83,;-7.25,-.29,;-3.24,-2.6,;-3.24,-4.14,;-1.91,-1.83,;-.44,-2.31,;-.04,-3.79,;1.44,-4.19,;1.84,-5.68,;2.53,-3.1,)|
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC(F)F)nn3)c(=O)c2c1CN(C)C
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OCC(F)(F)F)nn3)c(=O)c2c1CN(C)C
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OCC(F)(F)F)cc3)c(=O)c2c1CN(C)C
CCc1ccc(nn1)-n1c(=O)n(Cc2c(F)cccc2F)c2sc(c(CN(C)C)c2c1=O)-c1ccc(NC(=O)NOC)cc1
CONC(=O)Nc1ccc(cc1)-c1sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccc(OC)nn3)c(=O)c2c1CN(C)CCOC(F)(F)F