1320 SMILES Strings for Histone-arginine methyltransferase CARM1

Compound Name
SMILES String
Brc1cccc(NC(=O)CCN2CCc3ccccc3C2)c1C#N
C1CN=C(N1)c1cc2cc(ccc2o1)-c1cc2ccc(cc2[nH]1)C1=NCCN1 |c:2,t:28|
CC(=O)Nc1ccc(cc1)N=Nc1c(O)c2ccc(NC(=O)Nc3ccc4c(O)c(N=Nc5ccccc5)c(cc4c3)S(O)(=O)=O)cc2cc1S(O)(=O)=O |w:31.32,11.12|
CC(C)(N)C(=O)NCc1cccc(c1)-n1nc(cc1C(=O)Nc1ccc(cc1F)-c1ccccc1S(C)(=O)=O)C(F)(F)F
CC(C)N(CCCNC(=O)Nc1ccc(cc1)C(C)(C)C)CC1=C[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r,t:23|
CC(C)N(CCCNC(=O)Nc1ccc(cc1)C(C)(C)C)C[C@@H]1C[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
CC(C)N(CCCNC(=O)Nc1ccc(cc1)C(C)(C)C)C[C@H]1C[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
CC(C)N(CCCNC(=O)Nc1ccc(cc1)C(C)(C)C)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
CC(C)N(CCCNC(=O)Nc1ccc(cc1)C(C)(C)C)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCC=C)ncnc12 |r|
CC(C)N(CCCNC(=O)Nc1ccc(cc1)C(C)(C)C)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccccc3)ncnc12 |r|
CC(C)Oc1ccc(cc1)-c1c[nH]cc1CN(C)CCN
CC(C)Oc1ccccc1CNC(=O)c1cc(nn1-c1ccc(CNC(=O)[C@H](C)N)s1)C(F)(F)F |r|
CC(C)c1ccc(OCCNCCN)cc1C
CC(C)n1ncc2c(cc(cc12)-c1ccc(nc1)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
CC(CNC(=O)Nc1ccc(cc1)C(C)(C)C)CN(C)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
CC(Cc1c[nH]c2ccccc12)NC(=O)CN
CC(N)C(=O)NCc1ccc(Oc2ccccc2F)c(F)c1
CC(N)C(=O)NCc1ccccc1
CC(N)C(=O)Nc1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1)C(F)(F)F
CCC(=O)NC1CN(C1)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(10.95,1.12,;9.61,1.89,;9.61,3.43,;10.95,4.2,;8.28,4.2,;6.94,3.43,;6.55,1.94,;5.06,2.34,;5.46,3.83,;3.72,1.57,;2.39,2.34,;1.06,1.57,;1.06,.03,;2.39,-.74,;2.39,-2.28,;3.64,-3.19,;5.12,-2.79,;3.16,-4.65,;1.62,-4.65,;1.15,-3.19,;-.34,-2.79,;3.72,.03,;5.06,-.74,;-.28,2.34,;-.28,3.88,;-1.61,4.65,;-2.94,3.88,;-2.94,2.34,;-4.28,1.57,;-5.61,2.34,;-6.94,1.57,;-6.94,.03,;-8.28,2.34,;-9.61,1.57,;-10.95,2.34,;-1.61,1.57,)|
CCC(=O)Nc1cccc(c1)-c1c[nH]cc1CN(C)CCN
CCC(C)(C)c1ccc(COC2CCN(CCNC)CC2)cc1
CCC1(CNc2nc(nc(-c3c(C)noc3C)c2C)-c2cccc(OCC(O)CNC)c2)CCOCC1 |(9.34,.03,;8,.8,;8,2.34,;6.67,1.57,;5.33,2.34,;4,1.57,;2.67,2.34,;1.33,1.57,;1.33,.03,;2.67,-.74,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,;4,.03,;5.33,-.74,;,2.34,;,3.88,;-1.33,4.65,;-2.67,3.88,;-2.67,2.34,;-4,1.57,;-5.33,2.34,;-6.67,1.57,;-6.67,.03,;-8,2.34,;-9.34,1.57,;-10.67,2.34,;-1.33,1.57,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,)|
CCCCOc1nc(nc(-c2c(C)noc2C)c1C)-c1ccc(F)c(OCC(O)CNC)c1 |(10.67,2.34,;9.34,1.57,;8,2.34,;6.67,1.57,;5.33,2.34,;4,1.57,;2.67,2.34,;1.33,1.57,;1.33,.03,;2.67,-.74,;2.67,-2.28,;1.42,-3.19,;-.07,-2.79,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.4,-2.79,;4,.03,;5.33,-.74,;,2.34,;,3.88,;-1.33,4.65,;-2.67,3.88,;-4,4.65,;-2.67,2.34,;-4,1.57,;-5.33,2.34,;-6.67,1.57,;-6.67,.03,;-8,2.34,;-9.34,1.57,;-10.67,2.34,;-1.33,1.57,)|
CCCN[C@@H](CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(C)CC1
CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccnc(c1)N1CCN(C)CC1
CCN(C1CCOCC1)c1nc(nc(NC2CCOCC2)c1C)-c1cccc(OCC(O)CNC)c1
CCN(CC)c1nc(nc(N2CCOCC2)c1C)-c1cccc(OCC(O)CNC)c1
CCN([C@@H]1CCOC1)c1nc(nc(N2CCOCC2)c1C)-c1cccc(OCC(O)CNC)c1 |r|
CCN1CCC(Nc2nc(nc(-c3c(C)noc3C)c2C)-c2cc(OC[C@H](O)CNC)ccc2Cl)C(F)(F)C1 |r,wD:26.28,(11.34,.03,;10,-.74,;8.67,.03,;7.34,-.74,;6,.03,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;.75,-3.19,;-.71,-2.71,;1.23,-4.65,;2.77,-4.65,;3.25,-3.19,;4.71,-2.71,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,;7.34,2.34,;6.57,3.67,;8.11,3.67,;8.67,1.57,)|
CCN1CCC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@@H](O)CNC)ccc1Cl |r,wU:28.31,6.7,(10.98,-.17,;9.49,.23,;9.1,1.71,;10.13,2.86,;9.36,4.19,;7.85,3.87,;7.69,2.34,;6.36,1.57,;5.02,2.34,;3.69,1.57,;2.35,2.34,;1.02,1.57,;1.02,.03,;2.35,-.74,;2.35,-2.28,;3.6,-3.19,;5.09,-2.79,;3.12,-4.65,;1.58,-4.65,;1.11,-3.19,;-.38,-2.79,;3.69,.03,;5.02,-.74,;-.31,2.34,;-1.65,1.57,;-2.98,2.34,;-4.31,1.57,;-5.65,2.34,;-6.98,1.57,;-6.98,.03,;-8.31,2.34,;-9.65,1.57,;-10.98,2.34,;-2.98,3.88,;-1.65,4.65,;-.31,3.88,;1.02,4.65,)|
CCN1CCC[C@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@@H](O)CNC)ccc1Cl |r,wU:28.31,wD:6.7,(10.98,-.17,;9.49,.23,;9.1,1.71,;10.13,2.86,;9.36,4.19,;7.85,3.87,;7.69,2.34,;6.36,1.57,;5.02,2.34,;3.69,1.57,;2.35,2.34,;1.02,1.57,;1.02,.03,;2.35,-.74,;2.35,-2.28,;3.6,-3.19,;5.09,-2.79,;3.12,-4.65,;1.58,-4.65,;1.11,-3.19,;-.38,-2.79,;3.69,.03,;5.02,-.74,;-.31,2.34,;-1.65,1.57,;-2.98,2.34,;-4.31,1.57,;-5.65,2.34,;-6.98,1.57,;-6.98,.03,;-8.31,2.34,;-9.65,1.57,;-10.98,2.34,;-2.98,3.88,;-1.65,4.65,;-.31,3.88,;1.02,4.65,)|
CCN1CCN(CC1)c1cc(nc(n1)-c1cccc(OCC(O)CNC)c1)-c1c(C)noc1C
CCN1CCN(CC1)c1nc(nc(NC2CCOCC2)c1C)-c1cccc(OCC(O)CNC)c1
CCNC(=O)N1CCN(CC1)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12,3.11,;10.67,3.88,;9.34,3.11,;8,3.88,;8,5.42,;6.67,3.11,;6.67,1.57,;5.33,.8,;4,1.57,;4,3.11,;5.33,3.88,;2.67,.8,;1.33,1.57,;,.8,;,-.74,;1.33,-1.51,;1.33,-3.05,;.09,-3.96,;-1.38,-3.48,;.56,-5.42,;2.1,-5.42,;2.58,-3.96,;4.04,-3.48,;2.67,-.74,;4,-1.51,;-1.33,1.57,;-1.33,3.11,;-2.67,3.88,;-4,3.11,;-4,1.57,;-5.33,.8,;-6.67,1.57,;-8,.8,;-8,-.74,;-9.34,1.57,;-10.67,.8,;-12,1.57,;-2.67,.8,)|
CCNC(=O)[C@@H](C)N |r|
CCNCCN1CCC(Cc2ccccc2)CC1
CCNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1OC)C(F)(F)F
CCNc1nc(nc(NC2CCOCC2)c1C)-c1cccc(OCC(O)CNC)c1
CCOC(=O)N1CC(C1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12.28,.48,;10.95,-.29,;9.61,.48,;8.28,-.29,;8.28,-1.83,;6.94,.48,;5.46,.08,;5.06,1.57,;6.55,1.97,;3.72,2.34,;2.39,1.57,;1.06,2.34,;-.28,1.57,;-.28,.03,;1.06,-.74,;1.06,-2.28,;-.19,-3.19,;-1.65,-2.71,;.29,-4.65,;1.83,-4.65,;2.3,-3.19,;3.77,-2.71,;2.39,.03,;3.72,-.74,;-1.61,2.34,;-1.61,3.88,;-2.94,4.65,;-4.28,3.88,;-4.28,2.34,;-5.61,1.57,;-6.94,2.34,;-8.28,1.57,;-8.28,.03,;-9.61,2.34,;-10.95,1.57,;-12.28,2.34,;-2.94,1.57,)|
CCOC(=O)N1CC2(C1)CCCN(C2)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12.95,1.25,;11.61,.48,;10.28,1.25,;8.95,.48,;8.95,-1.06,;7.61,1.25,;6.12,.85,;5.73,2.34,;7.21,2.74,;5.73,3.88,;4.39,4.65,;3.06,3.88,;3.06,2.34,;4.39,1.57,;1.72,1.57,;.39,2.34,;-.94,1.57,;-.94,.03,;.39,-.74,;.39,-2.28,;1.64,-3.19,;3.1,-2.71,;1.16,-4.65,;-.38,-4.65,;-.86,-3.19,;-2.32,-2.71,;1.72,.03,;3.06,-.74,;-2.28,2.34,;-2.28,3.88,;-3.61,4.65,;-4.94,3.88,;-4.94,2.34,;-6.28,1.57,;-7.61,2.34,;-8.95,1.57,;-8.95,.03,;-10.28,2.34,;-11.61,1.57,;-12.95,2.34,;-3.61,1.57,)|
CCOC(=O)N1CCC(C1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12.34,-1.09,;11.4,.13,;9.87,-.03,;8.97,1.21,;9.59,2.62,;7.43,1.05,;6.66,-.28,;5.16,.04,;5,1.57,;6.4,2.2,;3.66,2.34,;2.33,1.57,;1,2.34,;-.34,1.57,;-.34,.03,;1,-.74,;1,-2.28,;2.24,-3.19,;3.71,-2.71,;1.77,-4.65,;.23,-4.65,;-.25,-3.19,;-1.71,-2.71,;2.33,.03,;3.66,-.74,;-1.67,2.34,;-1.67,3.88,;-3.01,4.65,;-4.34,3.88,;-4.34,2.34,;-5.67,1.57,;-7.01,2.34,;-8.34,1.57,;-8.34,.03,;-9.67,2.34,;-11.01,1.57,;-12.34,2.34,;-3.01,1.57,)|
CCOC(=O)N1CCC(CC1)N(C)c1cc(nc(n1)-c1cccc(OCC(O)CNC)c1)-c1c(C)noc1C
CCOC(=O)N1CCC(CC1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@@H](O)CNC)ccc1Cl |r,wU:31.34,(12.67,.03,;11.34,-.74,;10,.03,;8.67,-.74,;8.67,-2.28,;7.34,.03,;6,-.74,;4.67,.03,;4.67,1.57,;6,2.34,;7.34,1.57,;3.33,2.34,;2,1.57,;.67,2.34,;-.67,1.57,;-.67,.03,;.67,-.74,;.67,-2.28,;-.58,-3.19,;-2.04,-2.71,;-.1,-4.65,;1.44,-4.65,;1.91,-3.19,;3.38,-2.71,;2,.03,;3.33,-.74,;-2,2.34,;-3.33,1.57,;-4.67,2.34,;-6,1.57,;-7.34,2.34,;-8.67,1.57,;-8.67,.03,;-10,2.34,;-11.34,1.57,;-12.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-.67,4.65,)|
CCOC(=O)N1CCC(CC1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wD:31.34,(12.67,.03,;11.34,-.74,;10,.03,;8.67,-.74,;8.67,-2.28,;7.34,.03,;6,-.74,;4.67,.03,;4.67,1.57,;6,2.34,;7.34,1.57,;3.33,2.34,;2,1.57,;.67,2.34,;-.67,1.57,;-.67,.03,;.67,-.74,;.67,-2.28,;-.58,-3.19,;-2.04,-2.71,;-.1,-4.65,;1.44,-4.65,;1.91,-3.19,;3.38,-2.71,;2,.03,;3.33,-.74,;-2,2.34,;-3.33,1.57,;-4.67,2.34,;-6,1.57,;-7.34,2.34,;-8.67,1.57,;-8.67,.03,;-10,2.34,;-11.34,1.57,;-12.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-.67,4.65,)|
CCOC(=O)N1CCC(CC1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12.67,.03,;11.34,-.74,;10,.03,;8.67,-.74,;8.67,-2.28,;7.34,.03,;6,-.74,;4.67,.03,;4.67,1.57,;6,2.34,;7.34,1.57,;3.33,2.34,;2,1.57,;.67,2.34,;-.67,1.57,;-.67,.03,;.67,-.74,;.67,-2.28,;1.91,-3.19,;3.38,-2.71,;1.44,-4.65,;-.1,-4.65,;-.58,-3.19,;-2.04,-2.71,;2,.03,;3.33,-.74,;-2,2.34,;-2,3.88,;-3.33,4.65,;-4.67,3.88,;-4.67,2.34,;-6,1.57,;-7.34,2.34,;-8.67,1.57,;-8.67,.03,;-10,2.34,;-11.34,1.57,;-12.67,2.34,;-3.33,1.57,)|
CCOC(=O)N1CCC(CNc2nc(nc(-c3c(C)noc3C)c2C)-c2cccc(OCC(O)CNC)c2)CC1 |(13.34,3.11,;12,3.88,;10.67,3.11,;9.34,3.88,;9.34,5.42,;8,3.11,;6.67,3.88,;5.33,3.11,;5.33,1.57,;4,.8,;2.67,1.57,;1.33,.8,;,1.57,;-1.33,.8,;-1.33,-.74,;,-1.51,;,-3.05,;1.25,-3.96,;2.71,-3.48,;.77,-5.42,;-.77,-5.42,;-1.25,-3.96,;-2.71,-3.48,;1.33,-.74,;2.67,-1.51,;-2.67,1.57,;-2.67,3.11,;-4,3.88,;-5.33,3.11,;-5.33,1.57,;-6.67,.8,;-8,1.57,;-9.34,.8,;-9.34,-.74,;-10.67,1.57,;-12,.8,;-13.34,1.57,;-4,.8,;6.67,.8,;8,1.57,)|
CCOC(=O)N1CCC2(CN(C2)c2nc(nc(-c3c(C)noc3C)c2C)-c2cc(OC[C@H](O)CNC)ccc2Cl)C1 |r,wD:31.34,(12.32,.5,;11.7,1.9,;10.16,2.06,;9.54,3.47,;10.44,4.72,;8.01,3.63,;7.24,4.97,;5.73,4.65,;5.57,3.11,;5.17,1.63,;3.68,2.02,;4.08,3.51,;2.35,1.25,;1.02,2.02,;-.32,1.25,;-.32,-.29,;1.02,-1.06,;1.02,-2.6,;2.26,-3.5,;3.73,-3.02,;1.79,-4.97,;.25,-4.97,;-.23,-3.5,;-1.7,-3.02,;2.35,-.29,;3.68,-1.06,;-1.65,2.02,;-2.99,1.25,;-4.32,2.02,;-5.65,1.25,;-6.99,2.02,;-8.32,1.25,;-8.32,-.29,;-9.65,2.02,;-10.99,1.25,;-12.32,2.02,;-4.32,3.56,;-2.99,4.33,;-1.65,3.56,;-.32,4.33,;6.98,2.49,)|
CCOC(=O)N1CCC2(CN(C2)c2nc(nc(-c3c(C)noc3C)c2C)-c2cc(OC[C@H](O)CNC)ccc2Cl)CC1 |r,wD:31.34,(12.95,3.65,;11.61,4.42,;10.28,3.65,;8.95,4.42,;8.95,5.96,;7.61,3.65,;7.61,2.11,;6.28,1.34,;4.94,2.11,;4.55,.63,;3.06,1.03,;3.46,2.51,;1.72,.26,;.39,1.03,;-.94,.26,;-.94,-1.28,;.39,-2.05,;.39,-3.59,;1.64,-4.5,;3.1,-4.02,;1.16,-5.96,;-.38,-5.96,;-.86,-4.5,;-2.32,-4.02,;1.72,-1.28,;3.06,-2.05,;-2.28,1.03,;-3.61,.26,;-4.94,1.03,;-6.28,.26,;-7.61,1.03,;-8.95,.26,;-8.95,-1.28,;-10.28,1.03,;-11.61,.26,;-12.95,1.03,;-4.94,2.57,;-3.61,3.34,;-2.28,2.57,;-.94,3.34,;4.94,3.65,;6.28,4.42,)|
CCOC(=O)N1CCC2(CN(C2)c2nc(nc(-c3c(C)noc3C)c2C)-c2cc(OC[C@H](O)CNC)ccc2F)CC1 |r,wD:31.34,(12.95,3.65,;11.61,4.42,;10.28,3.65,;8.95,4.42,;8.95,5.96,;7.61,3.65,;7.61,2.11,;6.28,1.34,;4.94,2.11,;4.55,.63,;3.06,1.03,;3.46,2.51,;1.72,.26,;.39,1.03,;-.94,.26,;-.94,-1.28,;.39,-2.05,;.39,-3.59,;1.64,-4.5,;3.1,-4.02,;1.16,-5.96,;-.38,-5.96,;-.86,-4.5,;-2.32,-4.02,;1.72,-1.28,;3.06,-2.05,;-2.28,1.03,;-3.61,.26,;-4.94,1.03,;-6.28,.26,;-7.61,1.03,;-8.95,.26,;-8.95,-1.28,;-10.28,1.03,;-11.61,.26,;-12.95,1.03,;-4.94,2.57,;-3.61,3.34,;-2.28,2.57,;-.94,3.34,;4.94,3.65,;6.28,4.42,)|
CCOC(=O)N1CCCC(C1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12.67,1.57,;11.34,2.34,;10,1.57,;8.67,2.34,;8.67,3.88,;7.34,1.57,;7.34,.03,;6,-.74,;4.67,.03,;4.67,1.57,;6,2.34,;3.33,2.34,;2,1.57,;.67,2.34,;-.67,1.57,;-.67,.03,;.67,-.74,;.67,-2.28,;1.91,-3.19,;3.38,-2.71,;1.44,-4.65,;-.1,-4.65,;-.58,-3.19,;-2.04,-2.71,;2,.03,;3.33,-.74,;-2,2.34,;-2,3.88,;-3.33,4.65,;-4.67,3.88,;-4.67,2.34,;-6,1.57,;-7.34,2.34,;-8.67,1.57,;-8.67,.03,;-10,2.34,;-11.34,1.57,;-12.67,2.34,;-3.33,1.57,)|
CCOC(=O)N1CCCC(CNc2nc(nc(-c3c(C)noc3C)c2C)-c2cccc(OCC(O)CNC)c2)C1 |(13.34,2.34,;12,1.57,;10.67,2.34,;9.34,1.57,;9.34,.03,;8,2.34,;8,3.88,;6.67,4.65,;5.33,3.88,;5.33,2.34,;4,1.57,;2.67,2.34,;1.33,1.57,;,2.34,;-1.33,1.57,;-1.33,.03,;,-.74,;,-2.28,;1.25,-3.19,;2.71,-2.71,;.77,-4.65,;-.77,-4.65,;-1.25,-3.19,;-2.71,-2.71,;1.33,.03,;2.67,-.74,;-2.67,2.34,;-2.67,3.88,;-4,4.65,;-5.33,3.88,;-5.33,2.34,;-6.67,1.57,;-8,2.34,;-9.34,1.57,;-9.34,.03,;-10.67,2.34,;-12,1.57,;-13.34,2.34,;-4,1.57,;6.67,1.57,)|
CCOC(=O)N1CCCCC1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@@H](O)CNC)ccc1Cl |r,wU:32.35,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCCCC1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wD:32.35,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCCC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:10.11,wD:32.35,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCCC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1Cl)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:10.11,wD:32.35,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCC[C@@H]1CCNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wD:32.35,9.10,(8.63,5.96,;9.67,4.81,;9.19,3.35,;10.22,2.2,;11.73,2.52,;9.74,.74,;10.65,-.51,;9.74,-1.75,;8.28,-1.28,;8.28,.26,;6.95,1.03,;5.61,.26,;4.28,1.03,;2.94,.26,;1.61,1.03,;.28,.26,;.28,-1.28,;1.61,-2.05,;1.61,-3.59,;2.86,-4.49,;4.19,-3.72,;2.38,-5.96,;.84,-5.96,;.36,-4.49,;-.97,-3.72,;2.94,-1.28,;4.28,-2.05,;-1.06,1.03,;-2.39,.26,;-3.72,1.03,;-5.06,.26,;-6.39,1.03,;-7.73,.26,;-7.73,-1.28,;-9.06,1.03,;-10.39,.26,;-11.73,1.03,;-3.72,2.57,;-2.39,3.34,;-1.06,2.57,;.28,3.34,)|
CCOC(=O)N1CCC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@@H](O)CNC)ccc1Cl |r,wU:31.34,9.10,(11.93,-2.06,;10.44,-1.66,;10.04,-.17,;8.55,.23,;7.46,-.86,;8.15,1.71,;9.18,2.86,;8.41,4.19,;6.91,3.87,;6.75,2.34,;5.41,1.57,;4.08,2.34,;2.75,1.57,;1.41,2.34,;.08,1.57,;.08,.03,;1.41,-.74,;1.41,-2.28,;2.66,-3.19,;4.14,-2.79,;2.18,-4.65,;.64,-4.65,;.17,-3.19,;-1.32,-2.79,;2.75,.03,;4.08,-.74,;-1.26,2.34,;-2.59,1.57,;-3.92,2.34,;-5.26,1.57,;-6.59,2.34,;-7.92,1.57,;-7.92,.03,;-9.26,2.34,;-10.59,1.57,;-11.93,2.34,;-3.92,3.88,;-2.59,4.65,;-1.26,3.88,;.08,4.65,)|
CCOC(=O)N1CCC[C@@H]1COc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:9.10,wD:31.34,(12.05,-1.71,;10.54,-1.39,;10.07,.08,;8.56,.4,;7.53,-.74,;8.09,1.86,;8.99,3.11,;8.09,4.36,;6.62,3.88,;6.62,2.34,;5.29,1.57,;3.95,2.34,;2.62,1.57,;1.29,2.34,;-.05,1.57,;-.05,.03,;1.29,-.74,;1.29,-2.28,;2.53,-3.19,;3.87,-2.42,;2.06,-4.65,;.52,-4.65,;.04,-3.19,;-1.29,-2.42,;2.62,.03,;3.95,-.74,;-1.38,2.34,;-2.71,1.57,;-4.05,2.34,;-5.38,1.57,;-6.72,2.34,;-8.05,1.57,;-8.05,.03,;-9.38,2.34,;-10.72,1.57,;-12.05,2.34,;-4.05,3.88,;-2.71,4.65,;-1.38,3.88,;-.05,4.65,)|
CCOC(=O)N1CCC[C@H]1CCNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:9.10,wD:32.35,(8.63,5.96,;9.67,4.81,;9.19,3.35,;10.22,2.2,;11.73,2.52,;9.74,.74,;10.65,-.51,;9.74,-1.75,;8.28,-1.28,;8.28,.26,;6.95,1.03,;5.61,.26,;4.28,1.03,;2.94,.26,;1.61,1.03,;.28,.26,;.28,-1.28,;1.61,-2.05,;1.61,-3.59,;2.86,-4.49,;4.19,-3.72,;2.38,-5.96,;.84,-5.96,;.36,-4.49,;-.97,-3.72,;2.94,-1.28,;4.28,-2.05,;-1.06,1.03,;-2.39,.26,;-3.72,1.03,;-5.06,.26,;-6.39,1.03,;-7.73,.26,;-7.73,-1.28,;-9.06,1.03,;-10.39,.26,;-11.73,1.03,;-3.72,2.57,;-2.39,3.34,;-1.06,2.57,;.28,3.34,)|
CCOC(=O)N1CCC[C@H]1CCOc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:9.10,wD:32.35,(8.17,5.96,;9.31,4.93,;8.99,3.42,;10.13,2.39,;11.6,2.87,;9.81,.89,;10.84,-.26,;10.07,-1.59,;8.57,-1.27,;8.41,.26,;7.07,1.03,;5.74,.26,;4.41,1.03,;3.07,.26,;1.74,1.03,;.4,.26,;.4,-1.28,;1.74,-2.05,;1.74,-3.59,;2.98,-4.5,;4.45,-4.02,;2.51,-5.96,;.97,-5.96,;.49,-4.5,;-.97,-4.02,;3.07,-1.28,;4.41,-2.05,;-.93,1.03,;-2.26,.26,;-3.6,1.03,;-4.93,.26,;-6.26,1.03,;-7.6,.26,;-7.6,-1.28,;-8.93,1.03,;-10.26,.26,;-11.6,1.03,;-3.6,2.57,;-2.26,3.34,;-.93,2.57,;.4,3.34,)|
CCOC(=O)N1CCN(CC1)c1cc(nc(n1)-c1cccc(OCC(O)CNC)c1)-c1c(C)noc1C
CCOC(=O)N1CCN(CC1)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12,3.11,;10.67,3.88,;9.34,3.11,;8,3.88,;8,5.42,;6.67,3.11,;6.67,1.57,;5.33,.8,;4,1.57,;4,3.11,;5.33,3.88,;2.67,.8,;1.33,1.57,;,.8,;,-.74,;1.33,-1.51,;1.33,-3.05,;.09,-3.96,;-1.38,-3.48,;.56,-5.42,;2.1,-5.42,;2.58,-3.96,;4.04,-3.48,;2.67,-.74,;4,-1.51,;-1.33,1.57,;-1.33,3.11,;-2.67,3.88,;-4,3.11,;-4,1.57,;-5.33,.8,;-6.67,1.57,;-8,.8,;-8,-.74,;-9.34,1.57,;-10.67,.8,;-12,1.57,;-2.67,.8,)|
CCOC(=O)N1CCN(CC1)c1nc(nc(NC2CCOCC2)c1C)-c1cccc(OCC(O)CNC)c1
CCOC(=O)N1CCN(CC1)c1nc(nc(N[C@@H]2CCOC2)c1C)-c1cccc(OCC(O)CNC)c1 |r|
CCOC(=O)N1CCN(C[C@H]1C)c1nc(nc(N[C@@H]2CCOC2)c1C)-c1cccc(OCC(O)CNC)c1 |r|
CCOC(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OCC(O)CNC)ccc1Cl |r,wU:10.11,(12,-.74,;10.67,.03,;9.34,-.74,;8,.03,;6.67,-.74,;8,1.57,;9.34,2.34,;9.34,3.88,;8,4.65,;6.67,3.88,;6.67,2.34,;5.33,1.57,;4,2.34,;2.67,1.57,;1.33,2.34,;,1.57,;,.03,;1.33,-.74,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,;2.67,.03,;4,-.74,;-1.33,2.34,;-2.67,1.57,;-4,2.34,;-5.33,1.57,;-6.67,2.34,;-8,1.57,;-8,.03,;-9.34,2.34,;-10.67,1.57,;-12,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,)|
CCOC(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@@H](O)CNC)ccc1Cl |r,wU:32.35,10.11,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@@H](O)CNC)ccc1F |r,wU:32.35,10.11,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:10.11,wD:32.35,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1F |r,wU:10.11,wD:32.35,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |r,wU:10.11,(12,-.74,;10.67,.03,;9.34,-.74,;8,.03,;6.67,-.74,;8,1.57,;9.34,2.34,;9.34,3.88,;8,4.65,;6.67,3.88,;6.67,2.34,;5.33,1.57,;4,2.34,;2.67,1.57,;1.33,2.34,;,1.57,;,.03,;1.33,-.74,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,;2.67,.03,;4,-.74,;-1.33,2.34,;-1.33,3.88,;-2.67,4.65,;-4,3.88,;-4,2.34,;-5.33,1.57,;-6.67,2.34,;-8,1.57,;-8,.03,;-9.34,2.34,;-10.67,1.57,;-12,2.34,;-2.67,1.57,)|
CCOC(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OC[C@@H](O)CNC)c1 |r,wU:34.37,10.11,(12,-.74,;10.67,.03,;9.34,-.74,;8,.03,;6.67,-.74,;8,1.57,;9.34,2.34,;9.34,3.88,;8,4.65,;6.67,3.88,;6.67,2.34,;5.33,1.57,;4,2.34,;2.67,1.57,;1.33,2.34,;,1.57,;,.03,;1.33,-.74,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,;2.67,.03,;4,-.74,;-1.33,2.34,;-1.33,3.88,;-2.67,4.65,;-4,3.88,;-4,2.34,;-5.33,1.57,;-6.67,2.34,;-8,1.57,;-8,.03,;-9.34,2.34,;-10.67,1.57,;-12,2.34,;-2.67,1.57,)|
CCOC(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OC[C@H](O)CNC)c1 |r,wU:10.11,wD:34.37,(12,-.74,;10.67,.03,;9.34,-.74,;8,.03,;6.67,-.74,;8,1.57,;9.34,2.34,;9.34,3.88,;8,4.65,;6.67,3.88,;6.67,2.34,;5.33,1.57,;4,2.34,;2.67,1.57,;1.33,2.34,;,1.57,;,.03,;1.33,-.74,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,;2.67,.03,;4,-.74,;-1.33,2.34,;-1.33,3.88,;-2.67,4.65,;-4,3.88,;-4,2.34,;-5.33,1.57,;-6.67,2.34,;-8,1.57,;-8,.03,;-9.34,2.34,;-10.67,1.57,;-12,2.34,;-2.67,1.57,)|
CCOC(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1Cl)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:10.11,wD:32.35,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)nsc2C)c1C)-c1cc(OCC(O)CNC)ccc1Cl |r,wU:10.11,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.71,-2.71,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.71,-2.71,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCOC[C@@H]1COc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:10.11,wD:32.35,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCOC[C@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@@H](O)CNC)ccc1Cl |r,wU:32.35,wD:10.11,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCOC[C@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@@H](O)CNC)ccc1F |r,wU:32.35,wD:10.11,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCOC[C@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wD:32.35,10.11,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CCOC[C@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1F |r,wD:32.35,10.11,(11.34,-3.05,;10,-2.28,;10,-.74,;8.67,.03,;7.34,-.74,;8.67,1.57,;10,2.34,;10,3.88,;8.67,4.65,;7.34,3.88,;7.34,2.34,;6,1.57,;4.67,2.34,;3.33,1.57,;2,2.34,;.67,1.57,;.67,.03,;2,-.74,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,;3.33,.03,;4.67,-.74,;-.67,2.34,;-2,1.57,;-3.33,2.34,;-4.67,1.57,;-6,2.34,;-7.34,1.57,;-7.34,.03,;-8.67,2.34,;-10,1.57,;-11.34,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,)|
CCOC(=O)N1CC[C@@H](C1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:8.10,wD:30.33,(11.39,-4.05,;9.9,-3.66,;9.5,-2.17,;8.02,-1.77,;6.93,-2.86,;7.62,-.28,;8.39,1.05,;7.36,2.2,;5.95,1.57,;6.11,.04,;4.62,2.34,;3.28,1.57,;1.95,2.34,;.61,1.57,;.61,.03,;1.95,-.74,;1.95,-2.28,;3.19,-3.19,;4.68,-2.79,;2.72,-4.65,;1.18,-4.65,;.7,-3.19,;-.79,-2.79,;3.28,.03,;4.62,-.74,;-.72,2.34,;-2.05,1.57,;-3.39,2.34,;-4.72,1.57,;-6.05,2.34,;-7.39,1.57,;-7.39,.03,;-8.72,2.34,;-10.05,1.57,;-11.39,2.34,;-3.39,3.88,;-2.05,4.65,;-.72,3.88,;.61,4.65,)|
CCOC(=O)N1CC[C@@H](C1)Nc1nc(nc(-c2c(C)noc2C)c1Cl)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:8.10,wD:30.33,(11.39,-4.05,;9.9,-3.66,;9.5,-2.17,;8.02,-1.77,;6.93,-2.86,;7.62,-.28,;8.39,1.05,;7.36,2.2,;5.95,1.57,;6.11,.04,;4.62,2.34,;3.28,1.57,;1.95,2.34,;.61,1.57,;.61,.03,;1.95,-.74,;1.95,-2.28,;3.19,-3.19,;4.68,-2.79,;2.72,-4.65,;1.18,-4.65,;.7,-3.19,;-.79,-2.79,;3.28,.03,;4.62,-.74,;-.72,2.34,;-2.05,1.57,;-3.39,2.34,;-4.72,1.57,;-6.05,2.34,;-7.39,1.57,;-7.39,.03,;-8.72,2.34,;-10.05,1.57,;-11.39,2.34,;-3.39,3.88,;-2.05,4.65,;-.72,3.88,;.61,4.65,)|
CCOC(=O)N1CC[C@@H](Nc2nc(nc(-c3c(C)noc3C)c2C)-c2cccc(OCC(O)CNC)c2)[C@@H](F)C1 |r,wU:8.8,37.40,(12.67,.03,;11.34,-.74,;10,.03,;8.67,-.74,;8.67,-2.28,;7.34,.03,;6,-.74,;4.67,.03,;4.67,1.57,;3.33,2.34,;2,1.57,;.67,2.34,;-.67,1.57,;-.67,.03,;.67,-.74,;.67,-2.28,;-.58,-3.19,;-2.04,-2.71,;-.1,-4.65,;1.44,-4.65,;1.91,-3.19,;3.38,-2.71,;2,.03,;3.33,-.74,;-2,2.34,;-2,3.88,;-3.33,4.65,;-4.67,3.88,;-4.67,2.34,;-6,1.57,;-7.34,2.34,;-8.67,1.57,;-8.67,.03,;-10,2.34,;-11.34,1.57,;-12.67,2.34,;-3.33,1.57,;6,2.34,;6,3.88,;7.34,1.57,)|
CCOC(=O)N1CC[C@@H](Nc2nc(nc(-c3c(C)noc3C)c2C)-c2cccc(OCC(O)CNC)c2)[C@H](F)C1 |r,wU:8.8,wD:37.40,(12.67,.03,;11.34,-.74,;10,.03,;8.67,-.74,;8.67,-2.28,;7.34,.03,;6,-.74,;4.67,.03,;4.67,1.57,;3.33,2.34,;2,1.57,;.67,2.34,;-.67,1.57,;-.67,.03,;.67,-.74,;.67,-2.28,;-.58,-3.19,;-2.04,-2.71,;-.1,-4.65,;1.44,-4.65,;1.91,-3.19,;3.38,-2.71,;2,.03,;3.33,-.74,;-2,2.34,;-2,3.88,;-3.33,4.65,;-4.67,3.88,;-4.67,2.34,;-6,1.57,;-7.34,2.34,;-8.67,1.57,;-8.67,.03,;-10,2.34,;-11.34,1.57,;-12.67,2.34,;-3.33,1.57,;6,2.34,;6,3.88,;7.34,1.57,)|
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CCOC(=O)N1CC[C@H](C1)Nc1nc(nc(-c2c(C)noc2C)c1Cl)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wD:8.10,30.33,(11.38,-4.02,;9.88,-3.7,;9.4,-2.23,;7.89,-1.91,;6.86,-3.05,;7.42,-.45,;8.32,.8,;7.42,2.05,;5.95,1.57,;5.95,.03,;4.62,2.34,;3.29,1.57,;1.95,2.34,;.62,1.57,;.62,.03,;1.95,-.74,;1.95,-2.28,;3.2,-3.19,;4.53,-2.42,;2.72,-4.65,;1.18,-4.65,;.71,-3.19,;-.63,-2.42,;3.29,.03,;4.62,-.74,;-.71,2.34,;-2.05,1.57,;-3.38,2.34,;-4.72,1.57,;-6.05,2.34,;-7.38,1.57,;-7.38,.03,;-8.72,2.34,;-10.05,1.57,;-11.38,2.34,;-3.38,3.88,;-2.05,4.65,;-.71,3.88,;.62,4.65,)|
CCOC(=O)c1sc(nc1C)-c1cc(nc(n1)-c1cccc(OCC(O)CNC)c1)N(C)C1CCOCC1
CCOCC1(COCC)CCC(CC1)c1c(CN(C)CCNC)nn2CCCc12
CCO[C@@H]1CCC[C@@H]1N(CC)c1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wD:30.33,7.8,3.2,(10.42,5.17,;10.1,3.66,;8.64,3.19,;8.32,1.68,;9.35,.53,;8.58,-.8,;7.07,-.48,;6.91,1.05,;5.58,1.82,;5.58,3.36,;4.25,4.13,;4.25,1.05,;2.91,1.82,;1.58,1.05,;1.58,-.49,;2.91,-1.26,;2.91,-2.8,;1.67,-3.7,;.2,-3.23,;2.14,-5.17,;3.68,-5.17,;4.16,-3.7,;5.62,-3.23,;4.25,-.49,;5.58,-1.26,;.24,1.82,;-1.09,1.05,;-2.42,1.82,;-3.76,1.05,;-5.09,1.82,;-6.42,1.05,;-6.42,-.49,;-7.76,1.82,;-9.09,1.05,;-10.42,1.82,;-2.42,3.36,;-1.09,4.13,;.24,3.36,;1.58,4.13,)|
CCO[C@@H]1CCC[C@@H]1Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:7.8,3.2,wD:28.31,(10.25,1.53,;8.79,2,;8.46,3.51,;7,3.99,;6.52,5.45,;4.98,5.45,;4.51,3.99,;5.75,3.08,;5.75,1.54,;4.42,.77,;3.09,1.54,;1.75,.77,;1.75,-.77,;3.09,-1.54,;3.09,-3.08,;4.33,-3.99,;5.8,-3.51,;3.86,-5.45,;2.32,-5.45,;1.84,-3.99,;.38,-3.51,;4.42,-.77,;5.75,-1.54,;.42,1.54,;-.91,.77,;-2.25,1.54,;-3.58,.77,;-4.91,1.54,;-6.25,.77,;-6.25,-.77,;-7.58,1.54,;-8.92,.77,;-10.25,1.54,;-2.25,3.08,;-.91,3.85,;.42,3.08,;1.75,3.85,)|
CCO[C@@H]1CCC[C@H]1N(CC)c1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:7.8,wD:30.33,3.2,(10.42,5.17,;10.1,3.66,;8.64,3.19,;8.32,1.68,;9.35,.53,;8.58,-.8,;7.07,-.48,;6.91,1.05,;5.58,1.82,;5.58,3.36,;4.25,4.13,;4.25,1.05,;2.91,1.82,;1.58,1.05,;1.58,-.49,;2.91,-1.26,;2.91,-2.8,;1.67,-3.7,;.2,-3.23,;2.14,-5.17,;3.68,-5.17,;4.16,-3.7,;5.62,-3.23,;4.25,-.49,;5.58,-1.26,;.24,1.82,;-1.09,1.05,;-2.42,1.82,;-3.76,1.05,;-5.09,1.82,;-6.42,1.05,;-6.42,-.49,;-7.76,1.82,;-9.09,1.05,;-10.42,1.82,;-2.42,3.36,;-1.09,4.13,;.24,3.36,;1.58,4.13,)|
CCO[C@@H]1CCC[C@H]1Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:3.2,wD:28.31,7.8,(10.25,1.53,;8.79,2,;8.46,3.51,;7,3.99,;6.52,5.45,;4.98,5.45,;4.51,3.99,;5.75,3.08,;5.75,1.54,;4.42,.77,;3.09,1.54,;1.75,.77,;1.75,-.77,;3.09,-1.54,;3.09,-3.08,;4.33,-3.99,;5.8,-3.51,;3.86,-5.45,;2.32,-5.45,;1.84,-3.99,;.38,-3.51,;4.42,-.77,;5.75,-1.54,;.42,1.54,;-.91,.77,;-2.25,1.54,;-3.58,.77,;-4.91,1.54,;-6.25,.77,;-6.25,-.77,;-7.58,1.54,;-8.92,.77,;-10.25,1.54,;-2.25,3.08,;-.91,3.85,;.42,3.08,;1.75,3.85,)|
CCO[C@@H]1CCC[C@H]1Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1F |r,wU:3.2,wD:28.31,7.8,(10.31,1.7,;8.82,2.1,;8.43,3.59,;6.94,3.99,;6.46,5.45,;4.92,5.45,;4.45,3.99,;5.69,3.08,;5.69,1.54,;4.36,.77,;3.02,1.54,;1.69,.77,;1.69,-.77,;3.02,-1.54,;3.02,-3.08,;4.27,-3.99,;5.76,-3.59,;3.79,-5.45,;2.25,-5.45,;1.78,-3.99,;.29,-3.59,;4.36,-.77,;5.69,-1.54,;.36,1.54,;-.98,.77,;-2.31,1.54,;-3.64,.77,;-4.98,1.54,;-6.31,.77,;-6.31,-.77,;-7.64,1.54,;-8.98,.77,;-10.31,1.54,;-2.31,3.08,;-.98,3.85,;.36,3.08,;1.69,3.85,)|
CCO[C@H]1CCC[C@@H]1Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:3.2,wD:28.31,7.8,(10.42,5.17,;10.1,3.66,;8.64,3.19,;8.32,1.68,;9.35,.53,;8.58,-.8,;7.07,-.48,;6.91,1.05,;5.58,1.82,;4.25,1.05,;2.91,1.82,;1.58,1.05,;1.58,-.49,;2.91,-1.26,;2.91,-2.8,;1.67,-3.7,;.2,-3.23,;2.14,-5.17,;3.68,-5.17,;4.16,-3.7,;5.62,-3.23,;4.25,-.49,;5.58,-1.26,;.24,1.82,;-1.09,1.05,;-2.42,1.82,;-3.76,1.05,;-5.09,1.82,;-6.42,1.05,;-6.42,-.49,;-7.76,1.82,;-9.09,1.05,;-10.42,1.82,;-2.42,3.36,;-1.09,4.13,;.24,3.36,;1.58,4.13,)|
CCO[C@H]1CCC[C@H]1N(CC)c1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wU:7.8,3.2,wD:30.33,(10.42,5.17,;10.1,3.66,;8.64,3.19,;8.32,1.68,;9.35,.53,;8.58,-.8,;7.07,-.48,;6.91,1.05,;5.58,1.82,;5.58,3.36,;4.25,4.13,;4.25,1.05,;2.91,1.82,;1.58,1.05,;1.58,-.49,;2.91,-1.26,;2.91,-2.8,;1.67,-3.7,;.2,-3.23,;2.14,-5.17,;3.68,-5.17,;4.16,-3.7,;5.62,-3.23,;4.25,-.49,;5.58,-1.26,;.24,1.82,;-1.09,1.05,;-2.42,1.82,;-3.76,1.05,;-5.09,1.82,;-6.42,1.05,;-6.42,-.49,;-7.76,1.82,;-9.09,1.05,;-10.42,1.82,;-2.42,3.36,;-1.09,4.13,;.24,3.36,;1.58,4.13,)|
CCO[C@H]1CCC[C@H]1Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CNC)ccc1Cl |r,wD:28.31,7.8,3.2,(10.25,1.53,;8.79,2,;8.46,3.51,;7,3.99,;6.52,5.45,;4.98,5.45,;4.51,3.99,;5.75,3.08,;5.75,1.54,;4.42,.77,;3.09,1.54,;1.75,.77,;1.75,-.77,;3.09,-1.54,;3.09,-3.08,;4.33,-3.99,;5.8,-3.51,;3.86,-5.45,;2.32,-5.45,;1.84,-3.99,;.38,-3.51,;4.42,-.77,;5.75,-1.54,;.42,1.54,;-.91,.77,;-2.25,1.54,;-3.58,.77,;-4.91,1.54,;-6.25,.77,;-6.25,-.77,;-7.58,1.54,;-8.92,.77,;-10.25,1.54,;-2.25,3.08,;-.91,3.85,;.42,3.08,;1.75,3.85,)|
CCOc1ccccc1CNC(=O)c1cc(nn1-c1cccc(CNCCNC)c1)C(F)(F)F
CCS(=O)(=O)N1CC(C1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(11.61,-.29,;10.28,-1.06,;8.95,-.29,;9.72,1.04,;8.18,-1.62,;7.61,.48,;6.12,.08,;5.73,1.57,;7.21,1.97,;4.39,2.34,;3.06,1.57,;1.72,2.34,;.39,1.57,;.39,.03,;1.72,-.74,;1.72,-2.28,;2.97,-3.19,;4.43,-2.71,;2.49,-4.65,;.95,-4.65,;.48,-3.19,;-.99,-2.71,;3.06,.03,;4.39,-.74,;-.94,2.34,;-.94,3.88,;-2.28,4.65,;-3.61,3.88,;-3.61,2.34,;-4.94,1.57,;-6.28,2.34,;-7.61,1.57,;-7.61,.03,;-8.95,2.34,;-10.28,1.57,;-11.61,2.34,;-2.28,1.57,)|
CCS(=O)(=O)N1CC2(C1)CCCN(C2)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12.28,.48,;10.95,-.29,;9.61,.48,;10.38,1.81,;8.84,-.85,;8.28,1.25,;6.79,.85,;6.39,2.34,;7.88,2.74,;6.39,3.88,;5.06,4.65,;3.72,3.88,;3.72,2.34,;5.06,1.57,;2.39,1.57,;1.06,2.34,;-.28,1.57,;-.28,.03,;1.06,-.74,;1.06,-2.28,;2.3,-3.19,;3.77,-2.71,;1.83,-4.65,;.29,-4.65,;-.19,-3.19,;-1.65,-2.71,;2.39,.03,;3.72,-.74,;-1.61,2.34,;-1.61,3.88,;-2.94,4.65,;-4.28,3.88,;-4.28,2.34,;-5.61,1.57,;-6.94,2.34,;-8.28,1.57,;-8.28,.03,;-9.61,2.34,;-10.95,1.57,;-12.28,2.34,;-2.94,1.57,)|
CCS(=O)(=O)N1CC2(C1)CCN(CC2)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12.28,4.53,;10.95,5.3,;9.61,4.53,;8.84,5.86,;10.38,3.19,;8.28,3.76,;7.88,2.27,;6.39,2.67,;6.79,4.16,;6.39,1.13,;5.06,.36,;3.72,1.13,;3.72,2.67,;5.06,3.44,;2.39,.36,;1.06,1.13,;-.28,.36,;-.28,-1.18,;1.06,-1.95,;1.06,-3.49,;2.3,-4.4,;3.77,-3.92,;1.83,-5.86,;.29,-5.86,;-.19,-4.4,;-1.65,-3.92,;2.39,-1.18,;3.72,-1.95,;-1.61,1.13,;-1.61,2.67,;-2.94,3.44,;-4.28,2.67,;-4.28,1.13,;-5.61,.36,;-6.94,1.13,;-8.28,.36,;-8.28,-1.18,;-9.61,1.13,;-10.95,.36,;-12.28,1.13,;-2.94,.36,)|
CCS(=O)(=O)N1CC2(CN(C2)c2nc(nc(-c3c(C)noc3C)c2C)-c2cccc(OCC(O)CNC)c2)C1 |(11.89,4.3,;10.56,5.07,;9.22,4.3,;8.45,5.64,;9.99,2.97,;7.89,3.53,;7.49,2.04,;6,2.44,;5.6,.96,;4.12,1.35,;4.51,2.84,;2.78,.58,;1.45,1.35,;.11,.58,;.11,-.96,;1.45,-1.73,;1.45,-3.27,;2.69,-4.17,;4.18,-3.77,;2.22,-5.64,;.68,-5.64,;.2,-4.17,;-1.29,-3.77,;2.78,-.96,;4.12,-1.73,;-1.22,1.35,;-1.22,2.89,;-2.55,3.66,;-3.89,2.89,;-3.89,1.35,;-5.22,.58,;-6.55,1.35,;-7.89,.58,;-7.89,-.96,;-9.22,1.35,;-10.56,.58,;-11.89,1.35,;-2.55,.58,;6.4,3.93,)|
CCS(=O)(=O)N1CCC(C1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(11.6,3.1,;11.2,1.61,;9.71,1.21,;9.31,2.7,;10.11,-.27,;8.18,1.05,;7.41,-.28,;5.9,.04,;5.74,1.57,;7.15,2.2,;4.41,2.34,;3.07,1.57,;1.74,2.34,;.41,1.57,;.41,.03,;1.74,-.74,;1.74,-2.28,;2.99,-3.19,;4.45,-2.71,;2.51,-4.65,;.97,-4.65,;.49,-3.19,;-.97,-2.71,;3.07,.03,;4.41,-.74,;-.93,2.34,;-.93,3.88,;-2.26,4.65,;-3.59,3.88,;-3.59,2.34,;-4.93,1.57,;-6.26,2.34,;-7.6,1.57,;-7.6,.03,;-8.93,2.34,;-10.26,1.57,;-11.6,2.34,;-2.26,1.57,)|
CCS(=O)(=O)N1CCC(CC1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@@H](O)CNC)ccc1Cl |r,wU:31.34,(12,-.74,;10.67,-1.51,;9.34,-.74,;10.11,.59,;8.57,-2.07,;8,.03,;8,1.57,;6.67,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;4,2.34,;2.67,1.57,;1.33,2.34,;,1.57,;,.03,;1.33,-.74,;1.33,-2.28,;.09,-3.19,;-1.4,-2.79,;.56,-4.65,;2.1,-4.65,;2.58,-3.19,;4.07,-2.79,;2.67,.03,;4,-.74,;-1.33,2.34,;-2.67,1.57,;-4,2.34,;-5.33,1.57,;-6.67,2.34,;-8,1.57,;-8,.03,;-9.34,2.34,;-10.67,1.57,;-12,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,)|
CCS(=O)(=O)N1CCC(CC1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12,-.74,;10.67,-1.51,;9.34,-.74,;10.11,.59,;8.57,-2.07,;8,.03,;6.67,-.74,;5.33,.03,;5.33,1.57,;6.67,2.34,;8,1.57,;4,2.34,;2.67,1.57,;1.33,2.34,;,1.57,;,.03,;1.33,-.74,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,;2.67,.03,;4,-.74,;-1.33,2.34,;-1.33,3.88,;-2.67,4.65,;-4,3.88,;-4,2.34,;-5.33,1.57,;-6.67,2.34,;-8,1.57,;-8,.03,;-9.34,2.34,;-10.67,1.57,;-12,2.34,;-2.67,1.57,)|
CCS(=O)(=O)N1CCC(CC1)Nc1nc(nc(-c2c(C)nsc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12,-.74,;10.67,-1.51,;9.34,-.74,;10.11,.59,;8.57,-2.07,;8,.03,;6.67,-.74,;5.33,.03,;5.33,1.57,;6.67,2.34,;8,1.57,;4,2.34,;2.67,1.57,;1.33,2.34,;,1.57,;,.03,;1.33,-.74,;1.33,-2.28,;.09,-3.19,;-1.4,-2.79,;.56,-4.65,;2.1,-4.65,;2.58,-3.19,;4.07,-2.79,;2.67,.03,;4,-.74,;-1.33,2.34,;-1.33,3.88,;-2.67,4.65,;-4,3.88,;-4,2.34,;-5.33,1.57,;-6.67,2.34,;-8,1.57,;-8,.03,;-9.34,2.34,;-10.67,1.57,;-12,2.34,;-2.67,1.57,)|
CCS(=O)(=O)N1CCC(CNc2nc(nc(-c3c(C)noc3C)c2C)-c2cccc(OCC(O)CNC)c2)CC1 |(12.67,3.98,;11.34,4.75,;10,3.98,;9.23,5.32,;10.77,2.65,;8.67,3.21,;7.34,3.98,;6,3.21,;6,1.67,;4.67,.9,;3.33,1.67,;2,.9,;.67,1.67,;-.67,.9,;-.67,-.64,;.67,-1.41,;.67,-2.95,;1.91,-3.85,;3.38,-3.38,;1.44,-5.32,;-.1,-5.32,;-.58,-3.85,;-2.04,-3.38,;2,-.64,;3.33,-1.41,;-2,1.67,;-2,3.21,;-3.33,3.98,;-4.67,3.21,;-4.67,1.67,;-6,.9,;-7.34,1.67,;-8.67,.9,;-8.67,-.64,;-10,1.67,;-11.34,.9,;-12.67,1.67,;-3.33,.9,;7.34,.9,;8.67,1.67,)|
CCS(=O)(=O)N1CCCC(C1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |(12,2.34,;10.67,3.11,;9.34,2.34,;8.57,3.67,;10.11,1.01,;8,1.57,;8,.03,;6.67,-.74,;5.33,.03,;5.33,1.57,;6.67,2.34,;4,2.34,;2.67,1.57,;1.33,2.34,;,1.57,;,.03,;1.33,-.74,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,;2.67,.03,;4,-.74,;-1.33,2.34,;-1.33,3.88,;-2.67,4.65,;-4,3.88,;-4,2.34,;-5.33,1.57,;-6.67,2.34,;-8,1.57,;-8,.03,;-9.34,2.34,;-10.67,1.57,;-12,2.34,;-2.67,1.57,)|
CCS(=O)(=O)N1CCCC(CNc2nc(nc(-c3c(C)noc3C)c2C)-c2cccc(OCC(O)CNC)c2)C1 |(10.57,6.57,;9.23,5.8,;9.23,4.26,;10.77,4.26,;7.69,4.26,;9.23,2.72,;10.57,1.95,;10.57,.41,;9.23,-.36,;7.9,.41,;6.57,-.36,;5.23,.41,;3.9,-.36,;2.56,.41,;1.23,-.36,;1.23,-1.9,;2.56,-2.67,;2.56,-4.21,;3.81,-5.11,;5.27,-4.63,;3.33,-6.57,;1.79,-6.57,;1.32,-5.11,;-.15,-4.63,;3.9,-1.9,;5.23,-2.67,;-.1,.41,;-.1,1.95,;-1.44,2.72,;-2.77,1.95,;-2.77,.41,;-4.1,-.36,;-5.44,.41,;-6.77,-.36,;-6.77,-1.9,;-8.11,.41,;-9.44,-.36,;-10.77,.41,;-1.44,-.36,;7.9,1.95,)|
CCS(=O)(=O)N1CCN(CC1(C)C)c1nc(nc(NC2CCOC2)c1C)-c1cccc(OCC(O)CNC)c1
CCS(=O)(=O)N1CCN(CC1)c1nc(nc(NC2CCOCC2)c1C)-c1cccc(OCC(O)CNC)c1
CCS(=O)(=O)N1CCN(CC1)c1nc(nc(N[C@@H]2CCOC2)c1C)-c1cccc(OCC(O)CNC)c1 |r|
CCS(=O)(=O)N1CCN(C[C@@H]1C)c1cc(nc(n1)-c1cccc(OCC(O)CNC)c1)N(C)C1CCOCC1 |r|
CCS(=O)(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |r,wU:10.11,(7.74,-1.91,;9.23,-1.51,;9.23,.03,;10.77,.03,;7.69,.03,;9.23,1.57,;10.57,2.34,;10.57,3.88,;9.23,4.65,;7.9,3.88,;7.9,2.34,;6.57,1.57,;5.23,2.34,;3.9,1.57,;2.56,2.34,;1.23,1.57,;1.23,.03,;2.56,-.74,;2.56,-2.28,;1.32,-3.19,;-.15,-2.71,;1.79,-4.65,;3.33,-4.65,;3.81,-3.19,;5.27,-2.71,;3.9,.03,;5.23,-.74,;-.1,2.34,;-.1,3.88,;-1.44,4.65,;-2.77,3.88,;-2.77,2.34,;-4.1,1.57,;-5.44,2.34,;-6.77,1.57,;-6.77,.03,;-8.11,2.34,;-9.44,1.57,;-10.77,2.34,;-1.44,1.57,)|
CCS(=O)(=O)N1CCOC[C@@H]1CNc1nc(nc(-c2c(C)nsc2C)c1C)-c1cccc(OCC(O)CNC)c1 |r,wU:10.11,(10.57,-2.28,;9.23,-1.51,;9.23,.03,;10.77,.03,;7.69,.03,;9.23,1.57,;10.57,2.34,;10.57,3.88,;9.23,4.65,;7.9,3.88,;7.9,2.34,;6.57,1.57,;5.23,2.34,;3.9,1.57,;2.56,2.34,;1.23,1.57,;1.23,.03,;2.56,-.74,;2.56,-2.28,;3.81,-3.19,;5.3,-2.79,;3.33,-4.65,;1.79,-4.65,;1.32,-3.19,;-.17,-2.79,;3.9,.03,;5.23,-.74,;-.1,2.34,;-.1,3.88,;-1.44,4.65,;-2.77,3.88,;-2.77,2.34,;-4.1,1.57,;-5.44,2.34,;-6.77,1.57,;-6.77,.03,;-8.11,2.34,;-9.44,1.57,;-10.77,2.34,;-1.44,1.57,)|
CCS(=O)(=O)n1cc(-c2cc(nc(n2)-c2cccc(OCC(O)CNC)c2)N(C)C2CCOCC2)c2cncnc12
CC[C@@H]1CN(CCN1S(=O)(=O)CC)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |r,wD:2.1,(10.67,1.18,;9.34,.41,;8,1.18,;6.67,.41,;5.33,1.18,;5.33,2.72,;6.67,3.49,;8,2.72,;9.34,3.49,;8.57,4.83,;10.11,2.16,;10.67,4.26,;10.67,5.8,;4,.41,;2.67,1.18,;1.33,.41,;1.33,-1.13,;2.67,-1.9,;2.67,-3.44,;1.42,-4.34,;-.04,-3.86,;1.9,-5.8,;3.44,-5.8,;3.91,-4.34,;5.38,-3.86,;4,-1.13,;5.33,-1.9,;,1.18,;,2.72,;-1.33,3.49,;-2.67,2.72,;-2.67,1.18,;-4,.41,;-5.33,1.18,;-6.67,.41,;-6.67,-1.13,;-8,1.18,;-9.34,.41,;-10.67,1.18,;-1.33,.41,)|
CC[C@@H]1CN(CCN1S(C)(=O)=O)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |r,wD:2.1,(10.67,1.67,;9.34,.9,;8,1.67,;6.67,.9,;5.33,1.67,;5.33,3.21,;6.67,3.98,;8,3.21,;9.34,3.98,;10.67,4.75,;8.57,5.32,;10.11,2.65,;4,.9,;2.67,1.67,;1.33,.9,;1.33,-.64,;2.67,-1.41,;2.67,-2.95,;1.42,-3.85,;-.04,-3.38,;1.9,-5.32,;3.44,-5.32,;3.91,-3.85,;5.38,-3.38,;4,-.64,;5.33,-1.41,;,1.67,;,3.21,;-1.33,3.98,;-2.67,3.21,;-2.67,1.67,;-4,.9,;-5.33,1.67,;-6.67,.9,;-6.67,-.64,;-8,1.67,;-9.34,.9,;-10.67,1.67,;-1.33,.9,)|
CC[C@H]1CN(CCN1)c1cc(nc(n1)-c1cccc(OCC(O)CNC)c1)N(C)C1CCOCC1 |r|
CC[C@H]1CN(CCN1C1CC1)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |r,wU:2.1,(9.23,-.64,;9.23,.9,;7.9,1.67,;6.57,.9,;5.23,1.67,;5.23,3.21,;6.57,3.98,;7.9,3.21,;9.23,3.98,;10.77,3.98,;10,5.32,;3.9,.9,;2.56,1.67,;1.23,.9,;1.23,-.64,;2.56,-1.41,;2.56,-2.95,;3.81,-3.85,;5.27,-3.38,;3.33,-5.32,;1.79,-5.32,;1.32,-3.85,;-.15,-3.38,;3.9,-.64,;5.23,-1.41,;-.1,1.67,;-.1,3.21,;-1.44,3.98,;-2.77,3.21,;-2.77,1.67,;-4.1,.9,;-5.44,1.67,;-6.77,.9,;-6.77,-.64,;-8.11,1.67,;-9.44,.9,;-10.77,1.67,;-1.44,.9,)|
CC[C@H]1CN(CCN1S(=O)(=O)CC)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |r,wU:2.1,(10.67,1.18,;9.34,.41,;8,1.18,;6.67,.41,;5.33,1.18,;5.33,2.72,;6.67,3.49,;8,2.72,;9.34,3.49,;8.57,4.83,;10.11,2.16,;10.67,4.26,;10.67,5.8,;4,.41,;2.67,1.18,;1.33,.41,;1.33,-1.13,;2.67,-1.9,;2.67,-3.44,;1.42,-4.34,;-.04,-3.86,;1.9,-5.8,;3.44,-5.8,;3.91,-4.34,;5.38,-3.86,;4,-1.13,;5.33,-1.9,;,1.18,;,2.72,;-1.33,3.49,;-2.67,2.72,;-2.67,1.18,;-4,.41,;-5.33,1.18,;-6.67,.41,;-6.67,-1.13,;-8,1.18,;-9.34,.41,;-10.67,1.18,;-1.33,.41,)|
CC[C@H]1CN(CCN1S(C)(=O)=O)c1nc(nc(-c2c(C)noc2C)c1C)-c1cccc(OCC(O)CNC)c1 |r,wU:2.1,(10.67,1.67,;9.34,.9,;8,1.67,;6.67,.9,;5.33,1.67,;5.33,3.21,;6.67,3.98,;8,3.21,;9.34,3.98,;10.67,4.75,;8.57,5.32,;10.11,2.65,;4,.9,;2.67,1.67,;1.33,.9,;1.33,-.64,;2.67,-1.41,;2.67,-2.95,;1.42,-3.85,;-.04,-3.38,;1.9,-5.32,;3.44,-5.32,;3.91,-3.85,;5.38,-3.38,;4,-.64,;5.33,-1.41,;,1.67,;,3.21,;-1.33,3.98,;-2.67,3.21,;-2.67,1.67,;-4,.9,;-5.33,1.67,;-6.67,.9,;-6.67,-.64,;-8,1.67,;-9.34,.9,;-10.67,1.67,;-1.33,.9,)|
CCc1c(N[C@@H]2CCOC2)nc(nc1N1CCOCC1)-c1cccc(OCC(O)CNC)c1 |r|
CCc1ccccc1CNC(=O)c1cc(nn1-c1cccc(CNCCNC)c1)C(F)(F)F
CCc1nc(cc(n1)-c1cccc(OCC(O)CNC)c1)N(C)C1CCOCC1
CCc1onc(C)c1-c1nc(nc(NC2CCOCC2)c1C)-c1cccc(OCC(O)CNC)c1 |(-.52,-3.74,;.62,-2.71,;2.09,-3.19,;2.56,-4.65,;4.1,-4.65,;4.58,-3.19,;6.04,-2.71,;3.33,-2.28,;3.33,-.74,;2,.03,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;.67,2.34,;.67,3.88,;-.67,4.65,;-2,3.88,;-2,2.34,;-3.33,1.57,;-4.67,2.34,;-6,1.57,;-6,.03,;-7.34,2.34,;-8.67,1.57,;-10,2.34,;-.67,1.57,)|
CCn1c2cccc3cccc(c23)\c1=C\[CH+]\C=c1/n(CC)c2cccc3cccc1c23
CN(C)C(=O)c1cc(nn1-c1cccc(CNC(=O)CN)c1)C(F)(F)F
CN(C)CC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)-c1cccc(c1)C#N
CN(CCN)Cc1c[nH]cc1-c1cccc(NC(=O)C=C)c1
CN(CCN)Cc1c[nH]cc1-c1cccc(c1)C(F)(F)F
CN(CCN)Cc1ccccc1
CN(CCN)Cc1ccccc1Sc1ccccc1Cl
CN(CCN)Cc1n[nH]nc1-c1cccc(c1)C(F)(F)F
CN(CCO)Cc1c[nH]cc1-c1cccc(NC(=O)C=C)c1
CNC(=N)N\N=C(\C)c1ccc2oc3ccc(cc3c2c1)C(\C)=N\NC(=N)NC
CNC(=O)c1cc(nn1-c1cccc(CNC(=O)CN)c1)C(F)(F)F
CNCC(=O)NC1=CC2C(C=C1)C(=O)c1cc(NC(=O)CNC)ccc1C2=O |c:10,t:6|
CNCC(=O)NCc1cccc(c1)-n1nc(cc1C(=O)Nc1ccc(cc1F)-c1ccccc1S(C)(=O)=O)C(F)(F)F
CNCC(O)CN1CCC(Cc2ccccc2)CC1
CNCC(O)CN1CCCc2c(Br)cccc2C1
CNCC(O)CN1CCCc2ccccc2C1
CNCC(O)CN1CCOc2ccccc2C1
CNCC(O)CN1CCc2c(Br)cccc2C1
CNCC(O)CN1CCc2c(C1)cccc2-c1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2C(=O)NCc1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2C(=O)Nc1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2NC(=O)Nc1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2NC(=O)c1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2NCc1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2NS(=O)(=O)c1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2Nc1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2OCc1ccc(Cl)cc1
CNCC(O)CN1CCc2c(C1)cccc2OCc1ccc(F)cc1
CNCC(O)CN1CCc2c(C1)cccc2OCc1ccc(cc1)-c1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2OCc1ccc(cc1)-c1nccs1
CNCC(O)CN1CCc2c(C1)cccc2OCc1ccc(cc1)C#N
CNCC(O)CN1CCc2c(C1)cccc2OCc1ccc(cc1)C(C)(C)C
CNCC(O)CN1CCc2c(C1)cccc2OCc1cccc(F)c1
CNCC(O)CN1CCc2c(C1)cccc2OCc1cccc(c1)-c1nccs1
CNCC(O)CN1CCc2c(C1)cccc2OCc1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2OCc1ccccc1F
CNCC(O)CN1CCc2c(C1)cccc2Oc1cc(C)cc(C)c1
CNCC(O)CN1CCc2c(C1)cccc2Oc1ccc(Cl)cc1
CNCC(O)CN1CCc2c(C1)cccc2Oc1ccc(F)c(Cl)c1
CNCC(O)CN1CCc2c(C1)cccc2Oc1ccc(F)cc1
CNCC(O)CN1CCc2c(C1)cccc2Oc1ccc(cc1)-c1nccs1
CNCC(O)CN1CCc2c(C1)cccc2Oc1ccc(cc1)C#N
CNCC(O)CN1CCc2c(C1)cccc2Oc1cccc(F)c1
CNCC(O)CN1CCc2c(C1)cccc2Oc1cccc(N)c1
CNCC(O)CN1CCc2c(C1)cccc2Oc1cccc(c1)-c1nccs1
CNCC(O)CN1CCc2c(C1)cccc2Oc1ccccc1
CNCC(O)CN1CCc2c(C1)cccc2Oc1ccccc1F
CNCC(O)CN1CCc2cc(Br)ccc2C1
CNCC(O)CN1CCc2cc(OCc3ccccc3)ccc2C1
CNCC(O)CN1CCc2cc(Oc3ccccc3)ccc2C1
CNCC(O)CN1CCc2ccc(Br)cc2C1
CNCC(O)CN1CCc2cccc(Br)c2C1
CNCC(O)CN1CCc2ccccc2C1
CNCC(O)CN1CCc2ccccc2CC1
CNCC(O)CN1Cc2ccccc2C1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(Br)c(n1)-c1ccncc1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1c[nH]c2ccccc12
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1cc(C)nc(C)c1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1ccc(nc1)N(C)C
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1ccn2cnnc2c1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1ccncc1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1cn2ccccc2n1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1cn[nH]c1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1cnc2ccccc2n1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1cnc2ccccn12
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-n1cccn1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)C2CCOCC2)c(C2CC2)c(n1)-c1ccncc1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N(C)[C@H]2CCOC2)c(C)c(n1)-c1ccncc1 |r|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(NC2CCN(CC(F)F)CC2)c(C)c(n1)-c1c(C)noc1C |(-12,1.57,;-10.67,.8,;-9.34,1.57,;-8,.8,;-8,-.74,;-6.67,1.57,;-5.33,.8,;-4,1.57,;-4,3.11,;-2.67,3.88,;-2.67,5.42,;-1.33,3.11,;-1.33,1.57,;-2.67,.8,;,.8,;1.33,1.57,;2.67,.8,;4,1.57,;5.33,.8,;5.33,-.74,;6.67,-1.51,;8,-.74,;9.34,-1.51,;10.67,-.74,;12,-1.51,;10.67,.8,;8,.8,;6.67,1.57,;2.67,-.74,;4,-1.51,;1.33,-1.51,;,-.74,;1.33,-3.05,;2.58,-3.96,;4.07,-3.56,;2.1,-5.42,;.56,-5.42,;.09,-3.96,;-1.4,-3.56,)|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(NC2CCN(CC2)C2CC2)c(C)c(n1)-c1c(C)noc1C |(-11.44,1.57,;-10.11,.8,;-8.77,1.57,;-7.44,.8,;-7.44,-.74,;-6.1,1.57,;-4.77,.8,;-3.44,1.57,;-3.44,3.11,;-2.1,3.88,;-2.1,5.42,;-.77,3.11,;-.77,1.57,;-2.1,.8,;.56,.8,;1.9,1.57,;3.23,.8,;4.56,1.57,;5.9,.8,;5.9,-.74,;7.23,-1.51,;8.57,-.74,;8.57,.8,;7.23,1.57,;9.9,-1.51,;10.67,-2.84,;11.44,-1.51,;3.23,-.74,;4.56,-1.51,;1.9,-1.51,;.56,-.74,;1.9,-3.05,;3.14,-3.96,;4.63,-3.56,;2.67,-5.42,;1.13,-5.42,;.65,-3.96,;-.84,-3.56,)|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(NC2CCNCC2)cc(n1)-c1ccncc1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,1.57,;-8.67,.8,;-7.34,1.57,;-6,.8,;-6,-.74,;-4.67,1.57,;-3.33,.8,;-2,1.57,;-2,3.11,;-.67,3.88,;-.67,5.42,;.67,3.11,;.67,1.57,;-.67,.8,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;7.34,.8,;7.34,-.74,;8.67,-1.51,;10,-.74,;10,.8,;8.67,1.57,;4.67,-.74,;6,-1.51,;3.33,-1.51,;2,-.74,;3.33,-3.05,;2.09,-3.96,;.62,-3.48,;2.56,-5.42,;4.1,-5.42,;4.58,-3.96,;6.04,-3.48,)|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccncc1 |r|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)C(=O)N(C)CC1CCOCC1 |r|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)C(=O)NCC1CCOCC1 |r|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)C1=CCOCC1 |r,t:30|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N[C@@H]2CCOC2)cc(n1)-c1c(C)noc1C |r|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N[C@H]2CCOC2)c(C)c(n1)-c1ccncc1 |r|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(N[C@H]2CCOC2)cc(n1)-c1c(C)noc1C |r|
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(Nc2cncnc2)c(C)c(n1)N(C)C1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(Nc2cncnc2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)-c1c(C)noc1C)-c1c(C)noc1C
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)-c1ccc(OC)c(OC)c1)N(CCOC)CCOC
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)-c1ccc2OCCOc2c1)N(CCOC)CCOC
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)-c1ccnc(OC)c1)N(CCOC)CCOC
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)-c1ccnc(c1)N(C)C)N(C)C1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)-c1ccncc1)N1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)-c1ccncc1C1CC1)N(C)C1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)-c1cnn(C)c1)N(C)C1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)C(=O)N(C)C)N(C)C1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)C(=O)N(C)CC1CCOCC1)N(C)C1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)C(=O)NCC1CCOCC1)N(C)C1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)C(=O)OC)N(C)C1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)C(C)=C)N(C)C1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)C(O)=O)N(C)C1CCOCC1
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C(C)C
CNCC(O)COc1cc(Cl)cc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C1CC1
CNCC(O)COc1cc(N)cc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-9.22,1.93,;-7.89,1.15,;-6.55,1.93,;-5.22,1.15,;-5.22,-.38,;-3.89,1.93,;-2.55,1.15,;-1.22,1.93,;-1.22,3.47,;.11,4.23,;.11,5.78,;1.45,3.47,;1.45,1.93,;.11,1.15,;2.78,1.15,;2.78,-.38,;4.12,-1.15,;4.12,-2.69,;5.45,-3.47,;5.45,-5,;6.78,-5.78,;8.12,-5,;8.12,-3.47,;6.78,-2.69,;5.45,-.38,;6.78,-1.15,;5.45,1.15,;4.12,1.93,;6.78,1.93,;6.94,3.46,;5.8,4.49,;8.45,3.78,;9.22,2.44,;8.19,1.3,;8.51,-.21,)|
CNCC(O)COc1cc(NC)cc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,1.18,;-8.67,.41,;-7.34,1.18,;-6,.41,;-6,-1.13,;-4.67,1.18,;-3.33,.41,;-2,1.18,;-2,2.72,;-.67,3.49,;-.67,5.03,;-2,5.8,;.67,2.72,;.67,1.18,;-.67,.41,;2,.41,;3.33,1.18,;4.67,.41,;6,1.18,;7.34,.41,;7.34,-1.13,;8.67,-1.9,;10,-1.13,;10,.41,;8.67,1.18,;4.67,-1.13,;6,-1.9,;3.33,-1.9,;2,-1.13,;3.33,-3.44,;2.09,-4.34,;.62,-3.86,;2.56,-5.8,;4.1,-5.8,;4.58,-4.34,;6.04,-3.86,)|
CNCC(O)COc1cc(O)cc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,1.57,;-8.67,.8,;-7.34,1.57,;-6,.8,;-6,-.74,;-4.67,1.57,;-3.33,.8,;-2,1.57,;-2,3.11,;-.67,3.88,;-.67,5.42,;.67,3.11,;.67,1.57,;-.67,.8,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;7.34,.8,;7.34,-.74,;8.67,-1.51,;10,-.74,;10,.8,;8.67,1.57,;4.67,-.74,;6,-1.51,;3.33,-1.51,;2,-.74,;3.33,-3.05,;2.09,-3.96,;.62,-3.48,;2.56,-5.42,;4.1,-5.42,;4.58,-3.96,;6.04,-3.48,)|
CNCC(O)COc1cc(OC)cc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCN([C@@H](C)C1)C(C)=O |r|
CNCC(O)COc1cc(OC)cc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,1.18,;-8.67,.41,;-7.34,1.18,;-6,.41,;-6,-1.13,;-4.67,1.18,;-3.33,.41,;-2,1.18,;-2,2.72,;-.67,3.49,;-.67,5.03,;.67,5.8,;.67,2.72,;.67,1.18,;-.67,.41,;2,.41,;3.33,1.18,;4.67,.41,;6,1.18,;7.34,.41,;7.34,-1.13,;8.67,-1.9,;10,-1.13,;10,.41,;8.67,1.18,;4.67,-1.13,;6,-1.9,;3.33,-1.9,;2,-1.13,;3.33,-3.44,;2.09,-4.34,;.62,-3.86,;2.56,-5.8,;4.1,-5.8,;4.58,-4.34,;6.04,-3.86,)|
CNCC(O)COc1cc(OC)cc(c1)-c1nc(cc(n1)-c1cnc2cnccn12)N(C)C1CCOCC1
CNCC(O)COc1cc(OC)cc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C1CC1
CNCC(O)COc1cc(cc(c1)-n1cccn1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-n1cccn1
CNCC(O)COc1cc(ccc1F)-c1nc(NC2CCOC(C)C2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-1.33,1.57,;,2.34,;,3.88,;-1.33,4.65,;-2.67,3.88,;-4,4.65,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,-.74,;9.34,.03,;9.34,1.57,;10.67,2.34,;8,2.34,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.4,-2.79,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.07,-2.79,)|
CNCC(O)COc1cc(ccc1F)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-.67,1.57,;.67,2.34,;.67,3.88,;-.67,4.65,;-2,3.88,;-3.33,4.65,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;8.67,2.34,;10,1.57,;10,.03,;8.67,-.74,;7.34,.03,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.07,-2.79,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.6,-2.79,)|
CNCC(O)COc1ccc(C#N)c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-12,1.95,;-10.67,1.18,;-9.34,1.95,;-8,1.18,;-8,-.36,;-6.67,1.95,;-5.33,1.18,;-4,1.95,;-4,3.49,;-2.67,4.26,;-1.33,3.49,;,4.26,;1.33,5.03,;-1.33,1.95,;-2.67,1.18,;,1.18,;1.33,1.95,;2.67,1.18,;4,1.95,;5.33,1.18,;5.33,-.36,;6.67,-1.13,;8,-.36,;8,1.18,;6.67,1.95,;9.34,-1.13,;9.34,-2.67,;10.67,-.36,;12,-1.13,;2.67,-.36,;4,-1.13,;1.33,-1.13,;,-.36,;1.33,-2.67,;2.58,-3.57,;4.07,-3.17,;2.1,-5.03,;.56,-5.03,;.09,-3.57,;-1.4,-3.17,)|
CNCC(O)COc1ccc(C#N)c(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,1.95,;-8.67,1.18,;-7.34,1.95,;-6,1.18,;-6,-.36,;-4.67,1.95,;-3.33,1.18,;-2,1.95,;-2,3.49,;-.67,4.26,;.67,3.49,;2,4.26,;3.33,5.03,;.67,1.95,;-.67,1.18,;2,1.18,;3.33,1.95,;4.67,1.18,;6,1.95,;7.34,1.18,;7.34,-.36,;8.67,-1.13,;10,-.36,;10,1.18,;8.67,1.95,;4.67,-.36,;6,-1.13,;3.33,-1.13,;2,-.36,;3.33,-2.67,;4.58,-3.57,;6.07,-3.17,;4.1,-5.03,;2.56,-5.03,;2.09,-3.57,;.6,-3.17,)|
CNCC(O)COc1ccc(C)c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;3.91,-2.42,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.25,-2.42,)|
CNCC(O)COc1ccc(C)c(c1)-c1nc(NC2CCOC(C)C2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,-.74,;9.34,.03,;9.34,1.57,;10.67,2.34,;8,2.34,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.25,-2.42,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;.09,-2.42,)|
CNCC(O)COc1ccc(C)c(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;2,4.65,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;5.91,-2.42,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.75,-2.42,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2(C)CCOCC2)c(Cl)c(n1)-c1c(C)noc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;2,4.65,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,3.11,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;2.09,-3.19,;.62,-2.71,;2.56,-4.65,;4.1,-4.65,;4.58,-3.19,;6.04,-2.71,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2CC(C)N(C(C)C2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;6.67,-2.28,;8,.03,;8,1.57,;9.34,2.34,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2CC(O)(C2)C(F)(F)F)c(C)c(n1)-c1c(C)noc1C |(-10.77,2.34,;-9.43,1.57,;-8.1,2.34,;-6.77,1.57,;-6.77,.03,;-5.43,2.34,;-4.1,1.57,;-2.76,2.34,;-2.76,3.88,;-1.43,4.65,;-.1,3.88,;1.24,4.65,;-.1,2.34,;-1.43,1.57,;1.24,1.57,;2.57,2.34,;3.9,1.57,;5.24,2.34,;6.57,1.57,;6.97,.08,;8.46,.48,;9.79,1.25,;8.06,1.97,;9.23,-.85,;10.77,-.85,;8.46,-2.19,;10,-2.19,;3.9,.03,;5.24,-.74,;2.57,-.74,;1.24,.03,;2.57,-2.28,;1.32,-3.19,;-.16,-2.79,;1.8,-4.65,;3.34,-4.65,;3.82,-3.19,;5.3,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2CC3(C2)CCN(CC3)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-12.28,2.34,;-10.95,1.57,;-9.61,2.34,;-8.28,1.57,;-8.28,.03,;-6.94,2.34,;-5.61,1.57,;-4.28,2.34,;-4.28,3.88,;-2.94,4.65,;-1.61,3.88,;-.28,4.65,;-1.61,2.34,;-2.94,1.57,;-.28,1.57,;1.06,2.34,;2.39,1.57,;3.72,2.34,;5.06,1.57,;5.46,.08,;6.94,.48,;6.55,1.97,;6.94,-1.06,;8.28,-1.83,;9.61,-1.06,;9.61,.48,;8.28,1.25,;10.95,-1.83,;12.28,-1.06,;10.95,-3.37,;12.28,-4.14,;2.39,.03,;3.72,-.74,;1.06,-.74,;-.28,.03,;1.06,-2.28,;-.19,-3.19,;-1.68,-2.79,;.29,-4.65,;1.83,-4.65,;2.3,-3.19,;3.79,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2CC3(C2)CN(C3)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-11.89,2.34,;-10.56,1.57,;-9.22,2.34,;-7.89,1.57,;-7.89,.03,;-6.55,2.34,;-5.22,1.57,;-3.89,2.34,;-3.89,3.88,;-2.55,4.65,;-1.22,3.88,;.11,4.65,;-1.22,2.34,;-2.55,1.57,;.11,1.57,;1.45,2.34,;2.78,1.57,;4.12,2.34,;5.45,1.57,;5.85,.08,;7.34,.48,;6.94,1.97,;7.73,-1.01,;9.22,-.61,;8.82,.88,;10.56,-1.38,;11.89,-.61,;10.56,-2.92,;11.89,-3.69,;2.78,.03,;4.12,-.74,;1.45,-.74,;.11,.03,;1.45,-2.28,;.2,-3.19,;-1.29,-2.79,;.68,-4.65,;2.22,-4.65,;2.69,-3.19,;4.18,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2CC3(CC3)C2)c(C)c(n1)-c1c(C)noc1C |(-10.38,2.34,;-9.05,1.57,;-7.71,2.34,;-6.38,1.57,;-6.38,.03,;-5.05,2.34,;-3.71,1.57,;-2.38,2.34,;-2.38,3.88,;-1.05,4.65,;.29,3.88,;1.62,4.65,;.29,2.34,;-1.05,1.57,;1.62,1.57,;2.95,2.34,;4.29,1.57,;5.62,2.34,;6.96,1.57,;7.35,.08,;8.84,.48,;9.61,-.85,;10.38,.48,;8.44,1.97,;4.29,.03,;5.62,-.74,;2.95,-.74,;1.62,.03,;2.95,-2.28,;1.71,-3.19,;.24,-2.71,;2.18,-4.65,;3.72,-4.65,;4.2,-3.19,;5.67,-2.71,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;6,1.57,;6,.03,;7.34,-.74,;8.67,.03,;8.67,1.57,;7.34,2.34,;10,-.74,;11.34,.03,;10,-2.28,;8.67,-3.05,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;3.25,-3.19,;4.71,-2.71,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.71,-2.71,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(Cl)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;2,4.65,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;8.67,2.34,;10,1.57,;10,.03,;8.67,-.74,;7.34,.03,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.07,-2.79,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.6,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)nsc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;2,4.65,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)onc1CO |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;2,4.65,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;2.09,-3.19,;.62,-2.71,;2.56,-4.65,;4.1,-4.65,;4.58,-3.19,;6.04,-2.71,;7.19,-3.74,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NCC2CCCCO2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;8,3.88,;9.34,4.65,;10.67,3.88,;10.67,2.34,;9.34,1.57,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.07,-2.79,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.4,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NCC2CCOC2)c(C)c(n1)-c1c(C)noc1C |(-10.55,2.34,;-9.22,1.57,;-7.89,2.34,;-6.55,1.57,;-6.55,.03,;-5.22,2.34,;-3.89,1.57,;-2.55,2.34,;-2.55,3.88,;-1.22,4.65,;.11,3.88,;1.45,4.65,;.11,2.34,;-1.22,1.57,;1.45,1.57,;2.78,2.34,;4.12,1.57,;5.45,2.34,;6.78,1.57,;8.12,2.34,;8.28,3.87,;9.78,4.19,;10.55,2.86,;9.52,1.71,;4.12,.03,;5.45,-.74,;2.78,-.74,;1.45,.03,;2.78,-2.28,;1.54,-3.19,;.05,-2.79,;2.01,-4.65,;3.55,-4.65,;4.03,-3.19,;5.52,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NCC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.07,-2.79,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.4,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NCC2COCCO2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;8,3.88,;9.34,4.65,;10.67,3.88,;10.67,2.34,;9.34,1.57,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.07,-2.79,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.4,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC[C@@H]2CCCO2)c(C)c(n1)-c1c(C)noc1C |r,wD:19.19,(-10.55,2.34,;-9.22,1.57,;-7.89,2.34,;-6.55,1.57,;-6.55,.03,;-5.22,2.34,;-3.89,1.57,;-2.55,2.34,;-2.55,3.88,;-1.22,4.65,;.11,3.88,;1.45,4.65,;.11,2.34,;-1.22,1.57,;1.45,1.57,;2.78,2.34,;4.12,1.57,;5.45,2.34,;6.78,1.57,;8.12,2.34,;8.28,3.87,;9.78,4.19,;10.55,2.86,;9.52,1.71,;4.12,.03,;5.45,-.74,;2.78,-.74,;1.45,.03,;2.78,-2.28,;1.54,-3.19,;.05,-2.79,;2.01,-4.65,;3.55,-4.65,;4.03,-3.19,;5.52,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC[C@H]2CCCO2)c(C)c(n1)-c1c(C)noc1C |r,wU:19.19,(-10.55,2.34,;-9.22,1.57,;-7.89,2.34,;-6.55,1.57,;-6.55,.03,;-5.22,2.34,;-3.89,1.57,;-2.55,2.34,;-2.55,3.88,;-1.22,4.65,;.11,3.88,;1.45,4.65,;.11,2.34,;-1.22,1.57,;1.45,1.57,;2.78,2.34,;4.12,1.57,;5.45,2.34,;6.78,1.57,;8.12,2.34,;8.28,3.87,;9.78,4.19,;10.55,2.86,;9.52,1.71,;4.12,.03,;5.45,-.74,;2.78,-.74,;1.45,.03,;2.78,-2.28,;1.54,-3.19,;.05,-2.79,;2.01,-4.65,;3.55,-4.65,;4.03,-3.19,;5.52,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(NC[C@H]2COCCN2C2COC2)c(C)c(n1)-c1c(C)noc1C |r,wU:19.19,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;8,3.88,;9.34,4.65,;10.67,3.88,;10.67,2.34,;9.34,1.57,;9.34,.03,;8.25,-1.06,;9.34,-2.15,;10.42,-1.06,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.07,-2.79,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.4,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CCC[C@@H](O)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:18.18,22.23,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,-.74,;9.34,.03,;9.34,1.57,;10.67,2.34,;8,2.34,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.4,-2.79,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.07,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CCC[C@H](C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:18.18,22.25,(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;6,1.57,;6,.03,;7.34,-.74,;8.67,.03,;8.67,1.57,;7.34,2.34,;10,2.34,;11.34,1.57,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CCN(C[C@H]2F)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:18.18,23.25,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;6.67,3.88,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNCC(O)COc1ccc(Cl)c(c1)-c1nc(O[C@H]2CCN([C@@H](C)C2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:18.18,22.23,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;9.34,2.34,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNCC(O)COc1cccc(c1)-c1cc(NC2CCOCC2)nc(NC(C)C)n1
CNCC(O)COc1cccc(c1)-c1cc(NC2CCOCC2)nc(n1)-c1ccncc1
CNCC(O)COc1cccc(c1)-c1cc(NC2CCOCC2)nc(n1)N(C)C
CNCC(O)COc1cccc(c1)-c1cc(NC2CCOCC2)nc(n1)N1CCOCC1
CNCC(O)COc1cccc(c1)-c1cc(nc(C)n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1cc(nc(N[C@H]2CCOC2)n1)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1cc(nc(n1)-c1cccnc1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1cc(nc(n1)-c1ccncc1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1cc(nc(n1)-c1cnc2[nH]ccc2c1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1cc(nc(n1)C(C)=C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1cc(nc(n1)C(C)C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1cc(nc(n1)C1CC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1cc(nc(n1)N(C)C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1cc(nc(n1)N1CCOCC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(-c2c(C)n[nH]c2C)c(C)c(n1)-c1c(C)noc1C |(-9.22,2.21,;-7.89,1.44,;-6.55,2.21,;-5.22,1.44,;-5.22,-.1,;-3.89,2.21,;-2.55,1.44,;-1.22,2.21,;-1.22,3.75,;.11,4.52,;1.45,3.75,;1.45,2.21,;.11,1.44,;2.78,1.44,;4.12,2.21,;5.45,1.44,;6.78,2.21,;6.94,3.75,;5.8,4.78,;8.45,4.07,;9.22,2.73,;8.19,1.59,;8.51,.08,;5.45,-.1,;6.78,-.87,;4.12,-.87,;2.78,-.1,;4.12,-2.41,;5.36,-3.31,;6.83,-2.84,;4.89,-4.78,;3.35,-4.78,;2.87,-3.31,;1.41,-2.84,)|
CNCC(O)COc1cccc(c1)-c1nc(-c2c(C)noc2C)c(C)c(n1)-c1c(C)noc1C |(-9.22,2.21,;-7.89,1.44,;-6.55,2.21,;-5.22,1.44,;-5.22,-.1,;-3.89,2.21,;-2.55,1.44,;-1.22,2.21,;-1.22,3.75,;.11,4.52,;1.45,3.75,;1.45,2.21,;.11,1.44,;2.78,1.44,;4.12,2.21,;5.45,1.44,;6.78,2.21,;6.94,3.75,;5.8,4.78,;8.45,4.07,;9.22,2.73,;8.19,1.59,;8.51,.08,;5.45,-.1,;6.78,-.87,;4.12,-.87,;2.78,-.1,;4.12,-2.41,;5.36,-3.31,;6.83,-2.84,;4.89,-4.78,;3.35,-4.78,;2.87,-3.31,;1.41,-2.84,)|
CNCC(O)COc1cccc(c1)-c1nc(-c2c(C)noc2C)c(C)c(n1)-c1ccn2cnnc2c1 |(-9.91,1.51,;-8.57,.74,;-7.24,1.51,;-5.91,.74,;-5.91,-.8,;-4.57,1.51,;-3.24,.74,;-1.91,1.51,;-1.91,3.05,;-.57,3.82,;.76,3.05,;.76,1.51,;-.57,.74,;2.1,.74,;2.1,-.8,;3.43,-1.57,;3.43,-3.11,;4.67,-4.02,;6.14,-3.54,;4.2,-5.48,;2.66,-5.48,;2.18,-4.02,;.72,-3.54,;4.76,-.8,;6.1,-1.57,;4.76,.74,;3.43,1.51,;6.1,1.51,;7.43,.74,;8.76,1.51,;8.76,3.05,;9.91,4.08,;9.28,5.48,;7.75,5.32,;7.43,3.82,;6.1,3.05,)|
CNCC(O)COc1cccc(c1)-c1nc(-c2nc(C)cn2C)c(C)c(n1)-c1c(C)noc1C |(-9.22,1.87,;-7.89,1.1,;-6.55,1.87,;-5.22,1.1,;-5.22,-.44,;-3.89,1.87,;-2.55,1.1,;-1.22,1.87,;-1.22,3.41,;.11,4.18,;1.45,3.41,;1.45,1.87,;.11,1.1,;2.78,1.1,;4.12,1.87,;5.45,1.1,;6.78,1.87,;6.94,3.4,;8.45,3.72,;9.08,5.12,;9.22,2.38,;8.19,1.24,;8.51,-.27,;5.45,-.44,;6.78,-1.21,;4.12,-1.21,;2.78,-.44,;4.12,-2.75,;2.87,-3.66,;1.41,-3.18,;3.35,-5.12,;4.89,-5.12,;5.36,-3.66,;6.83,-3.18,)|
CNCC(O)COc1cccc(c1)-c1nc(C(=O)NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;5.33,3.88,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(C(=O)NC2CCOCC2)c(C)c(n1)C(=O)NC1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(C(C)C)c(C)c(n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(C)cc(n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(N(C)C)c(C)c(n1)-c1c(C)noc1C |(-8.67,2.34,;-7.34,1.57,;-6,2.34,;-4.67,1.57,;-4.67,.03,;-3.33,2.34,;-2,1.57,;-.67,2.34,;-.67,3.88,;.67,4.65,;2,3.88,;2,2.34,;.67,1.57,;3.33,1.57,;4.67,2.34,;6,1.57,;7.34,2.34,;8.67,1.57,;7.34,3.88,;6,.03,;7.34,-.74,;4.67,-.74,;3.33,.03,;4.67,-2.28,;3.42,-3.19,;1.96,-2.71,;3.9,-4.65,;5.44,-4.65,;5.91,-3.19,;7.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N(C)C2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;4,3.88,;5.33,1.57,;6.67,2.34,;8,1.57,;8,.03,;6.67,-.74,;5.33,.03,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;.09,-3.19,;-1.38,-2.71,;.56,-4.65,;2.1,-4.65,;2.58,-3.19,;4.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-9.22,2.57,;-7.89,1.8,;-6.55,2.57,;-5.22,1.8,;-5.22,.26,;-3.89,2.57,;-2.55,1.8,;-1.22,2.57,;-1.22,4.11,;.11,4.88,;1.45,4.11,;1.45,2.57,;.11,1.8,;2.78,1.8,;2.78,.26,;4.12,-.51,;4.12,-2.05,;2.78,-2.82,;5.45,-2.82,;5.45,-4.36,;6.78,-5.13,;8.12,-4.36,;8.12,-2.82,;6.78,-2.05,;5.45,.26,;6.78,-.51,;5.45,1.8,;4.12,2.57,;6.78,2.57,;6.94,4.1,;5.8,5.13,;8.45,4.42,;9.22,3.09,;8.19,1.94,;8.51,.44,)|
CNCC(O)COc1cccc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1ccncc1
CNCC(O)COc1cccc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)C(C)(C)O
CNCC(O)COc1cccc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)C(C)=O
CNCC(O)COc1cccc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)N1CCNCC1
CNCC(O)COc1cccc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)N1CCNC[C@@H]1C |r|
CNCC(O)COc1cccc(c1)-c1nc(N(C)C2CCOCC2)c(F)c(n1)N1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(N(C)CC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;5.33,3.88,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N(C)[C@@H]2CCOC2)c(C)c(n1)-c1ccncc1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N(C)[C@@H]2CCOC2)c(C)c(n1)N1CCN([C@@H](C)C1)C(C)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(N(C)[C@H]2CCOC2)c(C)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N(C)[C@H]2C[C@](C)(C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:20.21,wD:18.18,20.24,(-10.77,2.34,;-9.43,1.57,;-8.1,2.34,;-6.77,1.57,;-6.77,.03,;-5.43,2.34,;-4.1,1.57,;-2.76,2.34,;-2.76,3.88,;-1.43,4.65,;-.1,3.88,;-.1,2.34,;-1.43,1.57,;1.24,1.57,;2.57,2.34,;3.9,1.57,;5.24,2.34,;5.24,3.88,;6.57,1.57,;6.97,.08,;8.46,.48,;9.23,-.85,;8.06,1.97,;10,.48,;10.77,-.85,;3.9,.03,;5.24,-.74,;2.57,-.74,;1.24,.03,;2.57,-2.28,;1.32,-3.19,;-.16,-2.79,;1.8,-4.65,;3.34,-4.65,;3.82,-3.19,;5.3,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(N(C)c2cnc(nc2)C(F)(F)F)c(C)c(n1)-c1c(C)noc1C |(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;4.67,3.88,;6,1.57,;7.34,2.34,;8.67,1.57,;8.67,.03,;7.34,-.74,;6,.03,;10,-.74,;11.34,.03,;10,-2.28,;11.34,-1.51,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;3.25,-3.19,;4.71,-2.71,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.71,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CC(C2)NC(=O)N(C)C)c(C)c(n1)-c1c(C)noc1C |(-10.95,2.34,;-9.61,1.57,;-8.28,2.34,;-6.94,1.57,;-6.94,.03,;-5.61,2.34,;-4.28,1.57,;-2.94,2.34,;-2.94,3.88,;-1.61,4.65,;-.28,3.88,;-.28,2.34,;-1.61,1.57,;1.06,1.57,;2.39,2.34,;3.72,1.57,;5.06,2.34,;6.55,1.94,;6.94,3.43,;5.46,3.83,;8.28,4.2,;9.61,3.43,;10.95,4.2,;9.61,1.89,;8.28,1.12,;10.95,1.12,;3.72,.03,;5.06,-.74,;2.39,-.74,;1.06,.03,;2.39,-2.28,;1.15,-3.19,;-.34,-2.79,;1.62,-4.65,;3.16,-4.65,;3.64,-3.19,;5.12,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CC(C2)NC(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-10.95,2.34,;-9.61,1.57,;-8.28,2.34,;-6.94,1.57,;-6.94,.03,;-5.61,2.34,;-4.28,1.57,;-2.94,2.34,;-2.94,3.88,;-1.61,4.65,;-.28,3.88,;-.28,2.34,;-1.61,1.57,;1.06,1.57,;2.39,2.34,;3.72,1.57,;5.06,2.34,;6.55,1.94,;6.94,3.43,;5.46,3.83,;8.28,4.2,;9.61,3.43,;10.95,4.2,;9.61,1.89,;10.95,1.12,;3.72,.03,;5.06,-.74,;2.39,-.74,;1.06,.03,;2.39,-2.28,;1.15,-3.19,;-.34,-2.79,;1.62,-4.65,;3.16,-4.65,;3.64,-3.19,;5.12,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CC(CO)(CNC(=O)N(C)C)C2)c(C)c(n1)-c1c(C)noc1C |(-12.16,1.66,;-10.83,.89,;-9.5,1.66,;-8.16,.89,;-8.16,-.65,;-6.83,1.66,;-5.5,.89,;-4.16,1.66,;-4.16,3.2,;-2.83,3.97,;-1.49,3.2,;-1.49,1.66,;-2.83,.89,;-.16,.89,;1.17,1.66,;2.51,.89,;3.84,1.66,;5.33,1.26,;5.73,2.75,;6.13,4.24,;5.04,5.33,;7.21,2.35,;7.61,.87,;9.59,.47,;10.03,-1.01,;10.68,1.56,;12.16,1.16,;10.28,3.04,;4.24,3.15,;2.51,-.65,;3.84,-1.42,;1.17,-1.42,;-.16,-.65,;1.17,-2.96,;2.42,-3.86,;3.88,-3.39,;1.94,-5.33,;.4,-5.33,;-.07,-3.86,;-1.54,-3.39,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CC3(CN(C3)C(=O)N(C)C)C2)c(C)c(n1)-c1c(C)noc1C |(-11.89,1.25,;-10.56,.48,;-9.22,1.25,;-7.89,.48,;-7.89,-1.06,;-6.55,1.25,;-5.22,.48,;-3.89,1.25,;-3.89,2.79,;-2.55,3.56,;-1.22,2.79,;-1.22,1.25,;-2.55,.48,;.11,.48,;1.45,1.25,;2.78,.48,;4.12,1.25,;5.6,.85,;6,2.34,;7.49,1.94,;7.89,3.43,;6.4,3.83,;9.22,4.2,;9.22,5.74,;10.56,3.43,;11.89,4.2,;10.56,1.89,;4.51,2.74,;2.78,-1.06,;4.12,-1.83,;1.45,-1.83,;.11,-1.06,;1.45,-3.37,;2.69,-4.27,;4.16,-3.8,;2.22,-5.74,;.68,-5.74,;.2,-4.27,;-1.26,-3.8,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CC3(CN(C3)C(=O)OC)C2)c(C)c(n1)-c1c(C)noc1C |(-11.89,1.25,;-10.56,.48,;-9.22,1.25,;-7.89,.48,;-7.89,-1.06,;-6.55,1.25,;-5.22,.48,;-3.89,1.25,;-3.89,2.79,;-2.55,3.56,;-1.22,2.79,;-1.22,1.25,;-2.55,.48,;.11,.48,;1.45,1.25,;2.78,.48,;4.12,1.25,;5.6,.85,;6,2.34,;7.49,1.94,;7.89,3.43,;6.4,3.83,;9.22,4.2,;9.22,5.74,;10.56,3.43,;11.89,4.2,;4.51,2.74,;2.78,-1.06,;4.12,-1.83,;1.45,-1.83,;.11,-1.06,;1.45,-3.37,;2.69,-4.27,;4.16,-3.8,;2.22,-5.74,;.68,-5.74,;.2,-4.27,;-1.26,-3.8,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCC3(CN(C3)C(=O)N(C)C)CC2)c(C)c(n1)-c1c(C)noc1C |(-12.28,1.03,;-10.95,.26,;-9.61,1.03,;-8.28,.26,;-8.28,-1.28,;-6.94,1.03,;-5.61,.26,;-4.28,1.03,;-4.28,2.57,;-2.94,3.34,;-1.61,2.57,;-1.61,1.03,;-2.94,.26,;-.28,.26,;1.06,1.03,;2.39,.26,;3.72,1.03,;5.06,.26,;6.39,1.03,;6.39,2.57,;7.88,2.17,;8.28,3.65,;6.79,4.05,;9.61,4.42,;9.61,5.96,;10.95,3.65,;12.28,4.42,;10.95,2.11,;5.06,3.34,;3.72,2.57,;2.39,-1.28,;3.72,-2.05,;1.06,-2.05,;-.28,-1.28,;1.06,-3.59,;2.3,-4.5,;3.77,-4.02,;1.83,-5.96,;.29,-5.96,;-.19,-4.5,;-1.65,-4.02,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCC3(CN(C3)C(=O)OC)CC2)c(C)c(n1)-c1c(C)noc1C |(-12.28,1.03,;-10.95,.26,;-9.61,1.03,;-8.28,.26,;-8.28,-1.28,;-6.94,1.03,;-5.61,.26,;-4.28,1.03,;-4.28,2.57,;-2.94,3.34,;-1.61,2.57,;-1.61,1.03,;-2.94,.26,;-.28,.26,;1.06,1.03,;2.39,.26,;3.72,1.03,;5.06,.26,;6.39,1.03,;6.39,2.57,;7.88,2.17,;8.28,3.65,;6.79,4.05,;9.61,4.42,;9.61,5.96,;10.95,3.65,;12.28,4.42,;5.06,3.34,;3.72,2.57,;2.39,-1.28,;3.72,-2.05,;1.06,-2.05,;-.28,-1.28,;1.06,-3.59,;2.3,-4.5,;3.77,-4.02,;1.83,-5.96,;.29,-5.96,;-.19,-4.5,;-1.65,-4.02,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCC3(CN(C3)C3CC3)CC2)c(C)c(n1)-c1c(C)noc1C |(-11.72,1.13,;-10.38,.36,;-9.05,1.13,;-7.71,.36,;-7.71,-1.18,;-6.38,1.13,;-5.05,.36,;-3.71,1.13,;-3.71,2.67,;-2.38,3.44,;-1.05,2.67,;-1.05,1.13,;-2.38,.36,;.29,.36,;1.62,1.13,;2.95,.36,;4.29,1.13,;5.62,.36,;6.96,1.13,;6.96,2.67,;8.44,2.27,;8.84,3.76,;7.35,4.16,;10.18,4.53,;11.72,4.53,;10.95,5.86,;5.62,3.44,;4.29,2.67,;2.95,-1.18,;4.29,-1.95,;1.62,-1.95,;.29,-1.18,;1.62,-3.49,;2.87,-4.4,;4.33,-3.92,;2.39,-5.86,;.85,-5.86,;.38,-4.4,;-1.09,-3.92,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCC3(CN(C3)S(C)(=O)=O)CC2)c(C)c(n1)-c1c(C)noc1C |(-11.61,1.13,;-10.28,.36,;-8.95,1.13,;-7.61,.36,;-7.61,-1.18,;-6.28,1.13,;-4.94,.36,;-3.61,1.13,;-3.61,2.67,;-2.28,3.44,;-.94,2.67,;-.94,1.13,;-2.28,.36,;.39,.36,;1.72,1.13,;3.06,.36,;4.39,1.13,;5.73,.36,;7.06,1.13,;7.06,2.67,;8.55,2.27,;8.95,3.76,;7.46,4.16,;10.28,4.53,;11.61,5.3,;9.51,5.86,;11.05,3.19,;5.73,3.44,;4.39,2.67,;3.06,-1.18,;4.39,-1.95,;1.72,-1.95,;.39,-1.18,;1.72,-3.49,;2.97,-4.4,;4.43,-3.92,;2.49,-5.86,;.95,-5.86,;.48,-4.4,;-.99,-3.92,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCCC3(CN(C3)C(=O)N(C)C)C2)c(C)c(n1)-c1c(C)noc1C |(-12.28,2.34,;-10.95,1.57,;-9.61,2.34,;-8.28,1.57,;-8.28,.03,;-6.94,2.34,;-5.61,1.57,;-4.28,2.34,;-4.28,3.88,;-2.94,4.65,;-1.61,3.88,;-1.61,2.34,;-2.94,1.57,;-.28,1.57,;1.06,2.34,;2.39,1.57,;3.72,2.34,;3.72,3.88,;5.06,4.65,;6.39,3.88,;6.39,2.34,;6.79,.85,;8.28,1.25,;7.88,2.74,;9.61,.48,;9.61,-1.06,;10.95,1.25,;12.28,.48,;10.95,2.79,;5.06,1.57,;2.39,.03,;3.72,-.74,;1.06,-.74,;-.28,.03,;1.06,-2.28,;2.3,-3.19,;3.77,-2.71,;1.83,-4.65,;.29,-4.65,;-.19,-3.19,;-1.65,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCC[C@@H](C2)N(C)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:20.23,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;4,3.88,;5.33,4.65,;6.67,3.88,;6.67,2.34,;5.33,1.57,;8,1.57,;8,.03,;9.34,2.34,;9.34,3.88,;10.67,1.57,;12,2.34,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCC[C@H](C2)N(C)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:20.23,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;4,3.88,;5.33,4.65,;6.67,3.88,;6.67,2.34,;5.33,1.57,;8,1.57,;8,.03,;9.34,2.34,;9.34,3.88,;10.67,1.57,;12,2.34,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCC[C@H](C2)NC)c(C)c(n1)-c1c(C)noc1C |r,wU:20.23,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;6,3.88,;7.34,4.65,;8.67,3.88,;8.67,2.34,;7.34,1.57,;10,1.57,;10,.03,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCN(C(C2)C(F)F)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-11.34,1.57,;-10,.8,;-8.67,1.57,;-7.34,.8,;-7.34,-.74,;-6,1.57,;-4.67,.8,;-3.33,1.57,;-3.33,3.11,;-2,3.88,;-.67,3.11,;-.67,1.57,;-2,.8,;.67,.8,;2,1.57,;3.33,.8,;4.67,1.57,;4.67,3.11,;6,3.88,;7.34,3.11,;7.34,1.57,;6,.8,;8.67,.8,;10,1.57,;8.67,-.74,;8.67,3.88,;8.67,5.42,;10,3.11,;11.34,3.88,;3.33,-.74,;4.67,-1.51,;2,-1.51,;.67,-.74,;2,-3.05,;3.25,-3.96,;4.73,-3.56,;2.77,-5.42,;1.23,-5.42,;.75,-3.96,;-.73,-3.56,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCN(CC2)C(=O)C(F)F)c(C)c(n1)-c1c(C)noc1C |(-11.34,1.57,;-10,.8,;-8.67,1.57,;-7.34,.8,;-7.34,-.74,;-6,1.57,;-4.67,.8,;-3.33,1.57,;-3.33,3.11,;-2,3.88,;-.67,3.11,;-.67,1.57,;-2,.8,;.67,.8,;2,1.57,;3.33,.8,;4.67,1.57,;6,.8,;7.34,1.57,;7.34,3.11,;6,3.88,;4.67,3.11,;8.67,3.88,;8.67,5.42,;10,3.11,;11.34,3.88,;10,1.57,;3.33,-.74,;4.67,-1.51,;2,-1.51,;.67,-.74,;2,-3.05,;.75,-3.96,;-.71,-3.48,;1.23,-5.42,;2.77,-5.42,;3.25,-3.96,;4.71,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCN(CC2)C(=O)C2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-12,1.57,;-10.67,.8,;-9.34,1.57,;-8,.8,;-8,-.74,;-6.67,1.57,;-5.33,.8,;-4,1.57,;-4,3.11,;-2.67,3.88,;-1.33,3.11,;-1.33,1.57,;-2.67,.8,;,.8,;1.33,1.57,;2.67,.8,;4,1.57,;5.33,.8,;6.67,1.57,;6.67,3.11,;5.33,3.88,;4,3.11,;8,3.88,;8,5.42,;9.34,3.11,;9.34,1.57,;10.67,.8,;12,1.57,;12,3.11,;10.67,3.88,;2.67,-.74,;4,-1.51,;1.33,-1.51,;,-.74,;1.33,-3.05,;.09,-3.96,;-1.38,-3.48,;.56,-5.42,;2.1,-5.42,;2.58,-3.96,;4.04,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCN(CC2)C(=O)OC)c(F)c(n1)-c1c(C)noc1C |(-11.34,1.57,;-10,.8,;-8.67,1.57,;-7.34,.8,;-7.34,-.74,;-6,1.57,;-4.67,.8,;-3.33,1.57,;-3.33,3.11,;-2,3.88,;-.67,3.11,;-.67,1.57,;-2,.8,;.67,.8,;2,1.57,;3.33,.8,;4.67,1.57,;6,.8,;7.34,1.57,;7.34,3.11,;6,3.88,;4.67,3.11,;8.67,3.88,;8.67,5.42,;10,3.11,;11.34,3.88,;3.33,-.74,;4.67,-1.51,;2,-1.51,;.67,-.74,;2,-3.05,;.75,-3.96,;-.71,-3.48,;1.23,-5.42,;2.77,-5.42,;3.25,-3.96,;4.71,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCN(CC2)C(=O)OCC(F)F)c(C)c(n1)-c1c(C)noc1C |(-12.67,1.57,;-11.34,.8,;-10,1.57,;-8.67,.8,;-8.67,-.74,;-7.34,1.57,;-6,.8,;-4.67,1.57,;-4.67,3.11,;-3.33,3.88,;-2,3.11,;-2,1.57,;-3.33,.8,;-.67,.8,;.67,1.57,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;6,3.11,;4.67,3.88,;3.33,3.11,;7.34,3.88,;7.34,5.42,;8.67,3.11,;10,3.88,;11.34,3.11,;12.67,3.88,;11.34,1.57,;2,-.74,;3.33,-1.51,;.67,-1.51,;-.67,-.74,;.67,-3.05,;1.91,-3.96,;3.38,-3.48,;1.44,-5.42,;-.1,-5.42,;-.58,-3.96,;-2.04,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCN(CC2)C(=O)OCCF)c(C)c(n1)-c1c(C)noc1C |(-12.67,1.57,;-11.34,.8,;-10,1.57,;-8.67,.8,;-8.67,-.74,;-7.34,1.57,;-6,.8,;-4.67,1.57,;-4.67,3.11,;-3.33,3.88,;-2,3.11,;-2,1.57,;-3.33,.8,;-.67,.8,;.67,1.57,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;6,3.11,;4.67,3.88,;3.33,3.11,;7.34,3.88,;7.34,5.42,;8.67,3.11,;10,3.88,;11.34,3.11,;12.67,3.88,;2,-.74,;3.33,-1.51,;.67,-1.51,;-.67,-.74,;.67,-3.05,;-.58,-3.96,;-2.04,-3.48,;-.1,-5.42,;1.44,-5.42,;1.91,-3.96,;3.38,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCN(CC2)C(=O)OCCOC)c(C)c(n1)-c1c(C)noc1C |(-13.34,1.57,;-12,.8,;-10.67,1.57,;-9.34,.8,;-9.34,-.74,;-8,1.57,;-6.67,.8,;-5.33,1.57,;-5.33,3.11,;-4,3.88,;-2.67,3.11,;-2.67,1.57,;-4,.8,;-1.33,.8,;,1.57,;1.33,.8,;2.67,1.57,;4,.8,;5.33,1.57,;5.33,3.11,;4,3.88,;2.67,3.11,;6.67,3.88,;6.67,5.42,;8,3.11,;9.34,3.88,;10.67,3.11,;12,3.88,;13.34,3.11,;1.33,-.74,;2.67,-1.51,;,-1.51,;-1.33,-.74,;,-3.05,;-1.25,-3.96,;-2.71,-3.48,;-.77,-5.42,;.77,-5.42,;1.25,-3.96,;2.71,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCN(Cc3ccccc3)C(C2)C(F)F)c(C)c(n1)-c1c(C)noc1C |(-12,1.18,;-10.67,.41,;-9.34,1.18,;-8,.41,;-8,-1.13,;-6.67,1.18,;-5.33,.41,;-4,1.18,;-4,2.72,;-2.67,3.49,;-1.33,2.72,;-1.33,1.18,;-2.67,.41,;,.41,;1.33,1.18,;2.67,.41,;4,1.18,;5.33,.41,;6.67,1.18,;6.67,2.72,;8,3.49,;9.34,2.72,;9.34,1.18,;10.67,.41,;12,1.18,;12,2.72,;10.67,3.49,;5.33,3.49,;4,2.72,;5.33,5.03,;6.67,5.8,;4,5.8,;2.67,-1.13,;4,-1.9,;1.33,-1.9,;,-1.13,;1.33,-3.44,;.09,-4.34,;-1.38,-3.86,;.56,-5.8,;2.1,-5.8,;2.58,-4.34,;4.04,-3.86,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCN3[C@H](COC3=O)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:20.20,(-10.52,1.75,;-9.19,.98,;-7.85,1.75,;-6.52,.98,;-6.52,-.56,;-5.19,1.75,;-3.85,.98,;-2.52,1.75,;-2.52,3.29,;-1.18,4.06,;.15,3.29,;.15,1.75,;-1.18,.98,;1.48,.98,;2.82,1.75,;4.15,.98,;5.48,1.75,;5.48,3.29,;6.82,4.06,;8.15,3.29,;8.15,1.75,;9.62,1.28,;10.52,2.52,;9.62,3.77,;10.09,5.24,;6.82,.98,;4.15,-.56,;5.48,-1.33,;2.82,-1.33,;1.48,-.56,;2.82,-2.87,;1.57,-3.77,;.11,-3.29,;2.05,-5.24,;3.59,-5.24,;4.06,-3.77,;5.53,-3.29,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCNC(C2)C(F)F)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;5.33,3.88,;6.67,4.65,;8,3.88,;8,2.34,;6.67,1.57,;9.34,1.57,;10.67,2.34,;9.34,.03,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.4,-2.79,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.07,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCOC(C)(C)C2)c(C)c(n1)-c1c(C)noc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;6,3.88,;7.34,4.65,;8.67,3.88,;8.67,2.34,;8.67,.8,;10,1.57,;7.34,1.57,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@@H](C)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:20.21,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;6,3.88,;7.34,4.65,;8.67,3.88,;8.67,2.34,;10,1.57,;7.34,1.57,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@@H](CN(C)C(=O)N(C)C)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:20.21,(-12.67,2.34,;-11.34,1.57,;-10,2.34,;-8.67,1.57,;-8.67,.03,;-7.34,2.34,;-6,1.57,;-4.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-2,2.34,;-3.33,1.57,;-.67,1.57,;.67,2.34,;2,1.57,;3.33,2.34,;3.33,3.88,;4.67,4.65,;6,3.88,;6,2.34,;7.34,1.57,;8.67,2.34,;8.67,3.88,;10,1.57,;10,.03,;11.34,2.34,;12.67,1.57,;11.34,3.88,;4.67,1.57,;2,.03,;3.33,-.74,;.67,-.74,;-.67,.03,;.67,-2.28,;1.91,-3.19,;3.38,-2.71,;1.44,-4.65,;-.1,-4.65,;-.58,-3.19,;-2.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@@H](CN(C)C(=O)OC)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:20.21,(-12.67,2.34,;-11.34,1.57,;-10,2.34,;-8.67,1.57,;-8.67,.03,;-7.34,2.34,;-6,1.57,;-4.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-2,2.34,;-3.33,1.57,;-.67,1.57,;.67,2.34,;2,1.57,;3.33,2.34,;3.33,3.88,;4.67,4.65,;6,3.88,;6,2.34,;7.34,1.57,;8.67,2.34,;8.67,3.88,;10,1.57,;10,.03,;11.34,2.34,;12.67,1.57,;4.67,1.57,;2,.03,;3.33,-.74,;.67,-.74,;-.67,.03,;.67,-2.28,;-.58,-3.19,;-2.04,-2.71,;-.1,-4.65,;1.44,-4.65,;1.91,-3.19,;3.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@@H](CN(C)C)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:20.21,(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;4.67,3.88,;6,4.65,;7.34,3.88,;7.34,2.34,;8.67,1.57,;10,2.34,;11.34,1.57,;10,3.88,;6,1.57,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;.75,-3.19,;-.71,-2.71,;1.23,-4.65,;2.77,-4.65,;3.25,-3.19,;4.71,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@@H](CN(C)S(C)(=O)=O)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:20.21,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;4,3.88,;5.33,4.65,;6.67,3.88,;6.67,2.34,;8,1.57,;9.34,2.34,;9.34,3.88,;10.67,1.57,;12,.8,;11.44,2.9,;9.9,.24,;5.33,1.57,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;.09,-3.19,;-1.38,-2.71,;.56,-4.65,;2.1,-4.65,;2.58,-3.19,;4.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@@H](CO)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:20.21,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;5.33,3.88,;6.67,4.65,;8,3.88,;8,2.34,;9.34,1.57,;10.67,2.34,;6.67,1.57,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@H](C)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:20.21,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;6,3.88,;7.34,4.65,;8.67,3.88,;8.67,2.34,;10,1.57,;7.34,1.57,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@H](CN(C)C(=O)N(C)C)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:20.21,(-12.67,2.34,;-11.34,1.57,;-10,2.34,;-8.67,1.57,;-8.67,.03,;-7.34,2.34,;-6,1.57,;-4.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-2,2.34,;-3.33,1.57,;-.67,1.57,;.67,2.34,;2,1.57,;3.33,2.34,;3.33,3.88,;4.67,4.65,;6,3.88,;6,2.34,;7.34,1.57,;8.67,2.34,;8.67,3.88,;10,1.57,;10,.03,;11.34,2.34,;12.67,1.57,;11.34,3.88,;4.67,1.57,;2,.03,;3.33,-.74,;.67,-.74,;-.67,.03,;.67,-2.28,;-.58,-3.19,;-2.04,-2.71,;-.1,-4.65,;1.44,-4.65,;1.91,-3.19,;3.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@H](CN(C)C(=O)OC)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:20.21,(-12.67,2.34,;-11.34,1.57,;-10,2.34,;-8.67,1.57,;-8.67,.03,;-7.34,2.34,;-6,1.57,;-4.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-2,2.34,;-3.33,1.57,;-.67,1.57,;.67,2.34,;2,1.57,;3.33,2.34,;3.33,3.88,;4.67,4.65,;6,3.88,;6,2.34,;7.34,1.57,;8.67,2.34,;8.67,3.88,;10,1.57,;10,.03,;11.34,2.34,;12.67,1.57,;4.67,1.57,;2,.03,;3.33,-.74,;.67,-.74,;-.67,.03,;.67,-2.28,;-.58,-3.19,;-2.04,-2.71,;-.1,-4.65,;1.44,-4.65,;1.91,-3.19,;3.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@H](CN(C)C)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:20.21,(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;4.67,3.88,;6,4.65,;7.34,3.88,;7.34,2.34,;8.67,1.57,;10,2.34,;11.34,1.57,;10,3.88,;6,1.57,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;.75,-3.19,;-.71,-2.71,;1.23,-4.65,;2.77,-4.65,;3.25,-3.19,;4.71,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@H](CN(C)S(C)(=O)=O)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:20.21,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;4,3.88,;5.33,4.65,;6.67,3.88,;6.67,2.34,;8,1.57,;9.34,2.34,;9.34,3.88,;10.67,1.57,;12,.8,;11.76,2.66,;9.58,.48,;5.33,1.57,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;.09,-3.19,;-1.38,-2.71,;.56,-4.65,;2.1,-4.65,;2.58,-3.19,;4.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@H](CNC)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:20.21,(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;4.67,3.88,;6,4.65,;7.34,3.88,;7.34,2.34,;8.67,1.57,;10,2.34,;11.34,1.57,;6,1.57,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;.75,-3.19,;-.71,-2.71,;1.23,-4.65,;2.77,-4.65,;3.25,-3.19,;4.71,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCO[C@H](CO)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:20.21,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;5.33,3.88,;6.67,4.65,;8,3.88,;8,2.34,;9.34,1.57,;10.67,2.34,;6.67,1.57,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCS(=O)(=O)CC2)c(C)c(n1)-c1c(C)noc1C |(-10,1.95,;-8.67,1.18,;-7.34,1.95,;-6,1.18,;-6,-.36,;-4.67,1.95,;-3.33,1.18,;-2,1.95,;-2,3.49,;-.67,4.26,;.67,3.49,;.67,1.95,;-.67,1.18,;2,1.18,;3.33,1.95,;4.67,1.18,;6,1.95,;7.34,1.18,;8.67,1.95,;8.67,3.49,;8.67,5.03,;10,2.72,;7.34,4.26,;6,3.49,;4.67,-.36,;6,-1.13,;3.33,-1.13,;2,-.36,;3.33,-2.67,;4.58,-3.57,;6.04,-3.09,;4.1,-5.03,;2.56,-5.03,;2.09,-3.57,;.62,-3.09,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CC[C@@H](C2)C(=O)N(C)C)c(C)c(n1)-c1c(C)noc1C |r,wD:19.22,(-11.07,2.34,;-9.73,1.57,;-8.4,2.34,;-7.06,1.57,;-7.06,.03,;-5.73,2.34,;-4.4,1.57,;-3.06,2.34,;-3.06,3.88,;-1.73,4.65,;-.4,3.88,;-.4,2.34,;-1.73,1.57,;.94,1.57,;2.27,2.34,;3.6,1.57,;4.94,2.34,;5.1,3.87,;6.61,4.19,;7.38,2.86,;6.35,1.71,;8.91,2.7,;9.81,3.94,;9.53,1.29,;8.63,.04,;11.07,1.13,;3.6,.03,;4.94,-.74,;2.27,-.74,;.94,.03,;2.27,-2.28,;3.52,-3.19,;4.98,-2.71,;3.04,-4.65,;1.5,-4.65,;1.03,-3.19,;-.44,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CC[C@@H](C2)N(C)C(C)=O)c(C)c(n1)-c1c(C)noc1C |r,wD:19.22,(-11.2,1.99,;-9.87,1.22,;-8.54,1.99,;-7.2,1.22,;-7.2,-.32,;-5.87,1.99,;-4.54,1.22,;-3.2,1.99,;-3.2,3.53,;-1.87,4.3,;-.54,3.53,;-.54,1.99,;-1.87,1.22,;.8,1.22,;2.13,1.99,;3.47,1.22,;4.8,1.99,;4.96,3.52,;6.47,3.84,;7.24,2.51,;6.21,1.36,;8.77,2.35,;9.39,.94,;9.67,3.59,;11.2,3.43,;9.05,5,;3.47,-.32,;4.8,-1.09,;2.13,-1.09,;.8,-.32,;2.13,-2.63,;3.38,-3.54,;4.84,-3.06,;2.9,-5,;1.36,-5,;.89,-3.54,;-.58,-3.06,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CC[C@H](C2)S(C)(=O)=O)c(C)c(n1)-c1c(C)noc1C |r,wD:19.22,(-9.82,1.16,;-8.48,.39,;-7.15,1.16,;-5.81,.39,;-5.81,-1.15,;-4.48,1.16,;-3.15,.39,;-1.81,1.16,;-1.81,2.7,;-.48,3.47,;.85,2.7,;.85,1.16,;-.48,.39,;2.19,.39,;3.52,1.16,;4.85,.39,;6.19,1.16,;7.6,.54,;8.63,1.68,;7.86,3.01,;6.35,2.69,;8.48,4.42,;9.11,5.83,;7.15,5.19,;9.82,3.65,;4.85,-1.15,;6.19,-1.92,;3.52,-1.92,;2.19,-1.15,;3.52,-3.46,;2.28,-4.36,;.81,-3.89,;2.75,-5.83,;4.29,-5.83,;4.77,-4.36,;6.23,-3.89,)|
CNCC(O)COc1cccc(c1)-c1nc(N2CCn3ccnc3C2)c(C)c(n1)-c1c(C)noc1C |(-10.52,2.34,;-9.19,1.57,;-7.85,2.34,;-6.52,1.57,;-6.52,.03,;-5.19,2.34,;-3.85,1.57,;-2.52,2.34,;-2.52,3.88,;-1.18,4.65,;.15,3.88,;.15,2.34,;-1.18,1.57,;1.48,1.57,;2.82,2.34,;4.15,1.57,;5.48,2.34,;5.48,3.88,;6.82,4.65,;8.15,3.88,;9.62,4.36,;10.52,3.11,;9.62,1.86,;8.15,2.34,;6.82,1.57,;4.15,.03,;5.48,-.74,;2.82,-.74,;1.48,.03,;2.82,-2.28,;4.06,-3.19,;5.55,-2.79,;3.59,-4.65,;2.05,-4.65,;1.57,-3.19,;.08,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(N2C[C@@H]3CC[C@H](C2)N3C)c(C)c(n1)-c1c(C)noc1C |r,wD:18.25,21.24,THB:24:23:16.17.22:20.19,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;8.67,2.34,;7.13,2.34,;6.57,3.32,;7.34,4.65,;6,3.88,;8.67,3.88,;10,4.65,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;2.09,-3.19,;.62,-2.71,;2.56,-4.65,;4.1,-4.65,;4.58,-3.19,;6.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2C[C@@H]3C[C@H]2CN3C)c(C)c(n1)-c1c(C)noc1C |r,wU:20.20,18.19,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;8.67,2.34,;7.49,3.48,;6,3.88,;7.34,4.65,;8.67,3.88,;10,4.65,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;2.09,-3.19,;.62,-2.71,;2.56,-4.65,;4.1,-4.65,;4.58,-3.19,;6.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N2C[C@H](C)O[C@@H](C)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:21.22,wD:18.19,(-10,1.57,;-8.67,.8,;-7.34,1.57,;-6,.8,;-6,-.74,;-4.67,1.57,;-3.33,.8,;-2,1.57,;-2,3.11,;-.67,3.88,;.67,3.11,;.67,1.57,;-.67,.8,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;6,3.11,;7.34,3.88,;7.34,5.42,;8.67,3.11,;8.67,1.57,;10,.8,;7.34,.8,;4.67,-.74,;6,-1.51,;3.33,-1.51,;2,-.74,;3.33,-3.05,;4.58,-3.96,;6.04,-3.48,;4.1,-5.42,;2.56,-5.42,;2.09,-3.96,;.62,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(N2C[C@H](C)O[C@H](C)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:21.22,18.19,(-10,1.57,;-8.67,.8,;-7.34,1.57,;-6,.8,;-6,-.74,;-4.67,1.57,;-3.33,.8,;-2,1.57,;-2,3.11,;-.67,3.88,;.67,3.11,;.67,1.57,;-.67,.8,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;7.34,.8,;8.67,1.57,;10,.8,;8.67,3.11,;7.34,3.88,;7.34,5.42,;6,3.11,;4.67,-.74,;6,-1.51,;3.33,-1.51,;2,-.74,;3.33,-3.05,;4.58,-3.96,;6.04,-3.48,;4.1,-5.42,;2.56,-5.42,;2.09,-3.96,;.62,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(N2Cc3cccnc3C2)c(C)c(n1)-c1c(C)noc1C |(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.69,-3.22,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.23,-3.22,)|
CNCC(O)COc1cccc(c1)-c1nc(N2[C@H]3CC[C@@H]2CN(C)C3)c(C)c(n1)-c1c(C)noc1C |r,wD:20.21,17.17,THB:15:16:21.22.24:18.19,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;6,3.88,;7.54,3.88,;8.11,2.9,;7.34,1.57,;8.67,2.34,;8.67,3.88,;10,4.65,;7.34,4.65,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;2.09,-3.19,;.62,-2.71,;2.56,-4.65,;4.1,-4.65,;4.58,-3.19,;6.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC(C)C)cc(NC2CCOCC2)n1
CNCC(O)COc1cccc(c1)-c1nc(NC(C)C)cc(n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NC(C)C2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC(C)C2CCOCC2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NC)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NC2(C)CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,3.11,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;2.09,-3.19,;.62,-2.71,;2.56,-4.65,;4.1,-4.65,;4.58,-3.19,;6.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2(C)CCOCC2)c(F)c(n1)-c1c(C)noc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,3.11,;8.67,2.34,;10,1.57,;10,.03,;8.67,-.74,;7.34,.03,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2(C)CCOCC2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NC2(C)CCOCC2)cc(n1)N1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NC2(CC2)C(F)(F)F)c(C)c(n1)-c1c(C)noc1C |(-9.41,2.34,;-8.08,1.57,;-6.75,2.34,;-5.41,1.57,;-5.41,.03,;-4.08,2.34,;-2.74,1.57,;-1.41,2.34,;-1.41,3.88,;-.08,4.65,;1.26,3.88,;1.26,2.34,;-.08,1.57,;2.59,1.57,;3.92,2.34,;5.26,1.57,;6.59,2.34,;7.93,1.57,;7.93,.03,;9.26,.8,;7.93,3.11,;9.41,3.51,;8.32,4.6,;7.16,4.44,;5.26,.03,;6.59,-.74,;3.92,-.74,;2.59,.03,;3.92,-2.28,;2.68,-3.19,;1.19,-2.79,;3.15,-4.65,;4.69,-4.65,;5.17,-3.19,;6.66,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2(CCOC2)C(=O)NC)c(C)c(n1)-c1c(C)noc1C |(-9.69,1.54,;-8.36,.77,;-7.02,1.54,;-5.69,.77,;-5.69,-.77,;-4.35,1.54,;-3.02,.77,;-1.69,1.54,;-1.69,3.08,;-.35,3.85,;.98,3.08,;.98,1.54,;-.35,.77,;2.31,.77,;3.65,1.54,;4.98,.77,;6.32,1.54,;6.32,3.08,;6.79,4.54,;5.55,5.45,;4.3,4.54,;4.78,3.08,;7.8,3.48,;8.89,2.39,;8.2,4.97,;9.69,5.36,;4.98,-.77,;6.32,-1.54,;3.65,-1.54,;2.31,-.77,;3.65,-3.08,;2.4,-3.99,;.94,-3.51,;2.88,-5.45,;4.42,-5.45,;4.89,-3.99,;6.36,-3.51,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2(CO)CC2)c(C)c(n1)-c1c(C)noc1C |(-9.34,2.34,;-8,1.57,;-6.67,2.34,;-5.33,1.57,;-5.33,.03,;-4,2.34,;-2.67,1.57,;-1.33,2.34,;-1.33,3.88,;,4.65,;1.33,3.88,;1.33,2.34,;,1.57,;2.67,1.57,;4,2.34,;5.33,1.57,;6.67,2.34,;8,1.57,;8,3.11,;9.34,3.88,;8,.03,;9.34,.8,;5.33,.03,;6.67,-.74,;4,-.74,;2.67,.03,;4,-2.28,;2.76,-3.19,;1.27,-2.79,;3.23,-4.65,;4.77,-4.65,;5.25,-3.19,;6.73,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2C3COCC23)c(C)c(n1)-c1c(C)noc1C |(-10.27,2.34,;-8.94,1.57,;-7.61,2.34,;-6.27,1.57,;-6.27,.03,;-4.94,2.34,;-3.6,1.57,;-2.27,2.34,;-2.27,3.88,;-.94,4.65,;.4,3.88,;.4,2.34,;-.94,1.57,;1.73,1.57,;3.06,2.34,;4.4,1.57,;5.73,2.34,;7.07,1.57,;7.84,.24,;8.87,-.91,;10.27,-.28,;10.11,1.25,;8.61,1.57,;4.4,.03,;5.73,-.74,;3.06,-.74,;1.73,.03,;3.06,-2.28,;4.31,-3.19,;5.77,-2.71,;3.83,-4.65,;2.29,-4.65,;1.82,-3.19,;.35,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CC(F)C2)c(C)c(n1)-c1c(C)noc1C |(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;7.46,.08,;8.95,.48,;10.28,-.29,;8.55,1.97,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;1.81,-3.19,;.32,-2.79,;2.29,-4.65,;3.83,-4.65,;4.3,-3.19,;5.79,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CC2)c(C)c(n1)-c1c(C)noc1C |(-9.44,2.34,;-8.11,1.57,;-6.77,2.34,;-5.44,1.57,;-5.44,.03,;-4.1,2.34,;-2.77,1.57,;-1.44,2.34,;-1.44,3.88,;-.1,4.65,;1.23,3.88,;1.23,2.34,;-.1,1.57,;2.56,1.57,;3.9,2.34,;5.23,1.57,;6.57,2.34,;7.9,1.57,;8.67,.24,;9.44,1.57,;5.23,.03,;6.57,-.74,;3.9,-.74,;2.56,.03,;3.9,-2.28,;5.14,-3.19,;6.61,-2.71,;4.67,-4.65,;3.13,-4.65,;2.65,-3.19,;1.19,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CC2)cc(NC2CCOCC2)n1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCC2)c(C)c(n1)-c1c(C)noc1C |(-9.61,2.34,;-8.28,1.57,;-6.94,2.34,;-5.61,1.57,;-5.61,.03,;-4.28,2.34,;-2.94,1.57,;-1.61,2.34,;-1.61,3.88,;-.28,4.65,;1.06,3.88,;1.06,2.34,;-.28,1.57,;2.39,1.57,;3.72,2.34,;5.06,1.57,;6.39,2.34,;7.73,1.57,;8.12,.08,;9.61,.48,;9.21,1.97,;5.06,.03,;6.39,-.74,;3.72,-.74,;2.39,.03,;3.72,-2.28,;4.97,-3.19,;6.44,-2.71,;4.49,-4.65,;2.95,-4.65,;2.48,-3.19,;1.01,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCCC2)c(C)c(n1)-c1c(C)noc1C |(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;7.61,.04,;9.12,-.28,;9.89,1.05,;8.86,2.2,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;4.7,-3.19,;6.16,-2.71,;4.22,-4.65,;2.68,-4.65,;2.2,-3.19,;.74,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCCC2)c(C)c(n1)N1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCCN(C2)C(=O)C2CC2)c(C)c(n1)-c1c(C)noc1C |(-12.11,2.34,;-10.77,1.57,;-9.44,2.34,;-8.11,1.57,;-8.11,.03,;-6.77,2.34,;-5.44,1.57,;-4.1,2.34,;-4.1,3.88,;-2.77,4.65,;-1.44,3.88,;-1.44,2.34,;-2.77,1.57,;-.1,1.57,;1.23,2.34,;2.56,1.57,;3.9,2.34,;5.23,1.57,;5.23,.03,;6.57,-.74,;7.9,.03,;7.9,1.57,;6.57,2.34,;9.23,2.34,;9.23,3.88,;10.57,1.57,;11.34,.24,;12.11,1.57,;2.56,.03,;3.9,-.74,;1.23,-.74,;-.1,.03,;1.23,-2.28,;2.48,-3.19,;3.94,-2.71,;2,-4.65,;.46,-4.65,;-.02,-3.19,;-1.48,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCCN(C2)C(=O)N(C)C)c(C)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,2.34,;9.34,3.88,;10.67,1.57,;10.67,.03,;12,2.34,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCCN(C2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,2.34,;9.34,3.88,;10.67,1.57,;12,2.34,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCCN(C2)C2COC2)c(C)c(n1)-c1c(C)noc1C |(-11.61,2.34,;-10.28,1.57,;-8.95,2.34,;-7.61,1.57,;-7.61,.03,;-6.28,2.34,;-4.94,1.57,;-3.61,2.34,;-3.61,3.88,;-2.28,4.65,;-.94,3.88,;-.94,2.34,;-2.28,1.57,;.39,1.57,;1.72,2.34,;3.06,1.57,;4.39,2.34,;5.73,1.57,;5.73,.03,;7.06,-.74,;8.39,.03,;8.39,1.57,;7.06,2.34,;9.73,2.34,;11.21,1.94,;11.61,3.43,;10.12,3.83,;3.06,.03,;4.39,-.74,;1.72,-.74,;.39,.03,;1.72,-2.28,;2.97,-3.19,;4.43,-2.71,;2.49,-4.65,;.95,-4.65,;.48,-3.19,;-.99,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCCN(C2)S(C)(=O)=O)c(C)c(n1)-c1c(C)noc1C |(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;6,1.57,;6,.03,;7.34,-.74,;8.67,.03,;8.67,1.57,;7.34,2.34,;10,2.34,;11.34,3.11,;9.23,3.67,;10.77,1.01,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;3.25,-3.19,;4.71,-2.71,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.71,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCCN(CC(F)F)C2)c(C)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;9.34,2.34,;10.67,1.57,;12,2.34,;10.67,.03,;6.67,2.34,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCC[C@H]2O)c(C)c(n1)-c1c(C)noc1C |r,wD:21.23,(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;7.61,.04,;9.12,-.28,;9.89,1.05,;8.86,2.2,;9.18,3.7,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;2.2,-3.19,;.74,-2.71,;2.68,-4.65,;4.22,-4.65,;4.7,-3.19,;6.16,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(C2)C(=O)C2CC2)c(C)c(n1)-c1c(C)noc1C |(-11.84,2.34,;-10.5,1.57,;-9.17,2.34,;-7.83,1.57,;-7.83,.03,;-6.5,2.34,;-5.17,1.57,;-3.83,2.34,;-3.83,3.88,;-2.5,4.65,;-1.17,3.88,;-1.17,2.34,;-2.5,1.57,;.17,1.57,;1.5,2.34,;2.83,1.57,;4.17,2.34,;5.5,1.57,;5.66,.04,;7.17,-.28,;7.94,1.05,;6.91,2.2,;9.47,1.21,;10.08,2.63,;10.41,-.01,;10.62,-1.53,;11.84,-.59,;2.83,.03,;4.17,-.74,;1.5,-.74,;.17,.03,;1.5,-2.28,;2.75,-3.19,;4.21,-2.71,;2.27,-4.65,;.73,-4.65,;.26,-3.19,;-1.21,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(C2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-11.89,2.34,;-10.55,1.57,;-9.22,2.34,;-7.89,1.57,;-7.89,.03,;-6.55,2.34,;-5.22,1.57,;-3.88,2.34,;-3.88,3.88,;-2.55,4.65,;-1.22,3.88,;-1.22,2.34,;-2.55,1.57,;.12,1.57,;1.45,2.34,;2.78,1.57,;4.12,2.34,;5.45,1.57,;5.61,.04,;7.12,-.28,;7.89,1.05,;6.86,2.2,;9.42,1.21,;10.03,2.63,;10.36,-.01,;11.89,.2,;2.78,.03,;4.12,-.74,;1.45,-.74,;.12,.03,;1.45,-2.28,;2.7,-3.19,;4.16,-2.71,;2.22,-4.65,;.68,-4.65,;.2,-3.19,;-1.26,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(C2)C2COC2)c(C)c(n1)-c1c(C)noc1C |(-11.73,2.34,;-10.4,1.57,;-9.07,2.34,;-7.73,1.57,;-7.73,.03,;-6.4,2.34,;-5.06,1.57,;-3.73,2.34,;-3.73,3.88,;-2.4,4.65,;-1.06,3.88,;-1.06,2.34,;-2.4,1.57,;.27,1.57,;1.6,2.34,;2.94,1.57,;4.27,2.34,;5.61,1.57,;5.77,.04,;7.27,-.28,;8.04,1.05,;7.01,2.2,;9.57,1.21,;10.8,.28,;11.73,1.5,;10.51,2.44,;2.94,.03,;4.27,-.74,;1.6,-.74,;.27,.03,;1.6,-2.28,;.36,-3.19,;-1.11,-2.71,;.83,-4.65,;2.37,-4.65,;2.85,-3.19,;4.31,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(CC(F)F)C2)c(C)c(n1)-c1c(C)noc1C |(-11.87,2.34,;-10.54,1.57,;-9.2,2.34,;-7.87,1.57,;-7.87,.03,;-6.54,2.34,;-5.2,1.57,;-3.87,2.34,;-3.87,3.88,;-2.54,4.65,;-1.2,3.88,;-1.2,2.34,;-2.54,1.57,;.13,1.57,;1.47,2.34,;2.8,1.57,;4.13,2.34,;5.47,1.57,;5.63,.04,;7.13,-.28,;7.9,1.05,;9.44,1.21,;10.34,-.03,;11.87,.13,;9.71,-1.44,;6.87,2.2,;2.8,.03,;4.13,-.74,;1.47,-.74,;.13,.03,;1.47,-2.28,;2.71,-3.19,;4.18,-2.71,;2.24,-4.65,;.7,-4.65,;.22,-3.19,;-1.25,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(CC(F)F)CC2)c(C)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;9.34,-.74,;10.67,.03,;12,-.74,;10.67,1.57,;8,1.57,;6.67,2.34,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(CC2)C(=O)C2CC2)c(C)c(n1)-c1c(C)noc1C |(-12.11,2.34,;-10.77,1.57,;-9.44,2.34,;-8.11,1.57,;-8.11,.03,;-6.77,2.34,;-5.44,1.57,;-4.1,2.34,;-4.1,3.88,;-2.77,4.65,;-1.44,3.88,;-1.44,2.34,;-2.77,1.57,;-.1,1.57,;1.23,2.34,;2.56,1.57,;3.9,2.34,;5.23,1.57,;5.23,.03,;6.57,-.74,;7.9,.03,;7.9,1.57,;6.57,2.34,;9.23,-.74,;9.23,-2.28,;10.57,.03,;12.11,.03,;11.34,1.36,;2.56,.03,;3.9,-.74,;1.23,-.74,;-.1,.03,;1.23,-2.28,;2.48,-3.19,;3.94,-2.71,;2,-4.65,;.46,-4.65,;-.02,-3.19,;-1.48,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(CC2)C(=O)N(C)C)c(C)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;10.67,1.57,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;.09,-3.19,;-1.38,-2.71,;.56,-4.65,;2.1,-4.65,;2.58,-3.19,;4.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(Cl)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(CC2)C(=O)OC)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(CC2)C2CC2)c(C)c(n1)-c1c(C)noc1C |(-11.44,2.34,;-10.11,1.57,;-8.77,2.34,;-7.44,1.57,;-7.44,.03,;-6.1,2.34,;-4.77,1.57,;-3.44,2.34,;-3.44,3.88,;-2.1,4.65,;-.77,3.88,;-.77,2.34,;-2.1,1.57,;.56,1.57,;1.9,2.34,;3.23,1.57,;4.56,2.34,;5.9,1.57,;7.23,2.34,;8.57,1.57,;8.57,.03,;7.23,-.74,;5.9,.03,;9.9,-.74,;10.67,-2.07,;11.44,-.74,;3.23,.03,;4.56,-.74,;1.9,-.74,;.56,.03,;1.9,-2.28,;3.14,-3.19,;4.61,-2.71,;2.67,-4.65,;1.13,-4.65,;.65,-3.19,;-.81,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(CC2)C2COC2)c(C)c(n1)-c1c(C)noc1C |(-11.61,2.34,;-10.28,1.57,;-8.95,2.34,;-7.61,1.57,;-7.61,.03,;-6.28,2.34,;-4.94,1.57,;-3.61,2.34,;-3.61,3.88,;-2.28,4.65,;-.94,3.88,;-.94,2.34,;-2.28,1.57,;.39,1.57,;1.72,2.34,;3.06,1.57,;4.39,2.34,;5.73,1.57,;5.73,.03,;7.06,-.74,;8.39,.03,;8.39,1.57,;7.06,2.34,;9.73,-.74,;10.12,-2.23,;11.61,-1.83,;11.21,-.34,;3.06,.03,;4.39,-.74,;1.72,-.74,;.39,.03,;1.72,-2.28,;2.97,-3.19,;4.43,-2.71,;2.49,-4.65,;.95,-4.65,;.48,-3.19,;-.99,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCN(C[C@H]2F)C(=O)OC(C)(C)C)c(C)c(n1)-c1c(C)noc1C |r,wD:22.24,(-12.67,2.34,;-11.34,1.57,;-10,2.34,;-8.67,1.57,;-8.67,.03,;-7.34,2.34,;-6,1.57,;-4.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-2,2.34,;-3.33,1.57,;-.67,1.57,;.67,2.34,;2,1.57,;3.33,2.34,;4.67,1.57,;4.67,.03,;6,-.74,;7.34,.03,;7.34,1.57,;6,2.34,;6,3.88,;8.67,-.74,;8.67,-2.28,;10,.03,;11.34,-.74,;12.67,.03,;11.34,-2.28,;12.67,-1.51,;2,.03,;3.33,-.74,;.67,-.74,;-.67,.03,;.67,-2.28,;1.91,-3.19,;3.38,-2.71,;1.44,-4.65,;-.1,-4.65,;-.58,-3.19,;-2.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCNCC2)cc(n1)-c1ccncc1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCNC[C@H]2F)c(C)c(n1)-c1c(C)noc1C |r,wD:22.24,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;8.67,3.88,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC(C)(C)C2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,-.74,;9.34,.03,;9.34,1.57,;10.67,.8,;10.67,2.34,;8,2.34,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC(C)C2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,-.74,;9.34,.03,;9.34,1.57,;10.67,2.34,;8,2.34,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)-c1cn(C)nn1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)C(=O)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)C(=O)NC
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)C(=O)NC1CCN(C)CC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)C(=O)NC1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CC(N)CC(Cl)C1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CC2(CCNCC2)c2ccccc12
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CC2CC(C1)N2
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCC(O)(CCO)CC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCC2(CCCO2)CC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCC2(CCO2)CC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCCC2(CCOCC2)C1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCN(C(=O)OC)C(C)(C)C1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCN(C)C(C)(C)C1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCN(CC(F)(F)F)CC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCN(CC(F)F)C(C)(C)C1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCN(CCF)CC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCN(C[C@H]1C)C(C)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCN2[C@H](COC2=O)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCNC(C1)C(F)(F)F
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCNC[C@H]1C |r|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CCN[C@@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)c(C)c(n1)N1CC[C@@H](C1)S(C)(=O)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOC2=O)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C(F)F)c(n1)-c1c(C)noc1C |(-8.75,1.18,;-7.41,.41,;-6.08,1.18,;-4.74,.41,;-4.74,-1.13,;-3.41,1.18,;-2.08,.41,;-.74,1.18,;-.74,2.72,;.59,3.49,;1.92,2.72,;1.92,1.18,;.59,.41,;3.26,.41,;4.59,1.18,;5.92,.41,;7.26,1.18,;7.26,2.72,;8.59,3.49,;8.59,5.03,;7.26,5.8,;5.92,5.03,;5.92,3.49,;5.92,-1.13,;7.26,-1.9,;8.35,-2.98,;8.75,-1.5,;4.59,-1.9,;3.26,-1.13,;4.59,-3.44,;5.84,-4.34,;7.3,-3.86,;5.36,-5.8,;3.82,-5.8,;3.35,-4.34,;1.88,-3.86,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)n[nH]c1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.07,-2.79,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.6,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)nn(C)c1C |(-9.22,2.26,;-7.89,1.49,;-6.55,2.26,;-5.22,1.49,;-5.22,-.05,;-3.89,2.26,;-2.55,1.49,;-1.22,2.26,;-1.22,3.8,;.11,4.57,;1.45,3.8,;1.45,2.26,;.11,1.49,;2.78,1.49,;2.78,-.05,;4.12,-.82,;4.12,-2.36,;5.45,-3.13,;5.45,-4.67,;6.78,-5.44,;8.12,-4.67,;8.12,-3.13,;6.78,-2.36,;5.45,-.05,;6.78,-.82,;5.45,1.49,;4.12,2.26,;6.78,2.26,;8.19,1.63,;8.59,.14,;9.22,2.78,;8.45,4.11,;9.22,5.44,;6.94,3.79,;5.86,4.88,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-9.22,2.57,;-7.89,1.8,;-6.55,2.57,;-5.22,1.8,;-5.22,.26,;-3.89,2.57,;-2.55,1.8,;-1.22,2.57,;-1.22,4.11,;.11,4.88,;1.45,4.11,;1.45,2.57,;.11,1.8,;2.78,1.8,;2.78,.26,;4.12,-.51,;4.12,-2.05,;5.45,-2.82,;5.45,-4.36,;6.78,-5.13,;8.12,-4.36,;8.12,-2.82,;6.78,-2.05,;5.45,.26,;6.78,-.51,;5.45,1.8,;4.12,2.57,;6.78,2.57,;6.94,4.1,;5.8,5.13,;8.45,4.42,;9.22,3.09,;8.19,1.94,;8.51,.44,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C1CC1 |(-8.78,1.18,;-7.44,.41,;-6.11,1.18,;-4.78,.41,;-4.78,-1.13,;-3.44,1.18,;-2.11,.41,;-.77,1.18,;-.77,2.72,;.56,3.49,;1.89,2.72,;1.89,1.18,;.56,.41,;3.23,.41,;4.56,1.18,;5.89,.41,;7.23,1.18,;7.23,2.72,;8.56,3.49,;8.56,5.03,;7.23,5.8,;5.89,5.03,;5.89,3.49,;5.89,-1.13,;7.23,-1.9,;4.56,-1.9,;3.23,-1.13,;4.56,-3.44,;3.31,-4.34,;1.85,-3.86,;3.79,-5.8,;5.33,-5.8,;5.81,-4.34,;7.27,-3.86,;8.78,-4.18,;8.3,-2.72,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1CO |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.07,-2.79,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.6,-2.79,;-.49,-3.88,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)onc1CO |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;2.09,-3.19,;.62,-2.71,;2.56,-4.65,;4.1,-4.65,;4.58,-3.19,;6.04,-2.71,;7.19,-3.74,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)N(C1CC1)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)N1CCN(CC1)C(C)=O
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)N1CCN(CC1)C(C)C
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)N1CCN(CC1)C1CC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)N1CCN(CC1)S(C)(=O)=O
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)N1CCNC(C)(C)C1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)N1CCNC(C)C1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(CO)c(n1)-c1c(C)noc1C |(-8.67,1.18,;-7.34,.41,;-6,1.18,;-4.67,.41,;-4.67,-1.13,;-3.33,1.18,;-2,.41,;-.67,1.18,;-.67,2.72,;.67,3.49,;2,2.72,;2,1.18,;.67,.41,;3.33,.41,;4.67,1.18,;6,.41,;7.34,1.18,;7.34,2.72,;8.67,3.49,;8.67,5.03,;7.34,5.8,;6,5.03,;6,3.49,;6,-1.13,;7.34,-1.9,;8.67,-1.13,;4.67,-1.9,;3.33,-1.13,;4.67,-3.44,;5.91,-4.34,;7.38,-3.86,;5.44,-5.8,;3.9,-5.8,;3.42,-4.34,;1.96,-3.86,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(F)c(n1)-c1c(C)noc1C |(-8.67,1.18,;-7.34,.41,;-6,1.18,;-4.67,.41,;-4.67,-1.13,;-3.33,1.18,;-2,.41,;-.67,1.18,;-.67,2.72,;.67,3.49,;2,2.72,;2,1.18,;.67,.41,;3.33,.41,;4.67,1.18,;6,.41,;7.34,1.18,;7.34,2.72,;8.67,3.49,;8.67,5.03,;7.34,5.8,;6,5.03,;6,3.49,;6,-1.13,;7.34,-1.9,;4.67,-1.9,;3.33,-1.13,;4.67,-3.44,;3.42,-4.34,;1.96,-3.86,;3.9,-5.8,;5.44,-5.8,;5.91,-4.34,;7.38,-3.86,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1c(C)n[nH]c1C
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1c(C)nn(C)c1C
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1cc2ccccc2o1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1ccc(OC)c(OC)c1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1ccc(cc1)S(C)(=O)=O
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1ccc(nc1)C(F)(F)F
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1ccc2OCCOc2c1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1cccc(c1)C#N
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1cccc2ncccc12
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1ccnc(OC)c1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1cncnc1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1cnn(CC(C)C)c1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)C#C
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)C(=C(\C)N)\C(C)=O
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)C(Cl)=C
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)C1CC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)N(C)C
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)N(C1CC1)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)N(C1CC1)[C@@H]1CCOC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)N1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NC2CCOCC2C)c(C)c(n1)-c1c(C)noc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;8.67,3.88,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCS(=O)(=O)CC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;9.34,.03,;9.34,-1.51,;10.67,.8,;8,-.74,;6.67,.03,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CCS(=O)(=O)CC2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NC2CN(C2)C(=O)C2CC2)c(C)c(n1)-c1c(C)noc1C |(-11.72,2.34,;-10.38,1.57,;-9.05,2.34,;-7.71,1.57,;-7.71,.03,;-6.38,2.34,;-5.05,1.57,;-3.71,2.34,;-3.71,3.88,;-2.38,4.65,;-1.05,3.88,;-1.05,2.34,;-2.38,1.57,;.29,1.57,;1.62,2.34,;2.95,1.57,;4.29,2.34,;5.62,1.57,;6.02,.08,;7.51,.48,;7.11,1.97,;8.84,-.29,;8.84,-1.83,;10.18,.48,;11.72,.48,;10.95,1.81,;2.95,.03,;4.29,-.74,;1.62,-.74,;.29,.03,;1.62,-2.28,;2.87,-3.19,;4.33,-2.71,;2.39,-4.65,;.85,-4.65,;.38,-3.19,;-1.09,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CN(C2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-11.61,2.34,;-10.28,1.57,;-8.95,2.34,;-7.61,1.57,;-7.61,.03,;-6.28,2.34,;-4.94,1.57,;-3.61,2.34,;-3.61,3.88,;-2.28,4.65,;-.94,3.88,;-.94,2.34,;-2.28,1.57,;.39,1.57,;1.72,2.34,;3.06,1.57,;4.39,2.34,;5.73,1.57,;6.12,.08,;7.61,.48,;7.21,1.97,;8.95,-.29,;8.95,-1.83,;10.28,.48,;11.61,-.29,;3.06,.03,;4.39,-.74,;1.72,-.74,;.39,.03,;1.72,-2.28,;2.97,-3.19,;4.43,-2.71,;2.49,-4.65,;.95,-4.65,;.48,-3.19,;-.99,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CN(CC(F)F)C2)c(C)c(n1)-c1c(C)noc1C |(-11.61,2.34,;-10.28,1.57,;-8.95,2.34,;-7.61,1.57,;-7.61,.03,;-6.28,2.34,;-4.94,1.57,;-3.61,2.34,;-3.61,3.88,;-2.28,4.65,;-.94,3.88,;-.94,2.34,;-2.28,1.57,;.39,1.57,;1.72,2.34,;3.06,1.57,;4.39,2.34,;5.73,1.57,;6.12,.08,;7.61,.48,;8.95,-.29,;10.28,.48,;11.61,-.29,;10.28,2.02,;7.21,1.97,;3.06,.03,;4.39,-.74,;1.72,-.74,;.39,.03,;1.72,-2.28,;.48,-3.19,;-.99,-2.71,;.95,-4.65,;2.49,-4.65,;2.97,-3.19,;4.43,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2CNC2)c(C)c(n1)-c1c(C)noc1C |(-9.61,2.34,;-8.28,1.57,;-6.94,2.34,;-5.61,1.57,;-5.61,.03,;-4.28,2.34,;-2.94,1.57,;-1.61,2.34,;-1.61,3.88,;-.28,4.65,;1.06,3.88,;1.06,2.34,;-.28,1.57,;2.39,1.57,;3.72,2.34,;5.06,1.57,;6.39,2.34,;7.73,1.57,;8.12,.08,;9.61,.48,;9.21,1.97,;5.06,.03,;6.39,-.74,;3.72,-.74,;2.39,.03,;3.72,-2.28,;2.48,-3.19,;.99,-2.79,;2.95,-4.65,;4.49,-4.65,;4.97,-3.19,;6.46,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2COC2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NC2C[C@@H](O)[C@H](O)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:19.20,wD:21.22,(-10.65,2.34,;-9.32,1.57,;-7.99,2.34,;-6.65,1.57,;-6.65,.03,;-5.32,2.34,;-3.98,1.57,;-2.65,2.34,;-2.65,3.88,;-1.32,4.65,;.02,3.88,;.02,2.34,;-1.32,1.57,;1.35,1.57,;2.68,2.34,;4.02,1.57,;5.35,2.34,;6.68,1.57,;8.09,2.2,;9.12,1.05,;10.65,1.21,;8.35,-.28,;8.98,-1.69,;6.85,.04,;4.02,.03,;5.35,-.74,;2.68,-.74,;1.35,.03,;2.68,-2.28,;3.93,-3.19,;5.39,-2.71,;3.45,-4.65,;1.91,-4.65,;1.44,-3.19,;-.03,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC2C[C@@H]3CC[C@H](C2)N3C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:19.26,22.25,THB:25:24:17.18.23:20.21,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;5.9,.59,;6.46,1.57,;8,1.57,;6.67,2.34,;8,.03,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC(F)(F)F)cc(n1)-c1ccc(cc1)S(C)(=O)=O
CNCC(O)COc1cccc(c1)-c1nc(NCC(F)(F)F)cc(n1)-c1cncnc1
CNCC(O)COc1cccc(c1)-c1nc(NCC2(C)CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;8,.8,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2(CCOCC2)N(C)C)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;8,.8,;9.34,.03,;6.67,.03,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2(CCOCC2)N2CC(F)(F)C2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;8,.8,;6.91,-.29,;8,-1.38,;6.91,-2.47,;9.09,-2.47,;9.09,-.29,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2(CCOCC2)N2CCC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;8,.8,;6.91,-.29,;8,-1.38,;9.09,-.29,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2(CCOCC2)OC)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;8,.8,;9.34,.03,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2(CCl)CCOCC2)cc(n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NCC2(O)CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;8,.8,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCCN(CC(F)F)C2)c(C)c(n1)-c1c(C)noc1C |(-12.67,2.34,;-11.34,1.57,;-10,2.34,;-8.67,1.57,;-8.67,.03,;-7.34,2.34,;-6,1.57,;-4.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-2,2.34,;-3.33,1.57,;-.67,1.57,;.67,2.34,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;6,3.88,;7.34,4.65,;8.67,3.88,;8.67,2.34,;10,1.57,;11.34,2.34,;12.67,1.57,;11.34,3.88,;7.34,1.57,;2,.03,;3.33,-.74,;.67,-.74,;-.67,.03,;.67,-2.28,;1.91,-3.19,;3.38,-2.71,;1.44,-4.65,;-.1,-4.65,;-.58,-3.19,;-2.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCN(CC(F)F)CC2)c(C)c(n1)-c1c(C)noc1C |(-12.67,2.34,;-11.34,1.57,;-10,2.34,;-8.67,1.57,;-8.67,.03,;-7.34,2.34,;-6,1.57,;-4.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-2,2.34,;-3.33,1.57,;-.67,1.57,;.67,2.34,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;8.67,2.34,;8.67,3.88,;10,4.65,;11.34,3.88,;11.34,2.34,;12.67,4.65,;7.34,4.65,;6,3.88,;2,.03,;3.33,-.74,;.67,-.74,;-.67,.03,;.67,-2.28,;1.91,-3.19,;3.38,-2.71,;1.44,-4.65,;-.1,-4.65,;-.58,-3.19,;-2.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCN(CC2)C(=O)C2CC2)c(C)c(n1)-c1c(C)noc1C |(-12.77,1.57,;-11.44,.8,;-10.11,1.57,;-8.77,.8,;-8.77,-.74,;-7.44,1.57,;-6.1,.8,;-4.77,1.57,;-4.77,3.11,;-3.44,3.88,;-2.1,3.11,;-2.1,1.57,;-3.44,.8,;-.77,.8,;.56,1.57,;1.9,.8,;3.23,1.57,;4.56,.8,;5.9,1.57,;7.23,.8,;8.57,1.57,;8.57,3.11,;7.23,3.88,;5.9,3.11,;9.9,3.88,;9.9,5.42,;11.23,3.11,;12,1.78,;12.77,3.11,;1.9,-.74,;3.23,-1.51,;.56,-1.51,;-.77,-.74,;.56,-3.05,;1.81,-3.96,;3.27,-3.48,;1.33,-5.42,;-.21,-5.42,;-.68,-3.96,;-2.15,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCN(CC2)C(=O)N(C)C)c(C)c(n1)-c1c(C)noc1C |(-12.67,1.57,;-11.34,.8,;-10,1.57,;-8.67,.8,;-8.67,-.74,;-7.34,1.57,;-6,.8,;-4.67,1.57,;-4.67,3.11,;-3.33,3.88,;-2,3.11,;-2,1.57,;-3.33,.8,;-.67,.8,;.67,1.57,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;7.34,.8,;8.67,1.57,;8.67,3.11,;7.34,3.88,;6,3.11,;10,3.88,;10,5.42,;11.34,3.11,;11.34,1.57,;12.67,3.88,;2,-.74,;3.33,-1.51,;.67,-1.51,;-.67,-.74,;.67,-3.05,;1.91,-3.96,;3.38,-3.48,;1.44,-5.42,;-.1,-5.42,;-.58,-3.96,;-2.04,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-12.67,1.57,;-11.34,.8,;-10,1.57,;-8.67,.8,;-8.67,-.74,;-7.34,1.57,;-6,.8,;-4.67,1.57,;-4.67,3.11,;-3.33,3.88,;-2,3.11,;-2,1.57,;-3.33,.8,;-.67,.8,;.67,1.57,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;7.34,.8,;8.67,1.57,;8.67,3.11,;7.34,3.88,;6,3.11,;10,3.88,;10,5.42,;11.34,3.11,;12.67,3.88,;2,-.74,;3.33,-1.51,;.67,-1.51,;-.67,-.74,;.67,-3.05,;1.91,-3.96,;3.38,-3.48,;1.44,-5.42,;-.1,-5.42,;-.58,-3.96,;-2.04,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCN(CC2)C2CC2)c(C)c(n1)-c1c(C)noc1C |(-12.11,1.67,;-10.77,.9,;-9.44,1.67,;-8.11,.9,;-8.11,-.64,;-6.77,1.67,;-5.44,.9,;-4.1,1.67,;-4.1,3.21,;-2.77,3.98,;-1.44,3.21,;-1.44,1.67,;-2.77,.9,;-.1,.9,;1.23,1.67,;2.56,.9,;3.9,1.67,;5.23,.9,;6.57,1.67,;7.9,.9,;9.23,1.67,;9.23,3.21,;7.9,3.98,;6.57,3.21,;10.57,3.98,;12.11,3.98,;11.34,5.32,;2.56,-.64,;3.9,-1.41,;1.23,-1.41,;-.1,-.64,;1.23,-2.95,;2.48,-3.85,;3.94,-3.38,;2,-5.32,;.46,-5.32,;-.02,-3.85,;-1.48,-3.38,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCN(CC2)C2COC2)c(C)c(n1)-c1c(C)noc1C |(-12.28,1.6,;-10.95,.83,;-9.61,1.6,;-8.28,.83,;-8.28,-.71,;-6.94,1.6,;-5.61,.83,;-4.28,1.6,;-4.28,3.14,;-2.94,3.91,;-1.61,3.14,;-1.61,1.6,;-2.94,.83,;-.28,.83,;1.06,1.6,;2.39,.83,;3.72,1.6,;5.06,.83,;6.39,1.6,;7.73,.83,;9.06,1.6,;9.06,3.14,;7.73,3.91,;6.39,3.14,;10.39,3.91,;11.88,3.51,;12.28,5,;10.79,5.39,;2.39,-.71,;3.72,-1.48,;1.06,-1.48,;-.28,-.71,;1.06,-3.02,;2.3,-3.93,;3.77,-3.45,;1.83,-5.39,;.29,-5.39,;-.19,-3.93,;-1.65,-3.45,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCNCC2)cc(n1)-c1ccncc1
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCOCC2)c(Cl)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCOCC2)c(F)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCOCC2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NCC2CCOCC2)cc(n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NCC2CN(C)CCO2)c(C)c(n1)-c1c(C)noc1C |(-10.67,1.57,;-9.34,.8,;-8,1.57,;-6.67,.8,;-6.67,-.74,;-5.33,1.57,;-4,.8,;-2.67,1.57,;-2.67,3.11,;-1.33,3.88,;,3.11,;,1.57,;-1.33,.8,;1.33,.8,;2.67,1.57,;4,.8,;5.33,1.57,;6.67,.8,;8,1.57,;8,3.11,;9.34,3.88,;9.34,5.42,;10.67,3.11,;10.67,1.57,;9.34,.8,;4,-.74,;5.33,-1.51,;2.67,-1.51,;1.33,-.74,;2.67,-3.05,;3.91,-3.96,;5.38,-3.48,;3.44,-5.42,;1.9,-5.42,;1.42,-3.96,;-.04,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(NCCCCN2CCCC2=O)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NCCCCl)c(C)c(N[C@@H]2CCOC2)n1 |r|
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)-c1cc2ccccc2o1
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)-c1ccc(OC)c(OC)c1
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)-c1ccc(cc1)S(C)(=O)=O
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)-c1ccc(nc1)C(F)(F)F
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)-c1ccc2OCCOc2c1
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)-c1cccc2ncccc12
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)-c1ccnc(OC)c1
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)-c1cncnc1
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)-c1cnn(CC(C)C)c1
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCC2=O)cc(n1)C1=CCCC1 |t:32|
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCCCC2=O)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NCCCN2CCCCCC2=O)cc(n1)N1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1cc2ccccc2o1
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1ccc(OC)c(OC)c1
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1ccc(cc1)S(C)(=O)=O
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1ccc(nc1)C(F)(F)F
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1ccc2OCCOc2c1
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1cccc(c1)C#N
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1cccc2ncccc12
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1ccnc(OC)c1
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1cncnc1
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)-c1cnn(CC(C)C)c1
CNCC(O)COc1cccc(c1)-c1nc(NCCOC)cc(n1)C1=CCCC1 |t:26|
CNCC(O)COc1cccc(c1)-c1nc(NCN2CCN(CC(F)F)[C@@H](C)C2)cc(n1)-c1c(C)noc1C |r|
CNCC(O)COc1cccc(c1)-c1nc(NC[C@@H]2CN(CCO2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:18.18,(-11.34,1.18,;-10,.41,;-8.67,1.18,;-7.34,.41,;-7.34,-1.13,;-6,1.18,;-4.67,.41,;-3.33,1.18,;-3.33,2.72,;-2,3.49,;-.67,2.72,;-.67,1.18,;-2,.41,;.67,.41,;2,1.18,;3.33,.41,;4.67,1.18,;6,.41,;7.34,1.18,;7.34,2.72,;8.67,3.49,;10,2.72,;10,1.18,;8.67,.41,;8.67,5.03,;7.34,5.8,;10,5.8,;11.34,5.03,;3.33,-1.13,;4.67,-1.9,;2,-1.9,;.67,-1.13,;2,-3.44,;3.25,-4.34,;4.71,-3.86,;2.77,-5.8,;1.23,-5.8,;.75,-4.34,;-.71,-3.86,)|
CNCC(O)COc1cccc(c1)-c1nc(NC[C@H]2COCCN2C(=O)N(C)C)c(C)c(n1)-c1c(C)noc1C |r,wU:18.18,(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;6,1.57,;7.34,2.34,;7.34,3.88,;8.67,4.65,;10,3.88,;10,2.34,;8.67,1.57,;8.67,.03,;7.34,-.74,;10,-.74,;11.34,.03,;10,-2.28,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;3.25,-3.19,;4.71,-2.71,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.71,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NC[C@H]2COCCN2CC(F)F)c(C)c(n1)-c1c(C)noc1C |r,wU:18.18,(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;6,1.57,;7.34,2.34,;7.34,3.88,;8.67,4.65,;10,3.88,;10,2.34,;8.67,1.57,;8.67,.03,;10,-.74,;10,-2.28,;11.34,.03,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;3.25,-3.19,;4.71,-2.71,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.71,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(NCc2ccncc2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCC[C@@H]2O)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,21.23,(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;7.61,.04,;9.12,-.28,;9.89,1.05,;8.86,2.2,;9.18,3.7,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;4.7,-3.19,;6.16,-2.71,;4.22,-4.65,;2.68,-4.65,;2.2,-3.19,;.74,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCN(C[C@@H]2F)C(=O)OC(C)(C)C)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,22.24,(-12.67,2.34,;-11.34,1.57,;-10,2.34,;-8.67,1.57,;-8.67,.03,;-7.34,2.34,;-6,1.57,;-4.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-2,2.34,;-3.33,1.57,;-.67,1.57,;.67,2.34,;2,1.57,;3.33,2.34,;4.67,1.57,;4.67,.03,;6,-.74,;7.34,.03,;7.34,1.57,;6,2.34,;6,3.88,;8.67,-.74,;8.67,-2.28,;10,.03,;11.34,-.74,;12.67,.03,;11.34,-2.28,;12.67,-1.51,;2,.03,;3.33,-.74,;.67,-.74,;-.67,.03,;.67,-2.28,;-.58,-3.19,;-2.04,-2.71,;-.1,-4.65,;1.44,-4.65,;1.91,-3.19,;3.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCN(C[C@@H]2F)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,22.24,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;6.67,3.88,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;.09,-3.19,;-1.38,-2.71,;.56,-4.65,;2.1,-4.65,;2.58,-3.19,;4.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCN(C[C@@H]2F)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,22.24,(-11.44,2.34,;-10.11,1.57,;-8.77,2.34,;-7.44,1.57,;-7.44,.03,;-6.1,2.34,;-4.77,1.57,;-3.44,2.34,;-3.44,3.88,;-2.1,4.65,;-.77,3.88,;-.77,2.34,;-2.1,1.57,;.56,1.57,;1.9,2.34,;3.23,1.57,;4.56,2.34,;5.9,1.57,;5.9,.03,;7.23,-.74,;8.57,.03,;8.57,1.57,;7.23,2.34,;7.23,3.88,;9.9,-.74,;10.67,-2.07,;11.44,-.74,;3.23,.03,;4.56,-.74,;1.9,-.74,;.56,.03,;1.9,-2.28,;3.14,-3.19,;4.61,-2.71,;2.67,-4.65,;1.13,-4.65,;.65,-3.19,;-.81,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCN(C[C@H]2F)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,wD:22.24,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;6.67,3.88,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;.09,-3.19,;-1.38,-2.71,;.56,-4.65,;2.1,-4.65,;2.58,-3.19,;4.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCN(C[C@H]2F)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,wD:22.24,(-11.44,2.34,;-10.11,1.57,;-8.77,2.34,;-7.44,1.57,;-7.44,.03,;-6.1,2.34,;-4.77,1.57,;-3.44,2.34,;-3.44,3.88,;-2.1,4.65,;-.77,3.88,;-.77,2.34,;-2.1,1.57,;.56,1.57,;1.9,2.34,;3.23,1.57,;4.56,2.34,;5.9,1.57,;5.9,.03,;7.23,-.74,;8.57,.03,;8.57,1.57,;7.23,2.34,;7.23,3.88,;9.9,-.74,;10.67,-2.07,;11.44,-.74,;3.23,.03,;4.56,-.74,;1.9,-.74,;.56,.03,;1.9,-2.28,;3.14,-3.19,;4.61,-2.71,;2.67,-4.65,;1.13,-4.65,;.65,-3.19,;-.81,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCNC2)c(C)c(n1)-c1c(C)noc1C |r,wD:17.17,(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;8.86,2.2,;9.89,1.05,;9.12,-.28,;7.61,.04,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;4.7,-3.19,;6.16,-2.71,;4.22,-4.65,;2.68,-4.65,;2.2,-3.19,;.74,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCNC[C@@H]2F)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,22.24,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;8.67,3.88,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;2.09,-3.19,;.62,-2.71,;2.56,-4.65,;4.1,-4.65,;4.58,-3.19,;6.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1c(C)ncnc1C |r,wD:17.17,(-9.85,2.69,;-8.52,1.93,;-7.19,2.69,;-5.85,1.93,;-5.85,.38,;-4.52,2.69,;-3.19,1.93,;-1.85,2.69,;-1.85,4.23,;-.52,5,;.82,4.23,;.82,2.69,;-.52,1.93,;2.15,1.93,;3.48,2.7,;4.82,1.93,;6.15,2.69,;7.48,1.93,;8.95,2.4,;9.85,1.15,;8.95,-.09,;7.48,.38,;4.82,.38,;6.15,-.38,;3.48,-.38,;2.15,.38,;3.48,-1.93,;2.15,-2.69,;.82,-1.93,;2.15,-4.23,;3.48,-5,;4.82,-4.23,;4.82,-2.69,;6.15,-1.93,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1c(C)nn(C)c1C |r,wD:17.17,(-9.89,2.96,;-8.55,2.19,;-7.22,2.96,;-5.89,2.19,;-5.89,.65,;-4.55,2.96,;-3.22,2.19,;-1.89,2.96,;-1.89,4.5,;-.55,5.27,;.78,4.5,;.78,2.96,;-.55,2.19,;2.12,2.19,;3.45,2.96,;4.78,2.19,;6.12,2.96,;7.45,2.19,;8.86,2.82,;9.89,1.67,;9.12,.34,;7.61,.66,;4.78,.65,;6.12,-.12,;3.45,-.12,;2.12,.65,;3.45,-1.66,;4.7,-2.56,;6.16,-2.09,;4.22,-4.03,;2.68,-4.03,;1.77,-5.27,;2.2,-2.56,;.74,-2.09,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1c(C)noc1C |r,wD:17.17,(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;8.86,2.2,;9.89,1.05,;9.12,-.28,;7.61,.04,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;4.7,-3.19,;6.16,-2.71,;4.22,-4.65,;2.68,-4.65,;2.2,-3.19,;.74,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cc[nH]n1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccc(=O)[nH]c1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccc(OC)nc1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccc2nccn2c1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccc[nH]c1=O |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cccnc1F |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cccnc1N |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccnc(NC)c1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccnc(OCCOC)c1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccnc(c1)-n1ccnc1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccnc(c1)N(C)C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccnc(c1)N1CCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccncc1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccnn1C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1ccnnc1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cn[nH]c1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cnc(=O)[nH]c1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cnc(OC)nc1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cnc2[nH]ccc2c1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cncc(c1)C#N |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cncc(c1)C(=O)OC |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cnccn1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cncnc1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cnn(CC(F)(F)F)c1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-n1nc(C)cc1C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)C(=O)N(C)CC1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)C(=O)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)C(=O)NCC1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)C1=CC(C)(C)NC(C)(C)C1 |r,t:29|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N(C)C1CCN(C)CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N(C)Cc1ccccn1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N(CCC#N)C1CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CC2CCC(C1)O2 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CC2CN(CC2C1)S(C)(=O)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC(C)(O)CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC(C1)c1cccnc1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC(C1)n1nc(C)cc1C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC(CC1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC(CC1)OC |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC(CC1)OCCOC |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC(CC1)S(C)(=O)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC(CC1)n1c(C)nnc1C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC(O)CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC2(C1)CCOCC2 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC2(CCNCC2)CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC2(CN(CC(F)F)C2)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC2(CNC(=O)C2)CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCCC1c1nc(C)no1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCCC2(CN(CC(F)F)C2)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC[C@@H](O)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC[C@@H]1C(=O)NC |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC[C@H]1COC |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]12 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(C(C)=O)C(C)(C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(C(C)=O)C2(CC2)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(C)C(=O)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(C)[C@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(C2CC2)[C@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(CC(=O)N(C)C)CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(CC(F)F)CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(CC(F)F)[C@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(CC1)C1CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(CC1)S(C)(=O)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN(CC11CC1)C(C)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCN([C@@H](C)C1)C(C)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCNC(=O)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCNC(C1)C(F)(F)F |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCNCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCS(=O)(=O)CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CC[C@@H](C1)N(C)C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CC[C@@H](C1)N(C)C(C)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CC[C@@H](O)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CC[C@H](C1)N(C)C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CC[C@H](C1)OC |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CC[C@H](C1)c1cccnc1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCn2c(C1)nnc2C(F)(F)F |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCn2ccnc2C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1CCn2cnnc2C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1C[C@@H]2CNC[C@@H]2C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1C[C@H]2C[C@@H]1CN2C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1Cc2cccnc2C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1Cc2ccncc2C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)N1Cc2nc(C)sc2C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C2CC2)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(Cl)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(F)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)cc(n1)-c1c(C)noc1C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)cc(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2=O)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;7.61,.04,;9.12,-.28,;9.89,1.05,;8.86,2.2,;9.18,3.7,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;4.7,-3.19,;6.16,-2.71,;4.22,-4.65,;2.68,-4.65,;2.2,-3.19,;.74,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC[C@@H]2F)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,22.24,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;8.67,3.88,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC[C@@H]2OC)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,22.24,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;8.67,3.88,;10,4.65,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;2.09,-3.19,;.62,-2.71,;2.56,-4.65,;4.1,-4.65,;4.58,-3.19,;6.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CC[C@@H](C2)C(=O)N2CCOCC2)c(C)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CC[C@@H](C2)C(=O)NC)c(C)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CC[C@@H](O)C2)c(C)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CC[C@@H](O)C2)cc(n1)-c1c(C)noc1C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CC[C@@H](O)C2)cc(n1)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CC[C@H](O)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,20.21,(-10.65,2.34,;-9.32,1.57,;-7.99,2.34,;-6.65,1.57,;-6.65,.03,;-5.32,2.34,;-3.98,1.57,;-2.65,2.34,;-2.65,3.88,;-1.32,4.65,;.02,3.88,;.02,2.34,;-1.32,1.57,;1.35,1.57,;2.68,2.34,;4.02,1.57,;5.35,2.34,;6.68,1.57,;6.85,.04,;8.35,-.28,;9.12,1.05,;10.65,1.21,;8.09,2.2,;4.02,.03,;5.35,-.74,;2.68,-.74,;1.35,.03,;2.68,-2.28,;3.93,-3.19,;5.39,-2.71,;3.45,-4.65,;1.91,-4.65,;1.44,-3.19,;-.03,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CC[C@H](O)C2)c(C)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2CC[C@H](O)CC2)cc(n1)-c1c(C)noc1C |r,wD:17.17,20.21,(-9.34,2.57,;-8,1.8,;-6.67,2.57,;-5.33,1.8,;-5.33,.26,;-4,2.57,;-2.67,1.8,;-1.33,2.57,;-1.33,4.11,;,4.88,;1.33,4.11,;1.33,2.57,;,1.8,;2.67,1.8,;2.67,.26,;4,-.51,;4,-2.05,;5.33,-2.82,;6.67,-2.05,;8,-2.82,;8,-4.36,;9.34,-5.13,;6.67,-5.13,;5.33,-4.36,;5.33,.26,;5.33,1.8,;4,2.57,;6.67,2.57,;6.83,4.1,;5.68,5.13,;8.34,4.42,;9.11,3.09,;8.08,1.94,;8.4,.44,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2COC(=O)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,(-10.65,2.34,;-9.32,1.57,;-7.99,2.34,;-6.65,1.57,;-6.65,.03,;-5.32,2.34,;-3.98,1.57,;-2.65,2.34,;-2.65,3.88,;-1.32,4.65,;.02,3.88,;.02,2.34,;-1.32,1.57,;1.35,1.57,;2.68,2.34,;4.02,1.57,;5.35,2.34,;6.68,1.57,;6.85,.04,;8.35,-.28,;9.12,1.05,;10.65,1.21,;8.09,2.2,;4.02,.03,;5.35,-.74,;2.68,-.74,;1.35,.03,;2.68,-2.28,;3.93,-3.19,;5.39,-2.71,;3.45,-4.65,;1.91,-4.65,;1.44,-3.19,;-.03,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,wD:19.26,22.25,THB:25:24:17.18.23:20.21,(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;6,1.57,;6,.03,;7.34,-.74,;6.57,.59,;7.13,1.57,;8.67,1.57,;7.34,2.34,;8.67,.03,;10,-.74,;10,-2.28,;11.34,.03,;11.34,1.57,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;3.25,-3.19,;4.71,-2.71,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.71,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2C[C@H](O)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:17.17,19.20,(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;8.55,1.97,;8.95,.48,;10.28,-.29,;7.46,.08,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;4.3,-3.19,;5.77,-2.71,;3.83,-4.65,;2.29,-4.65,;1.81,-3.19,;.35,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2C[C@H](O)C2)cc(n1)-c1c(C)noc1C |r,wU:17.17,19.20,(-9.22,2.34,;-7.89,1.57,;-6.55,2.34,;-5.22,1.57,;-5.22,.03,;-3.89,2.34,;-2.55,1.57,;-1.22,2.34,;-1.22,3.88,;.11,4.65,;1.45,3.88,;1.45,2.34,;.11,1.57,;2.78,1.57,;2.78,.03,;4.12,-.74,;4.12,-2.28,;5.45,-3.05,;5.85,-4.53,;7.34,-4.14,;8.67,-4.91,;6.94,-2.65,;5.45,.03,;5.45,1.57,;4.12,2.34,;6.78,2.34,;6.94,3.88,;5.8,4.91,;8.45,4.2,;9.22,2.86,;8.19,1.72,;8.51,.21,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2C[C@H](O)C2)cc(n1)N(C)C1CCOCC1 |r,wD:17.17,19.20,(-10,2.47,;-8.67,1.7,;-7.34,2.47,;-6,1.7,;-6,.16,;-4.67,2.47,;-3.33,1.7,;-2,2.47,;-2,4.01,;-.67,4.78,;.67,4.01,;.67,2.47,;-.67,1.7,;2,1.7,;2,.16,;3.33,-.61,;3.33,-2.15,;4.67,-2.92,;6.16,-2.52,;6.55,-4.01,;7.89,-4.78,;5.07,-4.41,;4.67,.16,;4.67,1.7,;3.33,2.47,;6,2.47,;6,4.01,;7.34,1.7,;7.34,.16,;8.67,-.61,;10,.16,;10,1.7,;8.67,2.47,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@@H]2[C@H]3CN(C[C@@H]23)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,wD:18.19,22.22,(-12.27,2.34,;-10.94,1.57,;-9.61,2.34,;-8.27,1.57,;-8.27,.03,;-6.94,2.34,;-5.6,1.57,;-4.27,2.34,;-4.27,3.88,;-2.94,4.65,;-1.6,3.88,;-1.6,2.34,;-2.94,1.57,;-.27,1.57,;1.06,2.34,;2.4,1.57,;3.73,2.34,;5.06,1.57,;5.83,.24,;6.87,-.91,;8.27,-.28,;8.11,1.25,;6.6,1.57,;9.61,-1.05,;9.61,-2.59,;10.94,-.28,;12.27,-1.05,;2.4,.03,;3.73,-.74,;1.06,-.74,;-.27,.03,;1.06,-2.28,;2.31,-3.19,;3.77,-2.71,;1.83,-4.65,;.29,-4.65,;-.18,-3.19,;-1.65,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CC(C2)C(=O)OC)cc(n1)-c1c(C)noc1C |r,wD:17.17,(-10.28,3.11,;-8.95,2.34,;-7.61,3.11,;-6.28,2.34,;-6.28,.8,;-4.94,3.11,;-3.61,2.34,;-2.28,3.11,;-2.28,4.65,;-.94,5.42,;.39,4.65,;.39,3.11,;-.94,2.34,;1.72,2.34,;1.72,.8,;3.06,.03,;3.06,-1.51,;4.39,-2.28,;4.79,-3.76,;6.28,-3.37,;5.88,-1.88,;7.61,-4.14,;7.61,-5.68,;8.95,-3.37,;10.28,-4.14,;4.39,.8,;4.39,2.34,;3.06,3.11,;5.73,3.11,;5.89,4.65,;4.74,5.68,;7.39,4.97,;8.16,3.63,;7.13,2.49,;7.45,.98,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCC[C@@H](O)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:17.17,21.22,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,-.74,;9.34,.03,;9.34,1.57,;10.67,2.34,;8,2.34,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.4,-2.79,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.07,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCC[C@H]2O)c(C)c(n1)-c1c(C)noc1C |r,wD:17.17,21.23,(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;7.61,.04,;9.12,-.28,;9.89,1.05,;8.86,2.2,;9.18,3.7,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;2.2,-3.19,;.74,-2.71,;2.68,-4.65,;4.22,-4.65,;4.7,-3.19,;6.16,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCOC2)c(C)c(n1)-c1ccncc1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCOC2)c(C)c(n1)-n1nc(C)cc1C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCOC2)c(C)c(n1)C(=O)N(C)CC1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCOC2)c(C)c(n1)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCOC2)c(C)c(n1)N1CCC(O)CC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCOC2)c(C)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCOC2)cc(n1)-c1c(C)noc1C |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCOC2=O)c(C)c(n1)-c1c(C)noc1C |r,wD:17.17,(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;7.61,.04,;9.12,-.28,;9.89,1.05,;8.86,2.2,;9.18,3.7,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;4.7,-3.19,;6.16,-2.71,;4.22,-4.65,;2.68,-4.65,;2.2,-3.19,;.74,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CCOC[C@@H]2F)c(C)c(n1)-c1c(C)noc1C |r,wU:22.24,wD:17.17,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;8.67,3.88,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CC[C@@H](C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,wD:20.23,(-10.56,2.34,;-9.23,1.57,;-7.89,2.34,;-6.56,1.57,;-6.56,.03,;-5.22,2.34,;-3.89,1.57,;-2.56,2.34,;-2.56,3.88,;-1.22,4.65,;.11,3.88,;.11,2.34,;-1.22,1.57,;1.44,1.57,;2.78,2.34,;4.11,1.57,;5.44,2.34,;6.78,1.57,;8.19,2.2,;9.22,1.05,;8.45,-.28,;6.94,.04,;9.07,-1.69,;10.56,-2.09,;4.11,.03,;5.44,-.74,;2.78,-.74,;1.44,.03,;2.78,-2.28,;1.53,-3.19,;.07,-2.71,;2.01,-4.65,;3.55,-4.65,;4.02,-3.19,;5.49,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CC[C@H](O)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,wD:20.21,(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;8.86,2.2,;9.89,1.05,;9.12,-.28,;9.74,-1.69,;7.61,.04,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;2.2,-3.19,;.74,-2.71,;2.68,-4.65,;4.22,-4.65,;4.7,-3.19,;6.16,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CC[C@H](O)CC2)cc(n1)-c1c(C)noc1C |r,wU:17.17,wD:20.21,(-9.34,2.57,;-8,1.8,;-6.67,2.57,;-5.33,1.8,;-5.33,.26,;-4,2.57,;-2.67,1.8,;-1.33,2.57,;-1.33,4.11,;,4.88,;1.33,4.11,;1.33,2.57,;,1.8,;2.67,1.8,;2.67,.26,;4,-.51,;4,-2.05,;5.33,-2.82,;6.67,-2.05,;8,-2.82,;8,-4.36,;9.34,-5.13,;6.67,-5.13,;5.33,-4.36,;5.33,.26,;5.33,1.8,;4,2.57,;6.67,2.57,;6.83,4.1,;5.68,5.13,;8.34,4.42,;9.11,3.09,;8.08,1.94,;8.4,.44,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2COC(=O)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:17.17,(-10.65,2.34,;-9.32,1.57,;-7.99,2.34,;-6.65,1.57,;-6.65,.03,;-5.32,2.34,;-3.98,1.57,;-2.65,2.34,;-2.65,3.88,;-1.32,4.65,;.02,3.88,;.02,2.34,;-1.32,1.57,;1.35,1.57,;2.68,2.34,;4.02,1.57,;5.35,2.34,;6.68,1.57,;6.85,.04,;8.35,-.28,;9.12,1.05,;10.65,1.21,;8.09,2.2,;4.02,.03,;5.35,-.74,;2.68,-.74,;1.35,.03,;2.68,-2.28,;3.93,-3.19,;5.39,-2.71,;3.45,-4.65,;1.91,-4.65,;1.44,-3.19,;-.03,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CO[C@H]3OCC[C@@H]23)c(C)c(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2CO[C@H]3OCC[C@@H]23)cc(n1)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@@H](C2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,wD:19.22,(-11.61,2.34,;-10.28,1.57,;-8.95,2.34,;-7.61,1.57,;-7.61,.03,;-6.28,2.34,;-4.94,1.57,;-3.61,2.34,;-3.61,3.88,;-2.28,4.65,;-.94,3.88,;-.94,2.34,;-2.28,1.57,;.39,1.57,;1.72,2.34,;3.06,1.57,;4.39,2.34,;5.73,1.57,;7.21,1.97,;7.61,.48,;6.12,.08,;8.95,-.29,;8.95,-1.83,;10.28,.48,;11.61,-.29,;3.06,.03,;4.39,-.74,;1.72,-.74,;.39,.03,;1.72,-2.28,;.48,-3.19,;-.99,-2.71,;.95,-4.65,;2.49,-4.65,;2.97,-3.19,;4.43,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@@H](C2)C(C)(C)O)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,wD:19.22,(-10.95,2.34,;-9.61,1.57,;-8.28,2.34,;-6.94,1.57,;-6.94,.03,;-5.61,2.34,;-4.28,1.57,;-2.94,2.34,;-2.94,3.88,;-1.61,4.65,;-.28,3.88,;-.28,2.34,;-1.61,1.57,;1.06,1.57,;2.39,2.34,;3.72,1.57,;5.06,2.34,;6.39,1.57,;7.88,1.97,;8.28,.48,;6.79,.08,;9.61,-.29,;10.95,.48,;9.61,-1.83,;10.95,-1.06,;3.72,.03,;5.06,-.74,;2.39,-.74,;1.06,.03,;2.39,-2.28,;1.15,-3.19,;-.32,-2.71,;1.62,-4.65,;3.16,-4.65,;3.64,-3.19,;5.1,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@@H](C2)C(O)=O)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,wD:19.22,(-10.95,2.34,;-9.61,1.57,;-8.28,2.34,;-6.94,1.57,;-6.94,.03,;-5.61,2.34,;-4.28,1.57,;-2.94,2.34,;-2.94,3.88,;-1.61,4.65,;-.28,3.88,;-.28,2.34,;-1.61,1.57,;1.06,1.57,;2.39,2.34,;3.72,1.57,;5.06,2.34,;6.39,1.57,;7.88,1.97,;8.28,.48,;6.79,.08,;9.61,-.29,;10.95,.48,;9.61,-1.83,;3.72,.03,;5.06,-.74,;2.39,-.74,;1.06,.03,;2.39,-2.28,;1.15,-3.19,;-.32,-2.71,;1.62,-4.65,;3.16,-4.65,;3.64,-3.19,;5.1,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@@H]3CC[C@H](C2)N3C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:17.17,19.26,22.25,THB:25:24:17.18.23:20.21,(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;6,1.57,;6,.03,;7.34,-.74,;6.57,.59,;7.13,1.57,;8.67,1.57,;7.34,2.34,;8.67,.03,;10,-.74,;10,-2.28,;11.34,.03,;11.34,1.57,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;3.25,-3.19,;4.71,-2.71,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.71,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@@](C)(O)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,19.21,wD:19.20,(-10.36,2.34,;-9.02,1.57,;-7.69,2.34,;-6.35,1.57,;-6.35,.03,;-5.02,2.34,;-3.69,1.57,;-2.35,2.34,;-2.35,3.88,;-1.02,4.65,;.31,3.88,;.31,2.34,;-1.02,1.57,;1.65,1.57,;2.98,2.34,;4.31,1.57,;5.65,2.34,;6.98,1.57,;8.47,1.97,;8.87,.48,;10.36,.88,;9.27,-1.01,;7.38,.08,;4.31,.03,;5.65,-.74,;2.98,-.74,;1.65,.03,;2.98,-2.28,;4.23,-3.19,;5.69,-2.71,;3.75,-4.65,;2.21,-4.65,;1.74,-3.19,;.27,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@@](C)(O)C2)cc(n1)-c1c(C)noc1C |r,wU:17.17,19.21,wD:19.20,(-10.36,2.34,;-9.02,1.57,;-7.69,2.34,;-6.35,1.57,;-6.35,.03,;-5.02,2.34,;-3.69,1.57,;-2.35,2.34,;-2.35,3.88,;-1.02,4.65,;.31,3.88,;.31,2.34,;-1.02,1.57,;1.65,1.57,;2.98,2.34,;4.31,1.57,;5.65,2.34,;6.98,1.57,;8.47,1.97,;8.87,.48,;10.36,.88,;9.27,-1.01,;7.38,.08,;4.31,.03,;2.98,-.74,;1.65,.03,;2.98,-2.28,;4.23,-3.19,;5.69,-2.71,;3.75,-4.65,;2.21,-4.65,;1.74,-3.19,;.27,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@H](C2)C(C)(C)O)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,19.22,(-10.95,2.34,;-9.61,1.57,;-8.28,2.34,;-6.94,1.57,;-6.94,.03,;-5.61,2.34,;-4.28,1.57,;-2.94,2.34,;-2.94,3.88,;-1.61,4.65,;-.28,3.88,;-.28,2.34,;-1.61,1.57,;1.06,1.57,;2.39,2.34,;3.72,1.57,;5.06,2.34,;6.39,1.57,;7.88,1.97,;8.28,.48,;6.79,.08,;9.61,-.29,;10.95,.48,;9.61,-1.83,;10.95,-1.06,;3.72,.03,;5.06,-.74,;2.39,-.74,;1.06,.03,;2.39,-2.28,;1.15,-3.19,;-.32,-2.71,;1.62,-4.65,;3.16,-4.65,;3.64,-3.19,;5.1,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@H](C2)C(O)=O)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,19.22,(-10.95,2.34,;-9.61,1.57,;-8.28,2.34,;-6.94,1.57,;-6.94,.03,;-5.61,2.34,;-4.28,1.57,;-2.94,2.34,;-2.94,3.88,;-1.61,4.65,;-.28,3.88,;-.28,2.34,;-1.61,1.57,;1.06,1.57,;2.39,2.34,;3.72,1.57,;5.06,2.34,;6.39,1.57,;7.88,1.97,;8.28,.48,;6.79,.08,;9.61,-.29,;10.95,.48,;9.61,-1.83,;3.72,.03,;5.06,-.74,;2.39,-.74,;1.06,.03,;2.39,-2.28,;1.15,-3.19,;-.32,-2.71,;1.62,-4.65,;3.16,-4.65,;3.64,-3.19,;5.1,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@H](O)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,wD:19.20,(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;8.55,1.97,;8.95,.48,;10.28,-.29,;7.46,.08,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;4.3,-3.19,;5.77,-2.71,;3.83,-4.65,;2.29,-4.65,;1.81,-3.19,;.35,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@H](O)C2)cc(n1)-c1c(C)noc1C |r,wU:19.20,wD:17.17,(-9.22,2.34,;-7.89,1.57,;-6.55,2.34,;-5.22,1.57,;-5.22,.03,;-3.89,2.34,;-2.55,1.57,;-1.22,2.34,;-1.22,3.88,;.11,4.65,;1.45,3.88,;1.45,2.34,;.11,1.57,;2.78,1.57,;2.78,.03,;4.12,-.74,;4.12,-2.28,;5.45,-3.05,;5.85,-4.53,;7.34,-4.14,;8.67,-4.91,;6.94,-2.65,;5.45,.03,;5.45,1.57,;4.12,2.34,;6.78,2.34,;6.94,3.88,;5.8,4.91,;8.45,4.2,;9.22,2.86,;8.19,1.72,;8.51,.21,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@H](O)C2)cc(n1)N(C)C1CCOCC1 |r,wU:17.17,wD:19.20,(-10,2.47,;-8.67,1.7,;-7.34,2.47,;-6,1.7,;-6,.16,;-4.67,2.47,;-3.33,1.7,;-2,2.47,;-2,4.01,;-.67,4.78,;.67,4.01,;.67,2.47,;-.67,1.7,;2,1.7,;2,.16,;3.33,-.61,;3.33,-2.15,;4.67,-2.92,;6.16,-2.52,;6.55,-4.01,;7.89,-4.78,;5.07,-4.41,;4.67,.16,;4.67,1.7,;3.33,2.47,;6,2.47,;6,4.01,;7.34,1.7,;7.34,.16,;8.67,-.61,;10,.16,;10,1.7,;8.67,2.47,)|
CNCC(O)COc1cccc(c1)-c1nc(N[C@H]2C[C@](C)(C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:17.17,19.23,wD:19.20,(-10.77,2.34,;-9.43,1.57,;-8.1,2.34,;-6.77,1.57,;-6.77,.03,;-5.43,2.34,;-4.1,1.57,;-2.76,2.34,;-2.76,3.88,;-1.43,4.65,;-.1,3.88,;-.1,2.34,;-1.43,1.57,;1.24,1.57,;2.57,2.34,;3.9,1.57,;5.24,2.34,;6.57,1.57,;8.06,1.97,;8.46,.48,;10,.48,;6.97,.08,;9.23,-.85,;10.77,-.85,;3.9,.03,;5.24,-.74,;2.57,-.74,;1.24,.03,;2.57,-2.28,;1.32,-3.19,;-.16,-2.79,;1.8,-4.65,;3.34,-4.65,;3.82,-3.19,;5.3,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(Nc2c(C)nn(C)c2C)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(Nc2c(C)nn(C)c2C)cc(n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(Nc2c(C)noc2C)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(Nc2c(C)noc2C)cc(n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(Nc2cc(C)on2)c(C)c(n1)-c1c(C)noc1C |(-10.65,2.34,;-9.32,1.57,;-7.99,2.34,;-6.65,1.57,;-6.65,.03,;-5.32,2.34,;-3.98,1.57,;-2.65,2.34,;-2.65,3.88,;-1.32,4.65,;.02,3.88,;.02,2.34,;-1.32,1.57,;1.35,1.57,;2.68,2.34,;4.02,1.57,;5.35,2.34,;6.68,1.57,;8.09,2.2,;9.12,1.05,;10.65,1.21,;8.35,-.28,;6.85,.04,;4.02,.03,;5.35,-.74,;2.68,-.74,;1.35,.03,;2.68,-2.28,;1.44,-3.19,;-.03,-2.71,;1.91,-4.65,;3.45,-4.65,;3.93,-3.19,;5.39,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(Nc2cn(C)cn2)c(C)c(n1)-c1c(C)noc1C |(-10.65,2.34,;-9.32,1.57,;-7.99,2.34,;-6.65,1.57,;-6.65,.03,;-5.32,2.34,;-3.98,1.57,;-2.65,2.34,;-2.65,3.88,;-1.32,4.65,;.02,3.88,;.02,2.34,;-1.32,1.57,;1.35,1.57,;2.68,2.34,;4.02,1.57,;5.35,2.34,;6.68,1.57,;8.09,2.2,;9.12,1.05,;10.65,1.21,;8.35,-.28,;6.85,.04,;4.02,.03,;5.35,-.74,;2.68,-.74,;1.35,.03,;2.68,-2.28,;3.93,-3.19,;5.39,-2.71,;3.45,-4.65,;1.91,-4.65,;1.44,-3.19,;-.03,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(Nc2cnc(C)nc2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(Nc2cnc(OC)nc2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(Nc2cncnc2)cc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(Nc2ncc(C)cn2)cc(n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(Nc2ncc(OC)cn2)cc(n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(Nc2nccn2C)c(C)c(n1)-c1c(C)noc1C |(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;7.61,.04,;9.12,-.28,;9.89,1.05,;8.86,2.2,;9.18,3.7,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;2.2,-3.19,;.72,-2.79,;2.68,-4.65,;4.22,-4.65,;4.7,-3.19,;6.18,-2.79,)|
CNCC(O)COc1cccc(c1)-c1nc(Nc2nnc(s2)C2CC2)c(C)c(n1)-c1c(C)noc1C |(-11.36,2.34,;-10.02,1.57,;-8.69,2.34,;-7.36,1.57,;-7.36,.03,;-6.02,2.34,;-4.69,1.57,;-3.35,2.34,;-3.35,3.88,;-2.02,4.65,;-.69,3.88,;-.69,2.34,;-2.02,1.57,;.65,1.57,;1.98,2.34,;3.31,1.57,;4.65,2.34,;5.98,1.57,;6.14,.04,;7.65,-.28,;8.42,1.05,;7.39,2.2,;9.95,1.21,;11.36,.59,;11.2,2.12,;3.31,.03,;4.65,-.74,;1.98,-.74,;.65,.03,;1.98,-2.28,;.73,-3.19,;-.73,-2.71,;1.21,-4.65,;2.75,-4.65,;3.23,-3.19,;4.69,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(Nc2nncs2)c(C)c(n1)-c1c(C)noc1C |(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;7.61,.04,;9.12,-.28,;9.89,1.05,;8.86,2.2,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;4.7,-3.19,;6.16,-2.71,;4.22,-4.65,;2.68,-4.65,;2.2,-3.19,;.74,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(O)c(C)c(n1)-c1c(C)noc1C |(-8.02,2.34,;-6.69,1.57,;-5.36,2.34,;-4.02,1.57,;-4.02,.03,;-2.69,2.34,;-1.36,1.57,;-.02,2.34,;-.02,3.88,;1.31,4.65,;2.65,3.88,;2.65,2.34,;1.31,1.57,;3.98,1.57,;5.31,2.34,;6.65,1.57,;7.98,2.34,;6.65,.03,;7.98,-.74,;5.31,-.74,;3.98,.03,;5.31,-2.28,;4.07,-3.19,;2.6,-2.71,;4.54,-4.65,;6.08,-4.65,;6.56,-3.19,;8.02,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(OC)c(C)c(n1)-c1c(C)noc1C |(-8.67,2.34,;-7.34,1.57,;-6,2.34,;-4.67,1.57,;-4.67,.03,;-3.33,2.34,;-2,1.57,;-.67,2.34,;-.67,3.88,;.67,4.65,;2,3.88,;2,2.34,;.67,1.57,;3.33,1.57,;4.67,2.34,;6,1.57,;7.34,2.34,;8.67,1.57,;6,.03,;7.34,-.74,;4.67,-.74,;3.33,.03,;4.67,-2.28,;3.42,-3.19,;1.96,-2.71,;3.9,-4.65,;5.44,-4.65,;5.91,-3.19,;7.38,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(OC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;8.67,2.34,;10,1.57,;10,.03,;8.67,-.74,;7.34,.03,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(OCC2CCN(CC(F)F)CC2)c(C)c(n1)-c1c(C)noc1C |(-12.67,2.34,;-11.34,1.57,;-10,2.34,;-8.67,1.57,;-8.67,.03,;-7.34,2.34,;-6,1.57,;-4.67,2.34,;-4.67,3.88,;-3.33,4.65,;-2,3.88,;-2,2.34,;-3.33,1.57,;-.67,1.57,;.67,2.34,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;8.67,2.34,;8.67,3.88,;10,4.65,;11.34,3.88,;12.67,4.65,;11.34,2.34,;7.34,4.65,;6,3.88,;2,.03,;3.33,-.74,;.67,-.74,;-.67,.03,;.67,-2.28,;1.91,-3.19,;3.38,-2.71,;1.44,-4.65,;-.1,-4.65,;-.58,-3.19,;-2.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(OCC2CCN(CC2)C(=O)N(C)C)c(C)c(n1)-c1c(C)noc1C |(-12.67,1.57,;-11.34,.8,;-10,1.57,;-8.67,.8,;-8.67,-.74,;-7.34,1.57,;-6,.8,;-4.67,1.57,;-4.67,3.11,;-3.33,3.88,;-2,3.11,;-2,1.57,;-3.33,.8,;-.67,.8,;.67,1.57,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;7.34,.8,;8.67,1.57,;8.67,3.11,;7.34,3.88,;6,3.11,;10,3.88,;10,5.42,;11.34,3.11,;12.67,3.88,;11.34,1.57,;2,-.74,;3.33,-1.51,;.67,-1.51,;-.67,-.74,;.67,-3.05,;1.91,-3.96,;3.38,-3.48,;1.44,-5.42,;-.1,-5.42,;-.58,-3.96,;-2.04,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(OCC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-12.67,1.57,;-11.34,.8,;-10,1.57,;-8.67,.8,;-8.67,-.74,;-7.34,1.57,;-6,.8,;-4.67,1.57,;-4.67,3.11,;-3.33,3.88,;-2,3.11,;-2,1.57,;-3.33,.8,;-.67,.8,;.67,1.57,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;7.34,.8,;8.67,1.57,;8.67,3.11,;7.34,3.88,;6,3.11,;10,3.88,;10,5.42,;11.34,3.11,;12.67,3.88,;2,-.74,;3.33,-1.51,;.67,-1.51,;-.67,-.74,;.67,-3.05,;1.91,-3.96,;3.38,-3.48,;1.44,-5.42,;-.1,-5.42,;-.58,-3.96,;-2.04,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(OCC2CCN(CC2)C(=O)OCc2ccccc2)c(C)c(n1)-c1c(C)noc1C |(-14.67,1.57,;-13.34,.8,;-12,1.57,;-10.67,.8,;-10.67,-.74,;-9.34,1.57,;-8,.8,;-6.67,1.57,;-6.67,3.11,;-5.33,3.88,;-4,3.11,;-4,1.57,;-5.33,.8,;-2.67,.8,;-1.33,1.57,;,.8,;1.33,1.57,;2.67,.8,;4,1.57,;5.33,.8,;6.67,1.57,;6.67,3.11,;5.33,3.88,;4,3.11,;8,3.88,;8,5.42,;9.34,3.11,;10.67,3.88,;12,3.11,;12,1.57,;13.34,.8,;14.67,1.57,;14.67,3.11,;13.34,3.88,;,-.74,;1.33,-1.51,;-1.33,-1.51,;-2.67,-.74,;-1.33,-3.05,;-.09,-3.96,;1.38,-3.48,;-.56,-5.42,;-2.1,-5.42,;-2.58,-3.96,;-4.04,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(OCC2CCN(CC2)C(C)=O)c(C)c(n1)-c1c(C)noc1C |(-12,1.57,;-10.67,.8,;-9.34,1.57,;-8,.8,;-8,-.74,;-6.67,1.57,;-5.33,.8,;-4,1.57,;-4,3.11,;-2.67,3.88,;-1.33,3.11,;-1.33,1.57,;-2.67,.8,;,.8,;1.33,1.57,;2.67,.8,;4,1.57,;5.33,.8,;6.67,1.57,;8,.8,;9.34,1.57,;9.34,3.11,;8,3.88,;6.67,3.11,;10.67,3.88,;12,3.11,;10.67,5.42,;2.67,-.74,;4,-1.51,;1.33,-1.51,;,-.74,;1.33,-3.05,;2.58,-3.96,;4.04,-3.48,;2.1,-5.42,;.56,-5.42,;.09,-3.96,;-1.38,-3.48,)|
CNCC(O)COc1cccc(c1)-c1nc(OCC2CCN(CC2)C2CC2)c(C)c(n1)-c1c(C)noc1C |(-12.11,1.67,;-10.77,.9,;-9.44,1.67,;-8.11,.9,;-8.11,-.64,;-6.77,1.67,;-5.44,.9,;-4.1,1.67,;-4.1,3.21,;-2.77,3.98,;-1.44,3.21,;-1.44,1.67,;-2.77,.9,;-.1,.9,;1.23,1.67,;2.56,.9,;3.9,1.67,;5.23,.9,;6.57,1.67,;7.9,.9,;9.23,1.67,;9.23,3.21,;7.9,3.98,;6.57,3.21,;10.57,3.98,;12.11,3.98,;11.34,5.32,;2.56,-.64,;3.9,-1.41,;1.23,-1.41,;-.1,-.64,;1.23,-2.95,;2.48,-3.85,;3.94,-3.38,;2,-5.32,;.46,-5.32,;-.02,-3.85,;-1.48,-3.38,)|
CNCC(O)COc1cccc(c1)-c1nc(OCC2CCN(CC2)S(C)(=O)=O)c(C)c(n1)-c1c(C)noc1C |(-12,1.67,;-10.67,.9,;-9.34,1.67,;-8,.9,;-8,-.64,;-6.67,1.67,;-5.33,.9,;-4,1.67,;-4,3.21,;-2.67,3.98,;-1.33,3.21,;-1.33,1.67,;-2.67,.9,;,.9,;1.33,1.67,;2.67,.9,;4,1.67,;5.33,.9,;6.67,1.67,;8,.9,;9.34,1.67,;9.34,3.21,;8,3.98,;6.67,3.21,;10.67,3.98,;12,4.75,;9.9,5.32,;11.44,2.65,;2.67,-.64,;4,-1.41,;1.33,-1.41,;,-.64,;1.33,-2.95,;2.58,-3.85,;4.04,-3.38,;2.1,-5.32,;.56,-5.32,;.09,-3.85,;-1.38,-3.38,)|
CNCC(O)COc1cccc(c1)-c1nc(OCC2CCNCC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(OCC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNCC(O)COc1cccc(c1)-c1nc(SC)c(C)c(n1)-c1c(C)noc1C |(-9.22,1.41,;-7.89,.64,;-6.55,1.41,;-5.22,.64,;-5.22,-.9,;-3.89,1.41,;-2.55,.64,;-1.22,1.41,;-1.22,2.95,;.11,3.72,;1.45,2.95,;1.45,1.41,;.11,.64,;2.78,.64,;2.78,-.9,;4.12,-1.67,;4.12,-3.21,;5.45,-3.98,;5.45,-.9,;6.78,-1.67,;5.45,.64,;4.12,1.41,;6.78,1.41,;6.94,2.95,;5.8,3.98,;8.45,3.27,;9.22,1.93,;8.19,.79,;8.51,-.72,)|
CNCC(O)COc1cccc(c1)-c1nc(SC)cc(n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)n[nH]c1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)ncnc1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)nn(C(C)C)c1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)nn(C)c1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)-c1cnc2cnccn12
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)C(=O)N(C)C
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)C(=O)N(C)CC1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)C(=O)NC1CCN(C)CC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)C(=O)NC1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)C(=O)NCC1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N(C)C(C)=O
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N(C)C1CCN(CC1)C(=O)OC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N(C)CC1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N(C)c1cnc(C)nc1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N(C)c1cnc(OC)nc1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N(C)c1cncnc1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N(CCOC)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCC2(CC1)NC(=O)NC2=O
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(C(C)=O)C2(CC2)C1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(C)CC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(C)[C@@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(C)[C@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC(F)(F)F)CC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC(F)(F)F)[C@@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC(F)(F)F)[C@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC(F)F)CC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC(F)F)[C@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC1)C(=O)C1CC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC1)C(=O)N(C)C
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC1)C(=O)OC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC1)C1CC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC1)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC1)n1c(C)nnc1C
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CC11CC1)C(=O)OC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CCF)CC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CCF)[C@@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CCF)[C@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(CCOC)CC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN(C[C@H]1C)C(C)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN([C@@H](C)C1)C(=O)N(C)C |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN([C@@H](C)C1)C(C)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN([C@@H](C)C1)S(C)(=O)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN([C@H](C)C1)C(=O)N(C)C |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN([C@H](C)C1)S(C)(=O)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCNC(C)(C)C1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCNC(C)C1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCNC(C1)C(F)(F)F
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCNC(C1)C(O)=O
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CCN[C@@H](C)C1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CC[C@@H](C1)S(C)(=O)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1C[C@@H]2C[C@H]1CN2C(=O)OC |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1C[C@@H]2C[C@H]1CN2C(C)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1C[C@@H]2C[C@H]1CN2S(C)(=O)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1C[C@H]2C[C@@H]1CN2 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1C[C@H]2C[C@@H]1CN2S(C)(=O)=O |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c[nH]c2ncncc12)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1c[nH]cn1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cc2ccccc2o1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cc2ccccc2o1)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cc2ccccc2o1)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc(OC)c(OC)c1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc(OC)c(OC)c1)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc(OC)c(OC)c1)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc(cc1)S(C)(=O)=O)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc(cc1)S(C)(=O)=O)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc(cc1)S(C)(=O)=O)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc(nc1)C(F)(F)F)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc(nc1)C(F)(F)F)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc(nc1)C(F)(F)F)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc(nn1)N1CCOCC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc2OCCOc2c1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc2OCCOc2c1)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccc2OCCOc2c1)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cccc(c1)C#N)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cccc(c1)C#N)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cccc(c1)C#N)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cccc2ncccc12)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cccc2ncccc12)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cccc2ncccc12)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cccnc1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccnc(C)c1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccnc(OC)c1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccnc(OC)c1)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccnc(OC)c1)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccnc(c1)C#N)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccnc(c1)C(=O)N(C)C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccnc(c1)C(=O)NC)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccnc(c1)C(C)(C)O)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccncc1)N(C)C1CCN(C)CC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccncc1)N(C)C1CCN(CC1)C(C)=O
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccncc1)N(C)C1CCNCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ccncc1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cn(C)c(C)n1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cn(C)c2ncncc12)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cn(C)cn1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cn(c2ncncc12)S(C)(=O)=O)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc(C)n1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc(CO)n1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2CNCCn12)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2[nH]ccc2c1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2c(cnn2c1)C(=O)N(C)C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2c(cnn2c1)C(=O)OC)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2ccnn2c1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2cnccn12)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2ncccn12)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2nccn2c1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2ncnn2c1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cncn1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cncnc1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cncnc1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cncnc1)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cncnc1)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnn(CC(C)C)c1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnn(CC(C)C)c1)N(C)CCC#N
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1cnn(CC(C)C)c1)N(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1csnc1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1nc(C)c[nH]1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1nc(C)cn1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1nc(C)cs1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1nc[nH]c1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ncc(C)n1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1ncc[nH]1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1nccn1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1sc(C)nc1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-c1scnc1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-n1cccn1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)-n1nc(C)cc1C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C(=O)N(C)C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C(=O)N(C)C1CCOCC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C(=O)N(C)CC1CCOCC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C(=O)N1CCOCC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C(=O)NC)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C(=O)NC1CCOCC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C(=O)NCC1CCOCC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C(C)=C)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C1(C)CC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C1=CCCC1)C(CCOC)CCOC |t:21|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C1=CCCC1)N(C)C1CCOCC1 |t:21|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C1=CCCC1)N(C)CCC#N |t:21|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)C1CCCC1)C(CCOC)CCOC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C#C
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C(C)C
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C1CC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C1CCN(CC1)C(=O)N(C)C
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C1CCN(CC1)C(=O)OC
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C1CCN(CC1)C(C)=O
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C1CCN(CC1)S(C)(=O)=O
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C1CCN([C@@H](C)C1)C(=O)N(C)C |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)C1CCNCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)C1CCOCC1)N(C)C
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)c1cnc(C)nc1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)c1cnc(OC)nc1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)c1cnc(nc1)C(F)(F)F)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N(C)c1cncnc1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CC2(C1)CCOCC2)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CC2(CCNCC2)c2ccccc12)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CC2CCC(C1)O2)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCC(O)(CCO)CC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCC2(CCO2)CC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCC2(CCOC2)CC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCCC2(CCOCC2)C1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCC[C@H](O)C1)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(C(C)=O)C2(CC2)C1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(C)C(=O)C1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(C)CC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(C)[C@@H](C)C1)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(CC(F)(F)F)CC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(CC(F)(F)F)[C@@H](C)C1)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(CC(F)F)CC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(CC(F)F)[C@@H](C)C1)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(CC1)C(=O)OC)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(CC11CC1)C(C)=O)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(CCF)CC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN(CCF)[C@@H](C)C1)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN([C@@H](C)C1)C(=O)OC)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN([C@@H](C)C1)S(C)(=O)=O)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCN2[C@H](COC2=O)C1)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCNC(=O)C1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCOCC1)N(C)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCOCC1)N(C1CC1)C1CCOCC1
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCOCC1)N(C1CC1)[C@@H]1CCOC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCO[C@H](CN)C1)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CC[C@@H](C1)N(C)C(C)=O)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1C[C@@H]2CCCN([C@@H]2C1)C(C)=O)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1C[C@@H]2C[C@H]1CN2C)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(cc(n1)N1C[C@H]2C[C@@H]1CN2)N(C)C1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nc(nc(N[C@H]2CCOC2)c1C)N1CCOCC1 |r|
CNCC(O)COc1cccc(c1)-c1nccc(NC2CCOCC2)n1
CNCC(O)COc1cccc(c1)-c1nccc(n1)-c1c(C)noc1C
CNCC(O)COc1cccc(c1Cl)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;-2.67,.03,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNCC(O)COc1cccc(c1Cl)-c1nc(NC2CCOC(C)C2)c(C)c(n1)-c1c(C)noc1C |(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;-1.33,.03,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,-.74,;9.34,.03,;9.34,1.57,;10.67,2.34,;8,2.34,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.4,-2.79,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.07,-2.79,)|
CNCC(O)COc1cccc(c1Cl)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;-.67,.03,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.07,-2.79,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.6,-2.79,)|
CNCCCN1CCC(Cc2ccccc2)CC1
CNCCN(C)C
CNCCN(C)Cc1nn2CCCCc2c1C1CCCCC1
CNCCN(C)Cc1nn2CCCc2c1C1CCC(C)(C)CC1
CNCCN(C)Cc1nn2CCCc2c1C1CCC2(CCCC2)CC1
CNCCN(C)Cc1nn2CCCc2c1C1CCCCC1
CNCCN1CCC(C)CC1
CNCCN1CCC(CC1)C(=O)Nc1ccccc1
CNCCN1CCC(CC1)C(O)c1ccccc1
CNCCN1CCC(CC1)NC(=O)c1ccccc1
CNCCN1CCC(CC1)Nc1ccccc1
CNCCN1CCC(CC1)OC(=O)c1ccccc1
CNCCN1CCC(CC1)OCc1ccc(Br)cc1
CNCCN1CCC(CC1)OCc1ccc(CC(C)C)cc1
CNCCN1CCC(CC1)OCc1ccc(Cl)cc1
CNCCN1CCC(CC1)OCc1ccc(F)cc1
CNCCN1CCC(CC1)OCc1ccc(OC(F)(F)F)cc1
CNCCN1CCC(CC1)OCc1ccc(OCC(F)(F)F)cc1
CNCCN1CCC(CC1)OCc1ccc(Oc2cccc(Cl)c2Cl)cc1
CNCCN1CCC(CC1)OCc1ccc(cc1)-c1ccccc1
CNCCN1CCC(CC1)OCc1ccc(cc1)-n1nc(C)cc1C
CNCCN1CCC(CC1)OCc1ccc(cc1)C(F)(F)F
CNCCN1CCC(CC1)OCc1ccc(cc1)C1CCCCC1
CNCCN1CCC(CC1)OCc1cccc(Br)c1
CNCCN1CCC(CC1)OCc1cccc(Cl)c1
CNCCN1CCC(CC1)OCc1cccc(F)c1
CNCCN1CCC(CC1)OCc1cccc(c1)-c1ccccc1
CNCCN1CCC(CC1)OCc1cccc(c1)C(F)(F)F
CNCCN1CCC(CC1)OCc1ccccc1
CNCCN1CCC(CC1)OCc1ccccc1-c1ccccc1
CNCCN1CCC(CC1)OCc1ccccc1Br
CNCCN1CCC(CC1)OCc1ccccc1C(F)(F)F
CNCCN1CCC(CC1)OCc1ccccc1Cl
CNCCN1CCC(CC1)OCc1ccccc1F
CNCCN1CCC(CC1)Oc1ccccc1
CNCCN1CCC(CC1)Sc1ccccc1
CNCCN1CCC(CC1)c1cc(C)c2nc([nH]c2c1)-c1c(F)cccc1OC
CNCCN1CCC(CC1)c1cc(C)c2nc([nH]c2c1)-c1c(OC)cccc1OC
CNCCN1CCC(CC1)c1cc(C)c2nc([nH]c2c1)-c1ccc(F)cc1OC
CNCCN1CCC(CC1)c1cc(C)c2nc([nH]c2c1)-c1ccccc1
CNCCN1CCC(CC1)c1cc(C)c2nc([nH]c2c1)-c1ccccc1OC
CNCCN1CCC(CC1)c1cc(C)c2nc([nH]c2c1)-c1cccnc1OC
CNCCN1CCC(CC1)c1ccc2[nH]c(c(F)c2c1)-c1ccccc1OC
CNCCN1CCC(CC1)c1ccc2n(C)c(nc2c1)-c1cccnc1OC
CNCCN1CCC(CC1)c1ccc2nc([nH]c2c1)-c1cccnc1OC
CNCCN1CCC(CC1)c1ccccc1
CNCCN1CCC(CC1)c1cnc2nc([nH]c2c1)-c1cccnc1OC
CNCCN1CCC(CCc2ccccc2)CC1
CNCCN1CCC(CNc2ccccc2)CC1
CNCCN1CCC(COC(=O)c2ccccc2)CC1
CNCCN1CCC(COc2ccccc2)CC1
CNCCN1CCC(Cc2ccccc2)C1
CNCCN1CCC(Cc2ccccc2)CC1
CNCCN1CCCC(Cc2ccccc2)C1
CNCCN1CCCC1
CNCCNC(=O)c1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1OC)C(F)(F)F
CNCCNC(C)c1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1OC)C(F)(F)F
CNCCNC1CCN(CC1)c1cccc(c1)-c1ccnc(C)n1
CNCCNCc1cc(cc(c1)C(F)(F)F)-n1nc(cc1C(=O)NCc1ccccc1OC)C(F)(F)F
CNCCNCc1cc(ccc1C)-n1nc(cc1C(=O)NCc1ccccc1OC)C(F)(F)F
CNCCNCc1cc(ccc1F)-n1nc(cc1C(=O)NCc1ccccc1OC)C(F)(F)F
CNCCNCc1ccc2n(Cc3ccccc3OC)c(=O)c3cc(nn3c2c1)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCC1CCCCC1)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCCc1c[nH]c2ccccc12)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1c(OC)ccc2ccccc12)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1cc(F)ccc1OC)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1cccc2OCCOc12)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1cccc2ccccc12)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1C)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1N)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1OC(F)(F)F)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1OC)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1nc2ccccc2[nH]1)C(F)(F)F
CNCCNCc1cccc(c1)-n1nc(cc1C(=O)NCc1nc2ccccc2n1C)C(F)(F)F
CNC[C@@H](O)CN1CCc2c(C1)cccc2OCc1ccc(cc1)-c1nccs1 |r|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(-c2c(C)noc2C)c(C)c(n1)C1(C)CC1 |r,wD:3.3,(-8.67,2.34,;-7.34,1.57,;-6,2.34,;-4.67,1.57,;-4.67,.03,;-3.33,2.34,;-2,1.57,;-.67,2.34,;-.67,3.88,;.67,4.65,;2,3.88,;3.33,4.65,;2,2.34,;.67,1.57,;3.33,1.57,;3.33,.03,;4.67,-.74,;4.67,-2.28,;3.42,-3.19,;1.96,-2.71,;3.9,-4.65,;5.44,-4.65,;5.91,-3.19,;7.38,-2.71,;6,.03,;7.34,-.74,;6,1.57,;4.67,2.34,;7.34,2.34,;7.34,.8,;8.67,3.11,;7.34,3.88,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(-c2cnn(C)c2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-9.22,1.87,;-7.89,1.1,;-6.55,1.87,;-5.22,1.1,;-5.22,-.44,;-3.89,1.87,;-2.55,1.1,;-1.22,1.87,;-1.22,3.41,;.11,4.18,;1.45,3.41,;2.78,4.18,;1.45,1.87,;.11,1.1,;2.78,1.1,;4.12,1.87,;5.45,1.1,;6.78,1.87,;8.19,1.24,;9.22,2.38,;8.45,3.72,;9.08,5.12,;6.94,3.4,;5.45,-.44,;6.78,-1.21,;4.12,-1.21,;2.78,-.44,;4.12,-2.75,;2.87,-3.66,;1.41,-3.18,;3.35,-5.12,;4.89,-5.12,;5.36,-3.66,;6.83,-3.18,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-8.77,2.34,;-7.44,1.57,;-6.1,2.34,;-4.77,1.57,;-4.77,.03,;-3.44,2.34,;-2.1,1.57,;-.77,2.34,;-.77,3.88,;.56,4.65,;1.9,3.88,;3.23,4.65,;1.9,2.34,;.56,1.57,;3.23,1.57,;4.56,2.34,;5.9,1.57,;7.23,2.34,;8.77,2.34,;8,3.67,;5.9,.03,;7.23,-.74,;4.56,-.74,;3.23,.03,;4.56,-2.28,;3.32,-3.19,;1.83,-2.79,;3.79,-4.65,;5.33,-4.65,;5.81,-3.19,;7.3,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(C2CCOCC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-9.34,2.34,;-8,1.57,;-6.67,2.34,;-5.33,1.57,;-5.33,.03,;-4,2.34,;-2.67,1.57,;-1.33,2.34,;-1.33,3.88,;,4.65,;1.33,3.88,;2.67,4.65,;1.33,2.34,;,1.57,;2.67,1.57,;4,2.34,;5.33,1.57,;6.67,2.34,;8,1.57,;9.34,2.34,;9.34,3.88,;8,4.65,;6.67,3.88,;5.33,.03,;6.67,-.74,;4,-.74,;2.67,.03,;4,-2.28,;5.25,-3.19,;6.71,-2.71,;4.77,-4.65,;3.23,-4.65,;2.76,-3.19,;1.29,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(C2Cc3cnn(C)c3C2)c(F)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.55,2,;-9.21,1.23,;-7.88,2,;-6.55,1.23,;-6.55,-.31,;-5.21,2,;-3.88,1.23,;-2.54,2,;-2.54,3.54,;-1.21,4.31,;.12,3.54,;1.46,4.31,;.12,2,;-1.21,1.23,;1.46,1.23,;2.79,2,;4.12,1.23,;5.46,2,;5.62,3.53,;7.13,3.85,;8.16,4.99,;9.56,4.37,;9.4,2.84,;10.55,1.8,;7.9,2.51,;6.86,1.37,;4.12,-.31,;5.46,-1.08,;2.79,-1.08,;1.46,-.31,;2.79,-2.62,;4.04,-3.53,;5.5,-3.05,;3.56,-4.99,;2.02,-4.99,;1.54,-3.53,;.08,-3.05,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N(C)C2CC(COC)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.95,2.34,;-9.61,1.57,;-8.28,2.34,;-6.94,1.57,;-6.94,.03,;-5.61,2.34,;-4.28,1.57,;-2.94,2.34,;-2.94,3.88,;-1.61,4.65,;-.28,3.88,;1.06,4.65,;-.28,2.34,;-1.61,1.57,;1.06,1.57,;2.39,2.34,;3.72,1.57,;5.06,2.34,;5.06,3.88,;6.39,1.57,;6.79,.08,;8.28,.48,;9.61,-.29,;9.61,-1.83,;10.95,-2.6,;7.88,1.97,;3.72,.03,;5.06,-.74,;2.39,-.74,;1.06,.03,;2.39,-2.28,;1.15,-3.19,;-.32,-2.71,;1.62,-4.65,;3.16,-4.65,;3.64,-3.19,;5.1,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N(C)[C@H]2CC[C@H](C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:19.19,22.25,wD:3.3,(-10.45,2.34,;-9.11,1.57,;-7.78,2.34,;-6.44,1.57,;-6.44,.03,;-5.11,2.34,;-3.78,1.57,;-2.44,2.34,;-2.44,3.88,;-1.11,4.65,;.22,3.88,;1.56,4.65,;.22,2.34,;-1.11,1.57,;1.56,1.57,;2.89,2.34,;4.22,1.57,;5.56,2.34,;5.56,3.88,;6.89,1.57,;8.3,2.2,;9.33,1.05,;8.56,-.28,;7.05,.04,;8.96,-1.77,;10.45,-2.17,;4.22,.03,;5.56,-.74,;2.89,-.74,;1.56,.03,;2.89,-2.28,;1.65,-3.19,;.16,-2.79,;2.12,-4.65,;3.66,-4.65,;4.14,-3.19,;5.62,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC(CO)(CO)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.1,1.62,;-8.77,.85,;-7.43,1.62,;-6.1,.85,;-6.1,-.69,;-4.77,1.62,;-3.43,.85,;-2.1,1.62,;-2.1,3.16,;-.76,3.93,;.57,3.16,;1.9,3.93,;.57,1.62,;-.76,.85,;1.9,.85,;3.24,1.62,;4.57,.85,;5.9,1.62,;7.39,1.22,;7.79,2.71,;9.33,2.71,;10.1,1.37,;8.56,4.04,;7.79,5.37,;6.3,3.1,;4.57,-.69,;5.9,-1.46,;3.24,-1.46,;1.9,-.69,;3.24,-3,;1.99,-3.91,;.5,-3.51,;2.47,-5.37,;4.01,-5.37,;4.48,-3.91,;5.97,-3.51,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC(F)(F)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-9.72,2.28,;-8.38,1.51,;-7.05,2.28,;-5.71,1.51,;-5.71,-.03,;-4.38,2.28,;-3.05,1.51,;-1.71,2.28,;-1.71,3.82,;-.38,4.59,;.95,3.82,;2.29,4.59,;.95,2.28,;-.38,1.51,;2.29,1.51,;3.62,2.28,;4.96,1.51,;6.29,2.28,;7.78,1.88,;8.18,3.37,;9.72,3.37,;8.95,4.71,;6.69,3.77,;4.96,-.03,;6.29,-.8,;3.62,-.8,;2.29,-.03,;3.62,-2.34,;2.38,-3.24,;.89,-2.84,;2.85,-4.71,;4.39,-4.71,;4.87,-3.24,;6.36,-2.84,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC(F)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-9.61,2.34,;-8.28,1.57,;-6.94,2.34,;-5.61,1.57,;-5.61,.03,;-4.28,2.34,;-2.94,1.57,;-1.61,2.34,;-1.61,3.88,;-.28,4.65,;1.06,3.88,;2.39,4.65,;1.06,2.34,;-.28,1.57,;2.39,1.57,;3.72,2.34,;5.06,1.57,;6.39,2.34,;7.88,1.94,;8.28,3.43,;9.61,4.2,;6.79,3.83,;5.06,.03,;6.39,-.74,;3.72,-.74,;2.39,.03,;3.72,-2.28,;2.48,-3.19,;.99,-2.79,;2.95,-4.65,;4.49,-4.65,;4.97,-3.19,;6.46,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCCCO3)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.28,1.8,;-8.95,1.03,;-7.61,1.8,;-6.28,1.03,;-6.28,-.51,;-4.94,1.8,;-3.61,1.03,;-2.28,1.8,;-2.28,3.34,;-.94,4.11,;.39,3.34,;1.72,4.11,;.39,1.8,;-.94,1.03,;1.72,1.03,;3.06,1.8,;4.39,1.03,;5.73,1.8,;7.21,1.4,;7.61,2.88,;6.12,3.28,;7.61,4.42,;8.95,5.19,;10.28,4.42,;10.28,2.88,;8.95,2.11,;4.39,-.51,;5.73,-1.28,;3.06,-1.28,;1.72,-.51,;3.06,-2.82,;1.81,-3.73,;.35,-3.25,;2.29,-5.19,;3.83,-5.19,;4.3,-3.73,;5.77,-3.25,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCCO3)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.13,1.94,;-8.8,1.17,;-7.46,1.94,;-6.13,1.17,;-6.13,-.37,;-4.8,1.94,;-3.46,1.17,;-2.13,1.94,;-2.13,3.48,;-.79,4.25,;.54,3.48,;1.87,4.25,;.54,1.94,;-.79,1.17,;1.87,1.17,;3.21,1.94,;4.54,1.17,;5.87,1.94,;7.36,1.54,;7.76,3.03,;6.27,3.43,;7.76,4.57,;9.22,5.05,;10.13,3.8,;9.22,2.56,;4.54,-.37,;5.87,-1.14,;3.21,-1.14,;1.87,-.37,;3.21,-2.68,;1.96,-3.58,;.63,-2.81,;2.44,-5.05,;3.98,-5.05,;4.45,-3.58,;5.79,-2.81,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCCOC3)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.28,1.8,;-8.95,1.03,;-7.61,1.8,;-6.28,1.03,;-6.28,-.51,;-4.94,1.8,;-3.61,1.03,;-2.28,1.8,;-2.28,3.34,;-.94,4.11,;.39,3.34,;1.72,4.11,;.39,1.8,;-.94,1.03,;1.72,1.03,;3.06,1.8,;4.39,1.03,;5.73,1.8,;7.21,1.4,;7.61,2.88,;6.12,3.28,;7.61,4.42,;8.95,5.19,;10.28,4.42,;10.28,2.88,;8.95,2.11,;4.39,-.51,;5.73,-1.28,;3.06,-1.28,;1.72,-.51,;3.06,-2.82,;1.81,-3.73,;.48,-2.96,;2.29,-5.19,;3.83,-5.19,;4.3,-3.73,;5.64,-2.96,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCN(C3)C(=O)OC(C)C)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12.46,2.02,;-11.13,1.25,;-9.79,2.02,;-8.46,1.25,;-8.46,-.29,;-7.13,2.02,;-5.79,1.25,;-4.46,2.02,;-4.46,3.56,;-3.13,4.33,;-1.79,3.56,;-.46,4.33,;-1.79,2.02,;-3.13,1.25,;-.46,1.25,;.88,2.02,;2.21,1.25,;3.54,2.02,;5.03,1.63,;5.43,3.11,;3.94,3.51,;5.59,4.65,;7.1,4.97,;7.87,3.63,;6.84,2.49,;9.4,3.47,;10.3,4.72,;10.02,2.06,;11.56,1.9,;12.46,3.15,;12.18,.5,;2.21,-.29,;3.54,-1.06,;.88,-1.06,;-.46,-.29,;.88,-2.6,;-.37,-3.5,;-1.83,-3.02,;.11,-4.97,;1.65,-4.97,;2.12,-3.5,;3.59,-3.02,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCN(C3)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.85,2.02,;-10.52,1.25,;-9.18,2.02,;-7.85,1.25,;-7.85,-.29,;-6.52,2.02,;-5.18,1.25,;-3.85,2.02,;-3.85,3.56,;-2.51,4.33,;-1.18,3.56,;.15,4.33,;-1.18,2.02,;-2.51,1.25,;.15,1.25,;1.49,2.02,;2.82,1.25,;4.15,2.02,;5.64,1.63,;6.04,3.11,;4.55,3.51,;6.2,4.65,;7.71,4.97,;8.48,3.63,;7.45,2.49,;9.96,3.23,;11.05,4.32,;10.36,1.75,;11.85,1.35,;2.82,-.29,;4.15,-1.06,;1.49,-1.06,;.15,-.29,;1.49,-2.6,;.24,-3.5,;-1.25,-3.1,;.72,-4.97,;2.26,-4.97,;2.73,-3.5,;4.22,-3.1,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCN(C3)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.63,2.02,;-10.3,1.25,;-8.97,2.02,;-7.63,1.25,;-7.63,-.29,;-6.3,2.02,;-4.96,1.25,;-3.63,2.02,;-3.63,3.56,;-2.3,4.33,;-.96,3.56,;.37,4.33,;-.96,2.02,;-2.3,1.25,;.37,1.25,;1.7,2.02,;3.04,1.25,;4.37,2.02,;5.86,1.63,;6.26,3.11,;4.77,3.51,;6.42,4.65,;7.92,4.97,;8.69,3.63,;7.66,2.49,;10.23,3.47,;11.47,2.57,;11.63,4.1,;3.04,-.29,;4.37,-1.06,;1.7,-1.06,;.37,-.29,;1.7,-2.6,;.46,-3.5,;-1.03,-3.1,;.93,-4.97,;2.47,-4.97,;2.95,-3.5,;4.44,-3.1,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCN(CC(F)F)CC3)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12.28,1.8,;-10.95,1.03,;-9.61,1.8,;-8.28,1.03,;-8.28,-.51,;-6.94,1.8,;-5.61,1.03,;-4.28,1.8,;-4.28,3.34,;-2.94,4.11,;-1.61,3.34,;-.28,4.11,;-1.61,1.8,;-2.94,1.03,;-.28,1.03,;1.06,1.8,;2.39,1.03,;3.72,1.8,;5.21,1.4,;5.61,2.88,;4.12,3.28,;6.94,2.11,;8.28,2.88,;8.28,4.42,;9.61,5.19,;10.95,4.42,;12.28,5.19,;10.95,2.88,;6.94,5.19,;5.61,4.42,;2.39,-.51,;3.72,-1.28,;1.06,-1.28,;-.28,-.51,;1.06,-2.82,;-.19,-3.73,;-1.65,-3.25,;.29,-5.19,;1.83,-5.19,;2.3,-3.73,;3.77,-3.25,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCN(CC3)C(=O)OC(C)C)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12.95,1.03,;-11.61,.26,;-10.28,1.03,;-8.95,.26,;-8.95,-1.28,;-7.61,1.03,;-6.28,.26,;-4.94,1.03,;-4.94,2.57,;-3.61,3.34,;-2.28,2.57,;-.94,3.34,;-2.28,1.03,;-3.61,.26,;-.94,.26,;.39,1.03,;1.72,.26,;3.06,1.03,;4.55,.63,;4.94,2.11,;3.46,2.51,;6.28,1.34,;7.61,2.11,;7.61,3.65,;6.28,4.42,;4.94,3.65,;8.95,4.42,;8.95,5.96,;10.28,3.65,;11.61,4.42,;12.95,3.65,;11.61,5.96,;1.72,-1.28,;3.06,-2.05,;.39,-2.05,;-.94,-1.28,;.39,-3.59,;-.86,-4.5,;-2.32,-4.02,;-.38,-5.96,;1.16,-5.96,;1.64,-4.5,;3.1,-4.02,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCN(CC3)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12.28,1.03,;-10.95,.26,;-9.61,1.03,;-8.28,.26,;-8.28,-1.28,;-6.94,1.03,;-5.61,.26,;-4.28,1.03,;-4.28,2.57,;-2.94,3.34,;-1.61,2.57,;-.28,3.34,;-1.61,1.03,;-2.94,.26,;-.28,.26,;1.06,1.03,;2.39,.26,;3.72,1.03,;5.21,.63,;5.61,2.11,;4.12,2.51,;6.94,1.34,;8.28,2.11,;8.28,3.65,;6.94,4.42,;5.61,3.65,;9.61,4.42,;9.61,5.96,;10.95,3.65,;12.28,4.42,;2.39,-1.28,;3.72,-2.05,;1.06,-2.05,;-.28,-1.28,;1.06,-3.59,;-.19,-4.5,;-1.65,-4.02,;.29,-5.96,;1.83,-5.96,;2.3,-4.5,;3.77,-4.02,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCN(CC3)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.72,1.13,;-10.38,.36,;-9.05,1.13,;-7.71,.36,;-7.71,-1.18,;-6.38,1.13,;-5.05,.36,;-3.71,1.13,;-3.71,2.67,;-2.38,3.44,;-1.05,2.67,;.29,3.44,;-1.05,1.13,;-2.38,.36,;.29,.36,;1.62,1.13,;2.95,.36,;4.29,1.13,;5.78,.73,;6.17,2.22,;4.69,2.62,;7.51,1.45,;8.84,2.22,;8.84,3.76,;7.51,4.53,;6.17,3.76,;10.18,4.53,;11.72,4.53,;10.95,5.86,;2.95,-1.18,;4.29,-1.95,;1.62,-1.95,;.29,-1.18,;1.62,-3.49,;.38,-4.4,;-1.09,-3.92,;.85,-5.86,;2.39,-5.86,;2.87,-4.4,;4.33,-3.92,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCOC3)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.13,1.94,;-8.8,1.17,;-7.46,1.94,;-6.13,1.17,;-6.13,-.37,;-4.8,1.94,;-3.46,1.17,;-2.13,1.94,;-2.13,3.48,;-.79,4.25,;.54,3.48,;1.87,4.25,;.54,1.94,;-.79,1.17,;1.87,1.17,;3.21,1.94,;4.54,1.17,;5.87,1.94,;7.36,1.54,;7.76,3.03,;6.27,3.43,;7.76,4.57,;9.22,5.05,;10.13,3.8,;9.22,2.56,;4.54,-.37,;5.87,-1.14,;3.21,-1.14,;1.87,-.37,;3.21,-2.68,;1.96,-3.58,;.63,-2.81,;2.44,-5.05,;3.98,-5.05,;4.45,-3.58,;5.79,-2.81,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCOCC3)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.28,1.8,;-8.95,1.03,;-7.61,1.8,;-6.28,1.03,;-6.28,-.51,;-4.94,1.8,;-3.61,1.03,;-2.28,1.8,;-2.28,3.34,;-.94,4.11,;.39,3.34,;1.72,4.11,;.39,1.8,;-.94,1.03,;1.72,1.03,;3.06,1.8,;4.39,1.03,;5.73,1.8,;7.21,1.4,;7.61,2.88,;6.12,3.28,;8.95,2.11,;10.28,2.88,;10.28,4.42,;8.95,5.19,;7.61,4.42,;4.39,-.51,;5.73,-1.28,;3.06,-1.28,;1.72,-.51,;3.06,-2.82,;1.81,-3.73,;.48,-2.96,;2.29,-5.19,;3.83,-5.19,;4.3,-3.73,;5.64,-2.96,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCOCC3)c(Cl)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.28,1.8,;-8.95,1.03,;-7.61,1.8,;-6.28,1.03,;-6.28,-.51,;-4.94,1.8,;-3.61,1.03,;-2.28,1.8,;-2.28,3.34,;-.94,4.11,;.39,3.34,;1.72,4.11,;.39,1.8,;-.94,1.03,;1.72,1.03,;3.06,1.8,;4.39,1.03,;5.73,1.8,;7.21,1.4,;7.61,2.88,;6.12,3.28,;8.95,2.11,;10.28,2.88,;10.28,4.42,;8.95,5.19,;7.61,4.42,;4.39,-.51,;5.73,-1.28,;3.06,-1.28,;1.72,-.51,;3.06,-2.82,;1.81,-3.73,;.35,-3.25,;2.29,-5.19,;3.83,-5.19,;4.3,-3.73,;5.77,-3.25,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCOCC3)c(F)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.28,1.8,;-8.95,1.03,;-7.61,1.8,;-6.28,1.03,;-6.28,-.51,;-4.94,1.8,;-3.61,1.03,;-2.28,1.8,;-2.28,3.34,;-.94,4.11,;.39,3.34,;1.72,4.11,;.39,1.8,;-.94,1.03,;1.72,1.03,;3.06,1.8,;4.39,1.03,;5.73,1.8,;7.21,1.4,;7.61,2.88,;6.12,3.28,;8.95,2.11,;10.28,2.88,;10.28,4.42,;8.95,5.19,;7.61,4.42,;4.39,-.51,;5.73,-1.28,;3.06,-1.28,;1.72,-.51,;3.06,-2.82,;1.81,-3.73,;.35,-3.25,;2.29,-5.19,;3.83,-5.19,;4.3,-3.73,;5.77,-3.25,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(CCC3)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-9.89,2.21,;-8.55,1.44,;-7.22,2.21,;-5.89,1.44,;-5.89,-.1,;-4.55,2.21,;-3.22,1.44,;-1.89,2.21,;-1.89,3.75,;-.55,4.52,;.78,3.75,;2.11,4.52,;.78,2.21,;-.55,1.44,;2.11,1.44,;3.45,2.21,;4.78,1.44,;6.12,2.21,;7.6,1.81,;8,3.3,;9.49,2.9,;9.89,4.38,;8.4,4.78,;6.51,3.69,;4.78,-.1,;6.12,-.87,;3.45,-.87,;2.11,-.1,;3.45,-2.41,;2.2,-3.32,;.74,-2.84,;2.68,-4.78,;4.22,-4.78,;4.69,-3.32,;6.16,-2.84,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3CC3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-9.61,2.34,;-8.27,1.57,;-6.94,2.34,;-5.6,1.57,;-5.6,.03,;-4.27,2.34,;-2.94,1.57,;-1.6,2.34,;-1.6,3.88,;-.27,4.65,;1.06,3.88,;2.4,4.65,;1.06,2.34,;-.27,1.57,;2.4,1.57,;3.73,2.34,;5.06,1.57,;6.4,2.34,;7.81,1.71,;8.84,2.86,;9.61,4.19,;8.07,4.19,;6.56,3.87,;5.06,.03,;6.4,-.74,;3.73,-.74,;2.4,.03,;3.73,-2.28,;4.98,-3.19,;6.44,-2.71,;4.5,-4.65,;2.96,-4.65,;2.49,-3.19,;1.02,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-8.95,2.34,;-7.61,1.57,;-6.28,2.34,;-4.94,1.57,;-4.94,.03,;-3.61,2.34,;-2.28,1.57,;-.94,2.34,;-.94,3.88,;.39,4.65,;1.72,3.88,;3.06,4.65,;1.72,2.34,;.39,1.57,;3.06,1.57,;4.39,2.34,;5.73,1.57,;7.06,2.34,;8.55,1.94,;8.95,3.43,;7.46,3.83,;5.73,.03,;7.06,-.74,;4.39,-.74,;3.06,.03,;4.39,-2.28,;3.15,-3.19,;1.68,-2.71,;3.62,-4.65,;5.16,-4.65,;5.64,-3.19,;7.1,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC2C)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-9.13,2.34,;-7.8,1.57,;-6.46,2.34,;-5.13,1.57,;-5.13,.03,;-3.8,2.34,;-2.46,1.57,;-1.13,2.34,;-1.13,3.88,;.2,4.65,;1.54,3.88,;2.87,4.65,;1.54,2.34,;.2,1.57,;2.87,1.57,;4.21,2.34,;5.54,1.57,;6.87,2.34,;7.27,3.83,;8.76,3.43,;8.36,1.94,;9.13,.61,;5.54,.03,;6.87,-.74,;4.21,-.74,;2.87,.03,;4.21,-2.28,;2.96,-3.19,;1.47,-2.79,;3.44,-4.65,;4.98,-4.65,;5.45,-3.19,;6.94,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CC3)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-9.92,2.34,;-8.59,1.57,;-7.26,2.34,;-5.92,1.57,;-5.92,.03,;-4.59,2.34,;-3.26,1.57,;-1.92,2.34,;-1.92,3.88,;-.59,4.65,;.75,3.88,;2.08,4.65,;.75,2.34,;-.59,1.57,;2.08,1.57,;3.41,2.34,;4.75,1.57,;6.08,2.34,;6.24,3.87,;7.75,4.19,;8.52,2.86,;9.76,1.95,;9.92,3.48,;7.49,1.71,;4.75,.03,;6.08,-.74,;3.41,-.74,;2.08,.03,;3.41,-2.28,;4.66,-3.19,;6.12,-2.71,;4.18,-4.65,;2.64,-4.65,;2.17,-3.19,;.7,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CCCO3)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.44,2.34,;-9.11,1.57,;-7.77,2.34,;-6.44,1.57,;-6.44,.03,;-5.1,2.34,;-3.77,1.57,;-2.44,2.34,;-2.44,3.88,;-1.1,4.65,;.23,3.88,;1.56,4.65,;.23,2.34,;-1.1,1.57,;1.56,1.57,;2.9,2.34,;4.23,1.57,;5.56,2.34,;5.73,3.87,;7.23,4.19,;8,2.86,;8.77,1.52,;10.28,1.84,;10.44,3.38,;9.03,4,;6.97,1.71,;4.23,.03,;5.56,-.74,;2.9,-.74,;1.56,.03,;2.9,-2.28,;4.14,-3.19,;5.61,-2.71,;3.67,-4.65,;2.13,-4.65,;1.65,-3.19,;.19,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CCN(C3)C3CC3)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.81,1.67,;-10.47,.9,;-9.14,1.67,;-7.81,.9,;-7.81,-.64,;-6.47,1.67,;-5.14,.9,;-3.81,1.67,;-3.81,3.21,;-2.47,3.98,;-1.14,3.21,;.19,3.98,;-1.14,1.67,;-2.47,.9,;.19,.9,;1.53,1.67,;2.86,.9,;4.2,1.67,;4.2,3.21,;5.66,3.69,;6.57,2.44,;7.47,1.2,;8.93,1.67,;8.93,3.21,;7.47,3.69,;10.27,3.98,;11.81,3.98,;11.04,5.32,;5.66,1.2,;2.86,-.64,;4.2,-1.41,;1.53,-1.41,;.19,-.64,;1.53,-2.95,;2.77,-3.85,;4.11,-3.08,;2.3,-5.32,;.76,-5.32,;.28,-3.85,;-1.05,-3.08,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CCOC3)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.44,2.34,;-9.11,1.57,;-7.77,2.34,;-6.44,1.57,;-6.44,.03,;-5.1,2.34,;-3.77,1.57,;-2.44,2.34,;-2.44,3.88,;-1.1,4.65,;.23,3.88,;1.56,4.65,;.23,2.34,;-1.1,1.57,;1.56,1.57,;2.9,2.34,;4.23,1.57,;5.56,2.34,;5.73,3.87,;7.23,4.19,;8,2.86,;8.77,1.52,;10.28,1.84,;10.44,3.38,;9.03,4,;6.97,1.71,;4.23,.03,;5.56,-.74,;2.9,-.74,;1.56,.03,;2.9,-2.28,;4.14,-3.19,;5.61,-2.71,;3.67,-4.65,;2.13,-4.65,;1.65,-3.19,;.19,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CN(C3)C(=O)OC)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12.34,2.34,;-11,1.57,;-9.67,2.34,;-8.33,1.57,;-8.33,.03,;-7,2.34,;-5.67,1.57,;-4.33,2.34,;-4.33,3.88,;-3,4.65,;-1.67,3.88,;-.33,4.65,;-1.67,2.34,;-3,1.57,;-.33,1.57,;1,2.34,;2.33,1.57,;3.67,2.34,;3.83,3.87,;5.34,4.19,;6.11,2.86,;7.07,1.66,;8.27,2.63,;7.3,3.83,;9.76,2.23,;10.16,.74,;10.85,3.32,;12.34,2.92,;5.08,1.71,;2.33,.03,;3.67,-.74,;1,-.74,;-.33,.03,;1,-2.28,;2.25,-3.19,;3.73,-2.79,;1.77,-4.65,;.23,-4.65,;-.24,-3.19,;-1.73,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CN(C3)C(=O)OC)CC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12.28,1.03,;-10.95,.26,;-9.61,1.03,;-8.28,.26,;-8.28,-1.28,;-6.94,1.03,;-5.61,.26,;-4.28,1.03,;-4.28,2.57,;-2.94,3.34,;-1.61,2.57,;-.28,3.34,;-1.61,1.03,;-2.94,.26,;-.28,.26,;1.06,1.03,;2.39,.26,;3.72,1.03,;5.06,.26,;6.39,1.03,;6.39,2.57,;7.88,2.17,;8.28,3.65,;6.79,4.05,;9.61,4.42,;9.61,5.96,;10.95,3.65,;12.28,4.42,;5.06,3.34,;3.72,2.57,;2.39,-1.28,;3.72,-2.05,;1.06,-2.05,;-.28,-1.28,;1.06,-3.59,;2.3,-4.5,;3.64,-3.73,;1.83,-5.96,;.29,-5.96,;-.19,-4.5,;-1.52,-3.73,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CN(C3)C3CC3)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.79,2.34,;-10.46,1.57,;-9.12,2.34,;-7.79,1.57,;-7.79,.03,;-6.46,2.34,;-5.12,1.57,;-3.79,2.34,;-3.79,3.88,;-2.46,4.65,;-1.12,3.88,;.21,4.65,;-1.12,2.34,;-2.46,1.57,;.21,1.57,;1.55,2.34,;2.88,1.57,;4.21,2.34,;4.37,3.87,;5.88,4.19,;6.65,2.86,;7.62,1.66,;8.82,2.63,;7.85,3.83,;10.3,2.23,;11.39,1.14,;11.79,2.63,;5.62,1.71,;2.88,.03,;4.21,-.74,;1.55,-.74,;.21,.03,;1.55,-2.28,;2.79,-3.19,;4.28,-2.79,;2.32,-4.65,;.78,-4.65,;.3,-3.19,;-1.19,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CN(C3)C3CC3)CC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.72,1.13,;-10.38,.36,;-9.05,1.13,;-7.71,.36,;-7.71,-1.18,;-6.38,1.13,;-5.05,.36,;-3.71,1.13,;-3.71,2.67,;-2.38,3.44,;-1.05,2.67,;.29,3.44,;-1.05,1.13,;-2.38,.36,;.29,.36,;1.62,1.13,;2.95,.36,;4.29,1.13,;5.62,.36,;6.96,1.13,;6.96,2.67,;8.44,2.27,;8.84,3.76,;7.35,4.16,;10.18,4.53,;11.72,4.53,;10.95,5.86,;5.62,3.44,;4.29,2.67,;2.95,-1.18,;4.29,-1.95,;1.62,-1.95,;.29,-1.18,;1.62,-3.49,;2.87,-4.4,;4.35,-4,;2.39,-5.86,;.85,-5.86,;.38,-4.4,;-1.11,-4,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCOC2=O)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-9.22,2.34,;-7.89,1.57,;-6.55,2.34,;-5.22,1.57,;-5.22,.03,;-3.89,2.34,;-2.55,1.57,;-1.22,2.34,;-1.22,3.88,;.11,4.65,;1.45,3.88,;2.78,4.65,;1.45,2.34,;.11,1.57,;2.78,1.57,;4.12,2.34,;5.45,1.57,;6.78,2.34,;6.94,3.87,;8.45,4.19,;9.22,2.86,;8.19,1.71,;8.51,.21,;5.45,.03,;6.78,-.74,;4.12,-.74,;2.78,.03,;4.12,-2.28,;2.87,-3.19,;1.38,-2.79,;3.35,-4.65,;4.89,-4.65,;5.36,-3.19,;6.85,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCc3ccncc23)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.21,2.34,;-8.88,1.57,;-7.54,2.34,;-6.21,1.57,;-6.21,.03,;-4.88,2.34,;-3.54,1.57,;-2.21,2.34,;-2.21,3.88,;-.88,4.65,;.46,3.88,;1.79,4.65,;.46,2.34,;-.88,1.57,;1.79,1.57,;3.12,2.34,;4.46,1.57,;5.79,2.34,;5.95,3.87,;7.46,4.19,;8.23,2.86,;9.74,2.54,;10.21,1.07,;9.18,-.07,;7.67,.25,;7.2,1.71,;4.46,.03,;5.79,-.74,;3.12,-.74,;1.79,.03,;3.12,-2.28,;4.37,-3.19,;5.86,-2.79,;3.89,-4.65,;2.35,-4.65,;1.88,-3.19,;.39,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCc3nc(C)sc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.29,2.34,;-9.96,1.57,;-8.62,2.34,;-7.29,1.57,;-7.29,.03,;-5.96,2.34,;-4.62,1.57,;-3.29,2.34,;-3.29,3.88,;-1.95,4.65,;-.62,3.88,;.71,4.65,;-.62,2.34,;-1.95,1.57,;.71,1.57,;2.05,2.34,;3.38,1.57,;4.71,2.34,;4.71,3.88,;6.05,4.65,;7.38,3.88,;8.85,4.36,;9.75,3.11,;11.29,3.11,;8.85,1.86,;7.38,2.34,;6.05,1.57,;3.38,.03,;4.71,-.74,;2.05,-.74,;.71,.03,;2.05,-2.28,;3.29,-3.19,;4.63,-2.42,;2.82,-4.65,;1.28,-4.65,;.8,-3.19,;-.53,-2.42,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCc3ncccc23)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.21,2.34,;-8.88,1.57,;-7.54,2.34,;-6.21,1.57,;-6.21,.03,;-4.88,2.34,;-3.54,1.57,;-2.21,2.34,;-2.21,3.88,;-.88,4.65,;.46,3.88,;1.79,4.65,;.46,2.34,;-.88,1.57,;1.79,1.57,;3.12,2.34,;4.46,1.57,;5.79,2.34,;5.95,3.87,;7.46,4.19,;8.23,2.86,;9.74,2.54,;10.21,1.07,;9.18,-.07,;7.67,.25,;7.2,1.71,;4.46,.03,;5.79,-.74,;3.12,-.74,;1.79,.03,;3.12,-2.28,;4.37,-3.19,;5.86,-2.79,;3.89,-4.65,;2.35,-4.65,;1.88,-3.19,;.39,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCc3nn(C)cc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.29,2.34,;-9.96,1.57,;-8.62,2.34,;-7.29,1.57,;-7.29,.03,;-5.96,2.34,;-4.62,1.57,;-3.29,2.34,;-3.29,3.88,;-1.95,4.65,;-.62,3.88,;.71,4.65,;-.62,2.34,;-1.95,1.57,;.71,1.57,;2.05,2.34,;3.38,1.57,;4.71,2.34,;4.71,3.88,;6.05,4.65,;7.38,3.88,;8.85,4.36,;9.75,3.11,;11.29,3.11,;8.85,1.86,;7.38,2.34,;6.05,1.57,;3.38,.03,;4.71,-.74,;2.05,-.74,;.71,.03,;2.05,-2.28,;3.29,-3.19,;4.63,-2.42,;2.82,-4.65,;1.28,-4.65,;.8,-3.19,;-.53,-2.42,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2C[C@@H]3COC[C@@H]3C2)c(C)c(n1)-c1c(C)noc1C |r,wU:19.19,23.25,wD:3.3,(-10.05,1.9,;-8.72,1.13,;-7.39,1.9,;-6.05,1.13,;-6.05,-.41,;-4.72,1.9,;-3.39,1.13,;-2.05,1.9,;-2.05,3.44,;-.72,4.21,;.62,3.44,;1.95,4.21,;.62,1.9,;-.72,1.13,;1.95,1.13,;3.28,1.9,;4.62,1.13,;5.95,1.9,;7.36,1.28,;8.39,2.42,;9.89,2.74,;10.05,4.27,;8.65,4.9,;7.62,3.75,;6.11,3.43,;4.62,-.41,;5.95,-1.18,;3.28,-1.18,;1.95,-.41,;3.28,-2.72,;4.53,-3.62,;6.02,-3.22,;4.05,-5.09,;2.51,-5.09,;2.04,-3.62,;.55,-3.22,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3[nH]c(=O)[nH]c(=O)c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.15,1.24,;-9.81,.47,;-8.48,1.24,;-7.14,.47,;-7.14,-1.07,;-5.81,1.24,;-4.48,.47,;-3.14,1.24,;-3.14,2.78,;-1.81,3.55,;-.48,2.78,;.86,3.55,;-.48,1.24,;-1.81,.47,;.86,.47,;2.19,1.24,;3.52,.47,;4.86,1.24,;6.27,.61,;7.3,1.75,;8.84,1.75,;9.61,3.09,;11.15,3.09,;8.84,4.42,;7.3,4.42,;6.53,5.75,;6.53,3.09,;5.02,2.77,;3.52,-1.07,;4.86,-1.84,;2.19,-1.84,;.86,-1.07,;2.19,-3.38,;3.44,-4.29,;4.9,-3.81,;2.96,-5.75,;1.42,-5.75,;.95,-4.29,;-.52,-3.81,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3[nH]nc(C)c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.55,2,;-9.21,1.23,;-7.88,2,;-6.55,1.23,;-6.55,-.31,;-5.21,2,;-3.88,1.23,;-2.54,2,;-2.54,3.54,;-1.21,4.31,;.12,3.54,;1.46,4.31,;.12,2,;-1.21,1.23,;1.46,1.23,;2.79,2,;4.12,1.23,;5.46,2,;5.62,3.53,;7.13,3.85,;8.16,4.99,;9.56,4.37,;9.4,2.84,;10.55,1.8,;7.9,2.51,;6.86,1.37,;4.12,-.31,;5.46,-1.08,;2.79,-1.08,;1.46,-.31,;2.79,-2.62,;4.04,-3.53,;5.5,-3.05,;3.56,-4.99,;2.02,-4.99,;1.54,-3.53,;.08,-3.05,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3c(C)nn(C)c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.55,1.24,;-9.21,.47,;-7.88,1.24,;-6.55,.47,;-6.55,-1.07,;-5.21,1.24,;-3.88,.47,;-2.54,1.24,;-2.54,2.78,;-1.21,3.55,;.12,2.78,;1.46,3.55,;.12,1.24,;-1.21,.47,;1.46,.47,;2.79,1.24,;4.12,.47,;5.46,1.24,;5.62,2.78,;7.13,3.1,;8.16,4.24,;7.84,5.75,;9.56,3.61,;9.4,2.08,;10.55,1.05,;7.9,1.76,;6.86,.62,;4.12,-1.07,;5.46,-1.84,;2.79,-1.84,;1.46,-1.07,;2.79,-3.38,;4.04,-4.28,;5.5,-3.81,;3.56,-5.75,;2.02,-5.75,;1.54,-4.28,;.08,-3.81,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cc(Br)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.15,1.9,;-9.81,1.13,;-8.48,1.9,;-7.14,1.13,;-7.14,-.41,;-5.81,1.9,;-4.48,1.13,;-3.14,1.9,;-3.14,3.44,;-1.81,4.21,;-.48,3.44,;.86,4.21,;-.48,1.9,;-1.81,1.13,;.86,1.13,;2.19,1.9,;3.52,1.13,;4.86,1.9,;6.27,1.28,;7.3,2.42,;8.84,2.42,;9.61,3.75,;11.15,3.75,;8.84,5.09,;7.3,5.09,;6.53,3.75,;5.02,3.43,;3.52,-.41,;4.86,-1.18,;2.19,-1.18,;.86,-.41,;2.19,-2.72,;3.44,-3.62,;4.9,-3.15,;2.96,-5.09,;1.42,-5.09,;.95,-3.62,;-.52,-3.15,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cc(C)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.15,1.9,;-9.81,1.13,;-8.48,1.9,;-7.14,1.13,;-7.14,-.41,;-5.81,1.9,;-4.48,1.13,;-3.14,1.9,;-3.14,3.44,;-1.81,4.21,;-.48,3.44,;.86,4.21,;-.48,1.9,;-1.81,1.13,;.86,1.13,;2.19,1.9,;3.52,1.13,;4.86,1.9,;6.27,1.28,;7.3,2.42,;8.84,2.42,;9.61,3.75,;11.15,3.75,;8.84,5.09,;7.3,5.09,;6.53,3.75,;5.02,3.43,;3.52,-.41,;4.86,-1.18,;2.19,-1.18,;.86,-.41,;2.19,-2.72,;3.44,-3.62,;4.9,-3.15,;2.96,-5.09,;1.42,-5.09,;.95,-3.62,;-.52,-3.15,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cc(Cl)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.15,1.9,;-9.81,1.13,;-8.48,1.9,;-7.14,1.13,;-7.14,-.41,;-5.81,1.9,;-4.48,1.13,;-3.14,1.9,;-3.14,3.44,;-1.81,4.21,;-.48,3.44,;.86,4.21,;-.48,1.9,;-1.81,1.13,;.86,1.13,;2.19,1.9,;3.52,1.13,;4.86,1.9,;6.27,1.28,;7.3,2.42,;8.84,2.42,;9.61,3.75,;11.15,3.75,;8.84,5.09,;7.3,5.09,;6.53,3.75,;5.02,3.43,;3.52,-.41,;4.86,-1.18,;2.19,-1.18,;.86,-.41,;2.19,-2.72,;3.44,-3.62,;4.92,-3.22,;2.96,-5.09,;1.42,-5.09,;.95,-3.62,;-.54,-3.22,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cc(F)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.15,1.9,;-9.81,1.13,;-8.48,1.9,;-7.14,1.13,;-7.14,-.41,;-5.81,1.9,;-4.48,1.13,;-3.14,1.9,;-3.14,3.44,;-1.81,4.21,;-.48,3.44,;.86,4.21,;-.48,1.9,;-1.81,1.13,;.86,1.13,;2.19,1.9,;3.52,1.13,;4.86,1.9,;6.27,1.28,;7.3,2.42,;8.84,2.42,;9.61,3.75,;11.15,3.75,;8.84,5.09,;7.3,5.09,;6.53,3.75,;5.02,3.43,;3.52,-.41,;4.86,-1.18,;2.19,-1.18,;.86,-.41,;2.19,-2.72,;3.44,-3.62,;4.92,-3.22,;2.96,-5.09,;1.42,-5.09,;.95,-3.62,;-.54,-3.22,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cc(OC)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.53,1.9,;-10.2,1.13,;-8.86,1.9,;-7.53,1.13,;-7.53,-.41,;-6.2,1.9,;-4.86,1.13,;-3.53,1.9,;-3.53,3.44,;-2.2,4.21,;-.86,3.44,;.47,4.21,;-.86,1.9,;-2.2,1.13,;.47,1.13,;1.81,1.9,;3.14,1.13,;4.47,1.9,;5.88,1.28,;6.91,2.42,;8.45,2.42,;9.22,3.75,;10.76,3.75,;11.53,2.42,;8.45,5.09,;6.91,5.09,;6.14,3.75,;4.63,3.43,;3.14,-.41,;4.47,-1.18,;1.81,-1.18,;.47,-.41,;1.81,-2.72,;3.05,-3.62,;4.52,-3.15,;2.58,-5.09,;1.04,-5.09,;.56,-3.62,;-.9,-3.15,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cccc(F)c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;10.38,1.09,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.67,-3.15,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.25,-3.15,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cccnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.54,-2.85,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.38,-2.85,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cccnc3C2)c(Cl)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;7.04,1.28,;8.07,2.42,;9.61,2.42,;10.38,3.75,;9.61,5.09,;8.07,5.09,;7.3,3.75,;5.79,3.43,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.69,-3.22,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.23,-3.22,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3ccncc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.69,-3.22,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.23,-3.22,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3ccncc3C2)c(Cl)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.69,-3.22,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.23,-3.22,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cn(nc3C2)C(C)C)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.39,1.16,;-10.05,.39,;-8.72,1.16,;-7.39,.39,;-7.39,-1.15,;-6.05,1.16,;-4.72,.39,;-3.39,1.16,;-3.39,2.7,;-2.05,3.47,;-.72,2.7,;.62,3.47,;-.72,1.16,;-2.05,.39,;.62,.39,;1.95,1.16,;3.28,.39,;4.62,1.16,;6.02,.53,;7.05,1.67,;8.56,1.99,;8.72,3.52,;7.31,4.15,;6.28,3.01,;4.78,2.69,;10.05,4.29,;11.39,3.52,;10.05,5.83,;3.28,-1.15,;4.62,-1.92,;1.95,-1.92,;.62,-1.15,;1.95,-3.46,;3.19,-4.37,;4.66,-3.89,;2.72,-5.83,;1.18,-5.83,;.7,-4.37,;-.76,-3.89,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cn(nc3C2)S(C)(=O)=O)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.39,1.26,;-10.05,.49,;-8.72,1.26,;-7.39,.49,;-7.39,-1.05,;-6.05,1.26,;-4.72,.49,;-3.39,1.26,;-3.39,2.8,;-2.05,3.57,;-.72,2.8,;.62,3.57,;-.72,1.26,;-2.05,.49,;.62,.49,;1.95,1.26,;3.28,.49,;4.62,1.26,;6.02,.63,;7.05,1.78,;8.56,2.1,;8.72,3.63,;7.31,4.25,;6.28,3.11,;4.78,2.79,;10.05,4.4,;11.39,5.17,;9.28,5.73,;10.82,3.06,;3.28,-1.05,;4.62,-1.82,;1.95,-1.82,;.62,-1.05,;1.95,-3.36,;3.19,-4.27,;4.66,-3.79,;2.72,-5.73,;1.18,-5.73,;.7,-4.27,;-.76,-3.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cn[nH]c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.05,2,;-8.72,1.23,;-7.39,2,;-6.05,1.23,;-6.05,-.31,;-4.72,2,;-3.39,1.23,;-2.05,2,;-2.05,3.54,;-.72,4.31,;.62,3.54,;1.95,4.31,;.62,2,;-.72,1.23,;1.95,1.23,;3.28,2,;4.62,1.23,;5.95,2,;6.11,3.53,;7.62,3.85,;8.65,4.99,;10.05,4.37,;9.89,2.84,;8.39,2.51,;7.36,1.37,;4.62,-.31,;5.95,-1.08,;3.28,-1.08,;1.95,-.31,;3.28,-2.62,;2.04,-3.53,;.57,-3.05,;2.51,-4.99,;4.05,-4.99,;4.53,-3.53,;5.99,-3.05,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cnc(C)nc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.15,1.9,;-9.81,1.13,;-8.48,1.9,;-7.14,1.13,;-7.14,-.41,;-5.81,1.9,;-4.48,1.13,;-3.14,1.9,;-3.14,3.44,;-1.81,4.21,;-.48,3.44,;.86,4.21,;-.48,1.9,;-1.81,1.13,;.86,1.13,;2.19,1.9,;3.52,1.13,;4.86,1.9,;5.02,3.43,;6.53,3.75,;7.3,5.09,;8.84,5.09,;9.61,3.75,;11.15,3.75,;8.84,2.42,;7.3,2.42,;6.27,1.28,;3.52,-.41,;4.86,-1.18,;2.19,-1.18,;.86,-.41,;2.19,-2.72,;3.44,-3.62,;4.9,-3.15,;2.96,-5.09,;1.42,-5.09,;.95,-3.62,;-.52,-3.15,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cnc(nc3C2)C(C)C)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.53,1.9,;-10.2,1.13,;-8.86,1.9,;-7.53,1.13,;-7.53,-.41,;-6.2,1.9,;-4.86,1.13,;-3.53,1.9,;-3.53,3.44,;-2.2,4.21,;-.86,3.44,;.47,4.21,;-.86,1.9,;-2.2,1.13,;.47,1.13,;1.81,1.9,;3.14,1.13,;4.47,1.9,;4.63,3.43,;6.14,3.75,;6.91,5.09,;8.45,5.09,;9.22,3.75,;8.45,2.42,;6.91,2.42,;5.88,1.28,;10.76,3.75,;11.53,2.42,;11.53,5.09,;3.14,-.41,;4.47,-1.18,;1.81,-1.18,;.47,-.41,;1.81,-2.72,;3.05,-3.62,;4.52,-3.15,;2.58,-5.09,;1.04,-5.09,;.56,-3.62,;-.9,-3.15,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cnc(nc3C2)C(F)(F)F)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.92,1.9,;-10.58,1.13,;-9.25,1.9,;-7.91,1.13,;-7.91,-.41,;-6.58,1.9,;-5.25,1.13,;-3.91,1.9,;-3.91,3.44,;-2.58,4.21,;-1.25,3.44,;.09,4.21,;-1.25,1.9,;-2.58,1.13,;.09,1.13,;1.42,1.9,;2.75,1.13,;4.09,1.9,;4.25,3.43,;5.76,3.75,;6.53,5.09,;8.07,5.09,;8.84,3.75,;8.07,2.42,;6.53,2.42,;5.5,1.28,;10.38,3.75,;11.15,2.42,;11.15,5.09,;11.92,3.75,;2.75,-.41,;4.09,-1.18,;1.42,-1.18,;.09,-.41,;1.42,-2.72,;2.67,-3.62,;4.13,-3.15,;2.19,-5.09,;.65,-5.09,;.18,-3.62,;-1.29,-3.15,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cnc(nc3C2)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.81,1.9,;-10.48,1.13,;-9.15,1.9,;-7.81,1.13,;-7.81,-.41,;-6.48,1.9,;-5.14,1.13,;-3.81,1.9,;-3.81,3.44,;-2.48,4.21,;-1.14,3.44,;.19,4.21,;-1.14,1.9,;-2.48,1.13,;.19,1.13,;1.52,1.9,;2.86,1.13,;4.19,1.9,;4.35,3.43,;5.86,3.75,;6.63,5.09,;8.17,5.09,;8.94,3.75,;8.17,2.42,;6.63,2.42,;5.6,1.28,;10.48,3.75,;11.81,2.98,;11.81,4.52,;2.86,-.41,;4.19,-1.18,;1.52,-1.18,;.19,-.41,;1.52,-2.72,;2.77,-3.62,;4.23,-3.15,;2.29,-5.09,;.75,-5.09,;.28,-3.62,;-1.19,-3.15,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cncnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;7.04,1.28,;8.07,2.42,;9.61,2.42,;10.38,3.75,;9.61,5.09,;8.07,5.09,;7.3,3.75,;5.79,3.43,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.69,-3.22,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.23,-3.22,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cnn(C)c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.59,1.86,;-9.25,1.09,;-7.92,1.86,;-6.59,1.09,;-6.59,-.45,;-5.25,1.86,;-3.92,1.09,;-2.58,1.86,;-2.58,3.4,;-1.25,4.17,;.08,3.4,;1.42,4.17,;.08,1.86,;-1.25,1.09,;1.42,1.09,;2.75,1.86,;4.08,1.09,;5.42,1.86,;5.42,3.4,;6.88,3.88,;7.79,5.13,;9.25,4.65,;9.25,3.11,;10.59,2.34,;7.79,2.63,;6.88,1.39,;4.08,-.45,;5.42,-1.22,;2.75,-1.22,;1.42,-.45,;2.75,-2.76,;4,-3.66,;5.33,-2.89,;3.52,-5.13,;1.98,-5.13,;1.5,-3.66,;.17,-2.89,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cnn(C4CC4)c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.3,2,;-9.97,1.23,;-8.63,2,;-7.3,1.23,;-7.3,-.31,;-5.96,2,;-4.63,1.23,;-3.3,2,;-3.3,3.54,;-1.96,4.31,;-.63,3.54,;.7,4.31,;-.63,2,;-1.96,1.23,;.7,1.23,;2.04,2,;3.37,1.23,;4.7,2,;4.87,3.53,;6.37,3.85,;7.4,4.99,;8.81,4.37,;8.65,2.84,;9.79,1.8,;10.27,.34,;11.3,1.48,;7.14,2.51,;6.11,1.37,;3.37,-.31,;4.7,-1.08,;2.04,-1.08,;.7,-.31,;2.04,-2.62,;3.28,-3.53,;4.75,-3.05,;2.81,-4.99,;1.27,-4.99,;.79,-3.53,;-.67,-3.05,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cnn(CC(F)(F)F)c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12.01,2,;-10.68,1.23,;-9.34,2,;-8.01,1.23,;-8.01,-.31,;-6.68,2,;-5.34,1.23,;-4.01,2,;-4.01,3.54,;-2.67,4.31,;-1.34,3.54,;-.01,4.31,;-1.34,2,;-2.67,1.23,;-.01,1.23,;1.33,2,;2.66,1.23,;3.99,2,;4.15,3.53,;5.66,3.85,;6.69,4.99,;8.1,4.37,;7.94,2.84,;9.08,1.8,;10.55,2.28,;11.69,1.25,;10.87,3.79,;12.01,2.76,;6.43,2.51,;5.4,1.37,;2.66,-.31,;3.99,-1.08,;1.33,-1.08,;-.01,-.31,;1.33,-2.62,;2.57,-3.53,;4.04,-3.05,;2.1,-4.99,;.56,-4.99,;.08,-3.53,;-1.38,-3.05,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3nc(C)sc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.72,1.92,;-9.39,1.15,;-8.05,1.92,;-6.72,1.15,;-6.72,-.39,;-5.39,1.92,;-4.05,1.15,;-2.72,1.92,;-2.72,3.46,;-1.39,4.23,;-.05,3.46,;1.28,4.23,;-.05,1.92,;-1.39,1.15,;1.28,1.15,;2.62,1.92,;3.95,1.15,;5.28,1.92,;6.69,1.3,;7.72,2.44,;9.23,2.76,;9.39,4.29,;10.72,5.06,;7.98,4.92,;6.95,3.78,;5.44,3.46,;3.95,-.39,;5.28,-1.16,;2.62,-1.16,;1.28,-.39,;2.62,-2.7,;3.86,-3.6,;5.35,-3.2,;3.39,-5.06,;1.85,-5.06,;1.37,-3.6,;-.12,-3.2,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3nc(C)sc3C2)c(Cl)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.72,1.93,;-9.39,1.15,;-8.05,1.93,;-6.72,1.15,;-6.72,-.38,;-5.39,1.93,;-4.05,1.15,;-2.72,1.93,;-2.72,3.47,;-1.39,4.23,;-.05,3.47,;1.28,4.23,;-.05,1.93,;-1.39,1.15,;1.28,1.15,;2.62,1.93,;3.95,1.15,;5.28,1.93,;6.69,1.3,;7.72,2.44,;9.23,2.76,;9.39,4.29,;10.72,5.06,;7.98,4.92,;6.95,3.78,;5.44,3.46,;3.95,-.38,;5.28,-1.15,;2.62,-1.15,;1.28,-.38,;2.62,-2.69,;3.86,-3.6,;5.33,-3.12,;3.39,-5.06,;1.85,-5.06,;1.37,-3.6,;-.1,-3.12,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3nccnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.54,-2.85,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.38,-2.85,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3nccnc3C2)c(Cl)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;7.04,1.28,;8.07,2.42,;9.61,2.42,;10.38,3.75,;9.61,5.09,;8.07,5.09,;7.3,3.75,;5.79,3.43,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.67,-3.15,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.25,-3.15,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3nccnc3C2)c(F)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;7.04,1.28,;8.07,2.42,;9.61,2.42,;10.38,3.75,;9.61,5.09,;8.07,5.09,;7.3,3.75,;5.79,3.43,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.67,-3.15,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.25,-3.15,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3nn(C)c(C)c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.72,1.93,;-9.39,1.16,;-8.05,1.93,;-6.72,1.16,;-6.72,-.38,;-5.39,1.93,;-4.05,1.16,;-2.72,1.93,;-2.72,3.47,;-1.39,4.24,;-.05,3.47,;1.28,4.24,;-.05,1.93,;-1.39,1.16,;1.28,1.16,;2.62,1.93,;3.95,1.16,;5.28,1.93,;5.44,3.46,;6.95,3.78,;7.98,4.92,;9.39,4.29,;10.72,5.06,;9.23,2.76,;10.37,1.73,;7.72,2.44,;6.69,1.3,;3.95,-.38,;5.28,-1.15,;2.62,-1.15,;1.28,-.38,;2.62,-2.69,;3.86,-3.6,;5.33,-3.12,;3.39,-5.06,;1.85,-5.06,;1.37,-3.6,;-.1,-3.12,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CC(C)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;1.72,4.65,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;7.46,.08,;8.95,.48,;10.28,-.29,;8.55,1.97,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;1.81,-3.19,;.35,-2.71,;2.29,-4.65,;3.83,-4.65,;4.3,-3.19,;5.77,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CC(COC)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.95,2.34,;-9.61,1.57,;-8.28,2.34,;-6.94,1.57,;-6.94,.03,;-5.61,2.34,;-4.28,1.57,;-2.94,2.34,;-2.94,3.88,;-1.61,4.65,;-.28,3.88,;1.06,4.65,;-.28,2.34,;-1.61,1.57,;1.06,1.57,;2.39,2.34,;3.72,1.57,;5.06,2.34,;6.39,1.57,;6.79,.08,;8.28,.48,;9.61,-.29,;9.61,-1.83,;10.95,-2.6,;7.88,1.97,;3.72,.03,;5.06,-.74,;2.39,-.74,;1.06,.03,;2.39,-2.28,;1.15,-3.19,;-.32,-2.71,;1.62,-4.65,;3.16,-4.65,;3.64,-3.19,;5.1,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CC(F)(F)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,2.34,;-9.05,1.57,;-7.71,2.34,;-6.38,1.57,;-6.38,.03,;-5.05,2.34,;-3.71,1.57,;-2.38,2.34,;-2.38,3.88,;-1.05,4.65,;.29,3.88,;1.62,4.65,;.29,2.34,;-1.05,1.57,;1.62,1.57,;2.95,2.34,;4.29,1.57,;5.62,2.34,;6.96,1.57,;7.35,.08,;8.84,.48,;10.38,.48,;9.61,-.85,;8.44,1.97,;4.29,.03,;5.62,-.74,;2.95,-.74,;1.62,.03,;2.95,-2.28,;1.71,-3.19,;.22,-2.79,;2.18,-4.65,;3.72,-4.65,;4.2,-3.19,;5.69,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CC(F)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;1.72,4.65,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;7.46,.08,;8.95,.48,;10.28,-.29,;8.55,1.97,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;1.81,-3.19,;.32,-2.79,;2.29,-4.65,;3.83,-4.65,;4.3,-3.19,;5.79,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CC3(C2)CN(C3)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.89,2.34,;-10.56,1.57,;-9.22,2.34,;-7.89,1.57,;-7.89,.03,;-6.55,2.34,;-5.22,1.57,;-3.89,2.34,;-3.89,3.88,;-2.55,4.65,;-1.22,3.88,;.11,4.65,;-1.22,2.34,;-2.55,1.57,;.11,1.57,;1.45,2.34,;2.78,1.57,;4.12,2.34,;5.45,1.57,;5.85,.08,;7.34,.48,;6.94,1.97,;7.73,-1.01,;9.22,-.61,;8.82,.88,;10.56,-1.38,;11.89,-.61,;10.56,-2.92,;11.89,-3.69,;2.78,.03,;4.12,-.74,;1.45,-.74,;.11,.03,;1.45,-2.28,;.2,-3.19,;-1.29,-2.79,;.68,-4.65,;2.22,-4.65,;2.69,-3.19,;4.18,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CCN(C)CC2(F)F)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,-.74,;9.34,.03,;10.67,-.74,;9.34,1.57,;8,2.34,;7.23,3.67,;8.77,3.67,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CCN(CC2(F)F)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.44,2.34,;-10.11,1.57,;-8.77,2.34,;-7.44,1.57,;-7.44,.03,;-6.1,2.34,;-4.77,1.57,;-3.44,2.34,;-3.44,3.88,;-2.1,4.65,;-.77,3.88,;.56,4.65,;-.77,2.34,;-2.1,1.57,;.56,1.57,;1.9,2.34,;3.23,1.57,;4.56,2.34,;5.9,1.57,;5.9,.03,;7.23,-.74,;8.57,.03,;8.57,1.57,;7.23,2.34,;6.46,3.67,;8,3.67,;9.9,-.74,;10.67,-2.07,;11.44,-.74,;3.23,.03,;4.56,-.74,;1.9,-.74,;.56,.03,;1.9,-2.28,;3.14,-3.19,;4.61,-2.71,;2.67,-4.65,;1.13,-4.65,;.65,-3.19,;-.81,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(Cl)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;2,4.65,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;5.91,-2.42,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.75,-2.42,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC[C@@H]2CCCO2)c(C)c(n1)-c1c(C)noc1C |r,wD:19.19,3.3,(-10.52,2.34,;-9.19,1.57,;-7.85,2.34,;-6.52,1.57,;-6.52,.03,;-5.19,2.34,;-3.85,1.57,;-2.52,2.34,;-2.52,3.88,;-1.18,4.65,;.15,3.88,;1.48,4.65,;.15,2.34,;-1.18,1.57,;1.48,1.57,;2.82,2.34,;4.15,1.57,;5.48,2.34,;6.82,1.57,;8.15,2.34,;8.15,3.88,;9.62,4.36,;10.52,3.11,;9.62,1.86,;4.15,.03,;5.48,-.74,;2.82,-.74,;1.48,.03,;2.82,-2.28,;1.57,-3.19,;.24,-2.42,;2.05,-4.65,;3.59,-4.65,;4.06,-3.19,;5.4,-2.42,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC[C@@H]2CCOC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,19.19,(-10.55,2.34,;-9.22,1.57,;-7.89,2.34,;-6.55,1.57,;-6.55,.03,;-5.22,2.34,;-3.89,1.57,;-2.55,2.34,;-2.55,3.88,;-1.22,4.65,;.11,3.88,;1.45,4.65,;.11,2.34,;-1.22,1.57,;1.45,1.57,;2.78,2.34,;4.12,1.57,;5.45,2.34,;6.78,1.57,;8.12,2.34,;8.28,3.87,;9.78,4.19,;10.55,2.86,;9.52,1.71,;4.12,.03,;5.45,-.74,;2.78,-.74,;1.45,.03,;2.78,-2.28,;1.54,-3.19,;.07,-2.71,;2.01,-4.65,;3.55,-4.65,;4.03,-3.19,;5.49,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC[C@H]2CCCN2C(=O)OC(C)C)c(C)c(n1)-c1c(C)noc1C |r,wU:19.19,wD:3.3,(-11.93,2.34,;-10.59,1.57,;-9.26,2.34,;-7.92,1.57,;-7.92,.03,;-6.59,2.34,;-5.26,1.57,;-3.92,2.34,;-3.92,3.88,;-2.59,4.65,;-1.26,3.88,;.08,4.65,;-1.26,2.34,;-2.59,1.57,;.08,1.57,;1.41,2.34,;2.75,1.57,;4.08,2.34,;5.41,1.57,;6.75,2.34,;6.91,3.87,;8.41,4.19,;9.18,2.86,;8.15,1.71,;8.55,.23,;7.46,-.86,;10.04,-.17,;10.44,-1.66,;11.93,-2.06,;9.35,-2.75,;2.75,.03,;4.08,-.74,;1.41,-.74,;.08,.03,;1.41,-2.28,;.17,-3.19,;-1.32,-2.79,;.64,-4.65,;2.18,-4.65,;2.66,-3.19,;4.14,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(NC[C@H]2CCCO2)c(C)c(n1)-c1c(C)noc1C |r,wU:19.19,wD:3.3,(-10.52,2.34,;-9.19,1.57,;-7.85,2.34,;-6.52,1.57,;-6.52,.03,;-5.19,2.34,;-3.85,1.57,;-2.52,2.34,;-2.52,3.88,;-1.18,4.65,;.15,3.88,;1.48,4.65,;.15,2.34,;-1.18,1.57,;1.48,1.57,;2.82,2.34,;4.15,1.57,;5.48,2.34,;6.82,1.57,;8.15,2.34,;8.15,3.88,;9.62,4.36,;10.52,3.11,;9.62,1.86,;4.15,.03,;5.48,-.74,;2.82,-.74,;1.48,.03,;2.82,-2.28,;1.57,-3.19,;.24,-2.42,;2.05,-4.65,;3.59,-4.65,;4.06,-3.19,;5.4,-2.42,)|
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CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CN(C[C@@H]2F)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wU:22.24,wD:18.18,3.3,(-10.25,2.34,;-8.91,1.57,;-7.58,2.34,;-6.25,1.57,;-6.25,.03,;-4.91,2.34,;-3.58,1.57,;-2.24,2.34,;-2.24,3.88,;-.91,4.65,;.42,3.88,;1.76,4.65,;.42,2.34,;-.91,1.57,;1.76,1.57,;3.09,2.34,;4.42,1.57,;5.76,2.34,;7.09,1.57,;7.25,.04,;8.76,-.28,;9.53,1.05,;8.5,2.2,;8.9,3.68,;9.16,-1.77,;8.76,-3.26,;10.25,-2.86,;4.42,.03,;5.76,-.74,;3.09,-.74,;1.76,.03,;3.09,-2.28,;4.34,-3.19,;5.82,-2.79,;3.86,-4.65,;2.32,-4.65,;1.84,-3.19,;.36,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2COC[C@@H]2O)c(C)c(n1)-c1c(C)noc1C |r,wU:22.24,wD:3.3,18.18,(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;2.12,4.65,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;7.61,.04,;9.12,-.28,;9.89,1.05,;8.86,2.2,;9.26,3.68,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;4.7,-3.19,;6.18,-2.79,;4.22,-4.65,;2.68,-4.65,;2.2,-3.19,;.72,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CO[C@@H](C)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:18.18,3.3,21.22,(-10.65,2.34,;-9.32,1.57,;-7.99,2.34,;-6.65,1.57,;-6.65,.03,;-5.32,2.34,;-3.98,1.57,;-2.65,2.34,;-2.65,3.88,;-1.32,4.65,;.02,3.88,;1.35,4.65,;.02,2.34,;-1.32,1.57,;1.35,1.57,;2.68,2.34,;4.02,1.57,;5.35,2.34,;6.68,1.57,;6.85,.04,;8.35,-.28,;9.12,1.05,;10.65,1.21,;8.09,2.2,;4.02,.03,;5.35,-.74,;2.68,-.74,;1.35,.03,;2.68,-2.28,;3.93,-3.19,;5.42,-2.79,;3.45,-4.65,;1.91,-4.65,;1.44,-3.19,;-.05,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CO[C@@H](C)C2)c(Cl)c(n1)-c1c(C)noc1C |r,wD:18.18,3.3,21.22,(-10.65,2.34,;-9.32,1.57,;-7.99,2.34,;-6.65,1.57,;-6.65,.03,;-5.32,2.34,;-3.98,1.57,;-2.65,2.34,;-2.65,3.88,;-1.32,4.65,;.02,3.88,;1.35,4.65,;.02,2.34,;-1.32,1.57,;1.35,1.57,;2.68,2.34,;4.02,1.57,;5.35,2.34,;6.68,1.57,;6.85,.04,;8.35,-.28,;9.12,1.05,;10.65,1.21,;8.09,2.2,;4.02,.03,;5.35,-.74,;2.68,-.74,;1.35,.03,;2.68,-2.28,;3.93,-3.19,;5.42,-2.79,;3.45,-4.65,;1.91,-4.65,;1.44,-3.19,;-.05,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CO[C@H](C)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:21.22,wD:3.3,18.18,(-10.66,2.34,;-9.32,1.57,;-7.99,2.34,;-6.66,1.57,;-6.66,.03,;-5.32,2.34,;-3.99,1.57,;-2.66,2.34,;-2.66,3.88,;-1.32,4.65,;.01,3.88,;1.35,4.65,;.01,2.34,;-1.32,1.57,;1.35,1.57,;2.68,2.34,;4.01,1.57,;5.35,2.34,;6.68,1.57,;6.84,.04,;8.35,-.28,;9.12,1.05,;10.66,1.05,;8.09,2.2,;4.01,.03,;5.35,-.74,;2.68,-.74,;1.35,.03,;2.68,-2.28,;3.93,-3.19,;5.41,-2.79,;3.45,-4.65,;1.91,-4.65,;1.43,-3.19,;-.05,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CO[C@H](C)C2)c(Cl)c(n1)-c1c(C)noc1C |r,wU:21.22,wD:3.3,18.18,(-10.66,2.34,;-9.32,1.57,;-7.99,2.34,;-6.66,1.57,;-6.66,.03,;-5.32,2.34,;-3.99,1.57,;-2.66,2.34,;-2.66,3.88,;-1.32,4.65,;.01,3.88,;1.35,4.65,;.01,2.34,;-1.32,1.57,;1.35,1.57,;2.68,2.34,;4.01,1.57,;5.35,2.34,;6.68,1.57,;6.84,.04,;8.35,-.28,;9.12,1.05,;10.66,1.05,;8.09,2.2,;4.01,.03,;5.35,-.74,;2.68,-.74,;1.35,.03,;2.68,-2.28,;3.93,-3.19,;5.41,-2.79,;3.45,-4.65,;1.91,-4.65,;1.43,-3.19,;-.05,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2C[C@@H](C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:18.18,wD:20.23,3.3,(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;1.72,4.65,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;8.55,1.97,;8.95,.48,;7.46,.08,;10.28,-.29,;10.28,-1.83,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;1.81,-3.19,;.32,-2.79,;2.29,-4.65,;3.83,-4.65,;4.3,-3.19,;5.79,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2C[C@@H](C2)OC)c(Cl)c(n1)-c1c(C)noc1C |r,wU:18.18,wD:3.3,20.23,(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;1.72,4.65,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;8.55,1.97,;8.95,.48,;7.46,.08,;10.28,-.29,;10.28,-1.83,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;1.81,-3.19,;.32,-2.79,;2.29,-4.65,;3.83,-4.65,;4.3,-3.19,;5.79,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2C[C@H](C)O[C@H](C)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:18.18,wD:3.3,20.21,23.24,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;9.34,.03,;8,-.74,;8,-2.28,;6.67,.03,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.4,-2.79,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.07,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2C[C@H](C)O[C@H](C)C2)c(Cl)c(n1)-c1c(C)noc1C |r,wU:18.18,wD:3.3,20.21,23.24,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;9.34,.03,;8,-.74,;8,-2.28,;6.67,.03,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.4,-2.79,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.07,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2C[C@H](C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:18.18,20.23,wD:3.3,(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;1.72,4.65,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;8.55,1.97,;8.95,.48,;7.46,.08,;10.28,-.29,;10.28,-1.83,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;1.81,-3.19,;.32,-2.79,;2.29,-4.65,;3.83,-4.65,;4.3,-3.19,;5.79,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2C[C@H](C2)OC)c(Cl)c(n1)-c1c(C)noc1C |r,wU:18.18,20.23,wD:3.3,(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;1.72,4.65,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;8.55,1.97,;8.95,.48,;7.46,.08,;10.28,-.29,;10.28,-1.83,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;1.81,-3.19,;.32,-2.79,;2.29,-4.65,;3.83,-4.65,;4.3,-3.19,;5.79,-2.79,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2C[C@](C)(C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:18.18,20.24,wD:3.3,20.21,(-10.77,2.34,;-9.43,1.57,;-8.1,2.34,;-6.77,1.57,;-6.77,.03,;-5.43,2.34,;-4.1,1.57,;-2.76,2.34,;-2.76,3.88,;-1.43,4.65,;-.1,3.88,;1.24,4.65,;-.1,2.34,;-1.43,1.57,;1.24,1.57,;2.57,2.34,;3.9,1.57,;5.24,2.34,;6.57,1.57,;8.06,1.97,;8.46,.48,;10,.48,;6.97,.08,;9.23,-.85,;10.77,-.85,;3.9,.03,;5.24,-.74,;2.57,-.74,;1.24,.03,;2.57,-2.28,;1.32,-3.19,;-.14,-2.71,;1.8,-4.65,;3.34,-4.65,;3.82,-3.19,;5.28,-2.71,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(OC[C@@H]2CCOC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,19.19,(-10.52,2.34,;-9.19,1.57,;-7.85,2.34,;-6.52,1.57,;-6.52,.03,;-5.19,2.34,;-3.85,1.57,;-2.52,2.34,;-2.52,3.88,;-1.18,4.65,;.15,3.88,;1.48,4.65,;.15,2.34,;-1.18,1.57,;1.48,1.57,;2.82,2.34,;4.15,1.57,;5.48,2.34,;6.82,1.57,;8.15,2.34,;8.15,3.88,;9.62,4.36,;10.52,3.11,;9.62,1.86,;4.15,.03,;5.48,-.74,;2.82,-.74,;1.48,.03,;2.82,-2.28,;1.57,-3.19,;.24,-2.42,;2.05,-4.65,;3.59,-4.65,;4.06,-3.19,;5.4,-2.42,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(OC[C@H]2CCCO2)c(C)c(n1)-c1c(C)noc1C |r,wU:19.19,wD:3.3,(-10.52,2.34,;-9.19,1.57,;-7.85,2.34,;-6.52,1.57,;-6.52,.03,;-5.19,2.34,;-3.85,1.57,;-2.52,2.34,;-2.52,3.88,;-1.18,4.65,;.15,3.88,;1.48,4.65,;.15,2.34,;-1.18,1.57,;1.48,1.57,;2.82,2.34,;4.15,1.57,;5.48,2.34,;6.82,1.57,;8.15,2.34,;8.15,3.88,;9.62,4.36,;10.52,3.11,;9.62,1.86,;4.15,.03,;5.48,-.74,;2.82,-.74,;1.48,.03,;2.82,-2.28,;1.57,-3.19,;.24,-2.42,;2.05,-4.65,;3.59,-4.65,;4.06,-3.19,;5.4,-2.42,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(OC[C@H]2CCOC2)c(C)c(n1)-c1c(C)noc1C |r,wU:19.19,wD:3.3,(-10.52,2.34,;-9.19,1.57,;-7.85,2.34,;-6.52,1.57,;-6.52,.03,;-5.19,2.34,;-3.85,1.57,;-2.52,2.34,;-2.52,3.88,;-1.18,4.65,;.15,3.88,;1.48,4.65,;.15,2.34,;-1.18,1.57,;1.48,1.57,;2.82,2.34,;4.15,1.57,;5.48,2.34,;6.82,1.57,;8.15,2.34,;8.15,3.88,;9.62,4.36,;10.52,3.11,;9.62,1.86,;4.15,.03,;5.48,-.74,;2.82,-.74,;1.48,.03,;2.82,-2.28,;1.57,-3.19,;.24,-2.42,;2.05,-4.65,;3.59,-4.65,;4.06,-3.19,;5.4,-2.42,)|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CC2(C1)CCOCC2 |r|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1Cc2cnn(C)c2C1 |r|
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1Cc2nccnc2C1 |r|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(-c2c(C)noc2C)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-9.22,2.18,;-7.89,1.41,;-6.55,2.18,;-5.22,1.41,;-5.22,-.13,;-3.89,2.18,;-2.55,1.41,;-1.22,2.18,;-1.22,3.72,;.11,4.49,;1.45,3.72,;2.78,4.49,;1.45,2.18,;.11,1.41,;2.78,1.41,;2.78,-.13,;4.12,-.9,;4.12,-2.44,;5.36,-3.34,;6.85,-2.94,;4.89,-4.81,;3.35,-4.81,;2.87,-3.34,;1.38,-2.94,;5.45,-.13,;6.78,-.9,;5.45,1.41,;4.12,2.18,;6.78,2.18,;6.94,3.72,;5.86,4.81,;8.45,4.04,;9.22,2.7,;8.19,1.56,;8.59,.07,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2CC3(C2)CCCCO3)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.28,1.8,;-8.95,1.03,;-7.61,1.8,;-6.28,1.03,;-6.28,-.51,;-4.94,1.8,;-3.61,1.03,;-2.28,1.8,;-2.28,3.34,;-.94,4.11,;.39,3.34,;1.72,4.11,;.39,1.8,;-.94,1.03,;1.72,1.03,;3.06,1.8,;4.39,1.03,;5.73,1.8,;7.21,1.4,;7.61,2.88,;6.12,3.28,;7.61,4.42,;8.95,5.19,;10.28,4.42,;10.28,2.88,;8.95,2.11,;4.39,-.51,;5.73,-1.28,;3.06,-1.28,;1.72,-.51,;3.06,-2.82,;1.81,-3.73,;.35,-3.25,;2.29,-5.19,;3.83,-5.19,;4.3,-3.73,;5.77,-3.25,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2CC3(C2)CCN(CC(F)F)CC3)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12.28,1.8,;-10.95,1.03,;-9.61,1.8,;-8.28,1.03,;-8.28,-.51,;-6.94,1.8,;-5.61,1.03,;-4.28,1.8,;-4.28,3.34,;-2.94,4.11,;-1.61,3.34,;-.28,4.11,;-1.61,1.8,;-2.94,1.03,;-.28,1.03,;1.06,1.8,;2.39,1.03,;3.72,1.8,;5.21,1.4,;5.61,2.88,;4.12,3.28,;6.94,2.11,;8.28,2.88,;8.28,4.42,;9.61,5.19,;10.95,4.42,;12.28,5.19,;10.95,2.88,;6.94,5.19,;5.61,4.42,;2.39,-.51,;3.72,-1.28,;1.06,-1.28,;-.28,-.51,;1.06,-2.82,;-.19,-3.73,;-1.65,-3.25,;.29,-5.19,;1.83,-5.19,;2.3,-3.73,;3.77,-3.25,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2CC3(C2)CCN(CC3)C(=O)OC(C)C)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12.95,1.03,;-11.61,.26,;-10.28,1.03,;-8.95,.26,;-8.95,-1.28,;-7.61,1.03,;-6.28,.26,;-4.94,1.03,;-4.94,2.57,;-3.61,3.34,;-2.28,2.57,;-.94,3.34,;-2.28,1.03,;-3.61,.26,;-.94,.26,;.39,1.03,;1.72,.26,;3.06,1.03,;4.55,.63,;4.94,2.11,;3.46,2.51,;6.28,1.34,;7.61,2.11,;7.61,3.65,;6.28,4.42,;4.94,3.65,;8.95,4.42,;8.95,5.96,;10.28,3.65,;11.61,4.42,;12.95,3.65,;11.61,5.96,;1.72,-1.28,;3.06,-2.05,;.39,-2.05,;-.94,-1.28,;.39,-3.59,;-.86,-4.5,;-2.32,-4.02,;-.38,-5.96,;1.16,-5.96,;1.64,-4.5,;3.1,-4.02,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2CC3(C2)CCOCC3)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.28,1.8,;-8.95,1.03,;-7.61,1.8,;-6.28,1.03,;-6.28,-.51,;-4.94,1.8,;-3.61,1.03,;-2.28,1.8,;-2.28,3.34,;-.94,4.11,;.39,3.34,;1.72,4.11,;.39,1.8,;-.94,1.03,;1.72,1.03,;3.06,1.8,;4.39,1.03,;5.73,1.8,;7.21,1.4,;7.61,2.88,;6.12,3.28,;8.95,2.11,;10.28,2.88,;10.28,4.42,;8.95,5.19,;7.61,4.42,;4.39,-.51,;5.73,-1.28,;3.06,-1.28,;1.72,-.51,;3.06,-2.82,;1.81,-3.73,;.35,-3.25,;2.29,-5.19,;3.83,-5.19,;4.3,-3.73,;5.77,-3.25,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2CC3(C2)CCOCC3)c(Cl)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.28,1.8,;-8.95,1.03,;-7.61,1.8,;-6.28,1.03,;-6.28,-.51,;-4.94,1.8,;-3.61,1.03,;-2.28,1.8,;-2.28,3.34,;-.94,4.11,;.39,3.34,;1.72,4.11,;.39,1.8,;-.94,1.03,;1.72,1.03,;3.06,1.8,;4.39,1.03,;5.73,1.8,;7.21,1.4,;7.61,2.88,;6.12,3.28,;8.95,2.11,;10.28,2.88,;10.28,4.42,;8.95,5.19,;7.61,4.42,;4.39,-.51,;5.73,-1.28,;3.06,-1.28,;1.72,-.51,;3.06,-2.82,;1.81,-3.73,;.35,-3.25,;2.29,-5.19,;3.83,-5.19,;4.3,-3.73,;5.77,-3.25,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3cc(Cl)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.15,1.9,;-9.81,1.13,;-8.48,1.9,;-7.14,1.13,;-7.14,-.41,;-5.81,1.9,;-4.48,1.13,;-3.14,1.9,;-3.14,3.44,;-1.81,4.21,;-.48,3.44,;.86,4.21,;-.48,1.9,;-1.81,1.13,;.86,1.13,;2.19,1.9,;3.52,1.13,;4.86,1.9,;6.27,1.28,;7.3,2.42,;8.84,2.42,;9.61,3.75,;11.15,3.75,;8.84,5.09,;7.3,5.09,;6.53,3.75,;5.02,3.43,;3.52,-.41,;4.86,-1.18,;2.19,-1.18,;.86,-.41,;2.19,-2.72,;3.44,-3.62,;4.92,-3.22,;2.96,-5.09,;1.42,-5.09,;.95,-3.62,;-.54,-3.22,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3cc(F)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.15,1.9,;-9.81,1.13,;-8.48,1.9,;-7.14,1.13,;-7.14,-.41,;-5.81,1.9,;-4.48,1.13,;-3.14,1.9,;-3.14,3.44,;-1.81,4.21,;-.48,3.44,;.86,4.21,;-.48,1.9,;-1.81,1.13,;.86,1.13,;2.19,1.9,;3.52,1.13,;4.86,1.9,;6.27,1.28,;7.3,2.42,;8.84,2.42,;9.61,3.75,;11.15,3.75,;8.84,5.09,;7.3,5.09,;6.53,3.75,;5.02,3.43,;3.52,-.41,;4.86,-1.18,;2.19,-1.18,;.86,-.41,;2.19,-2.72,;3.44,-3.62,;4.92,-3.22,;2.96,-5.09,;1.42,-5.09,;.95,-3.62,;-.54,-3.22,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3cc(OC)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.53,1.9,;-10.2,1.13,;-8.86,1.9,;-7.53,1.13,;-7.53,-.41,;-6.2,1.9,;-4.86,1.13,;-3.53,1.9,;-3.53,3.44,;-2.2,4.21,;-.86,3.44,;.47,4.21,;-.86,1.9,;-2.2,1.13,;.47,1.13,;1.81,1.9,;3.14,1.13,;4.47,1.9,;5.88,1.28,;6.91,2.42,;8.45,2.42,;9.22,3.75,;10.76,3.75,;11.53,2.42,;8.45,5.09,;6.91,5.09,;6.14,3.75,;4.63,3.43,;3.14,-.41,;4.47,-1.18,;1.81,-1.18,;.47,-.41,;1.81,-2.72,;.56,-3.62,;-.9,-3.15,;1.04,-5.09,;2.58,-5.09,;3.05,-3.62,;4.52,-3.15,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3cccc(F)c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;10.38,1.09,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.67,-3.15,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.25,-3.15,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3cccnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.54,-2.85,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.38,-2.85,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3cncnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.67,-3.15,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.25,-3.15,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3cnn(C)c3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.55,2,;-9.21,1.23,;-7.88,2,;-6.55,1.23,;-6.55,-.31,;-5.21,2,;-3.88,1.23,;-2.54,2,;-2.54,3.54,;-1.21,4.31,;.12,3.54,;1.46,4.31,;.12,2,;-1.21,1.23,;1.46,1.23,;2.79,2,;4.12,1.23,;5.46,2,;5.62,3.53,;7.13,3.85,;8.16,4.99,;9.56,4.37,;9.4,2.84,;10.55,1.8,;7.9,2.51,;6.86,1.37,;4.12,-.31,;5.46,-1.08,;2.79,-1.08,;1.46,-.31,;2.79,-2.62,;4.04,-3.53,;5.5,-3.05,;3.56,-4.99,;2.02,-4.99,;1.54,-3.53,;.08,-3.05,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3nccnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;7.04,1.28,;8.07,2.42,;9.61,2.42,;10.38,3.75,;9.61,5.09,;8.07,5.09,;7.3,3.75,;5.79,3.43,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.67,-3.15,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.25,-3.15,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3nccnc3C2)c(Cl)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;7.04,1.28,;8.07,2.42,;9.61,2.42,;10.38,3.75,;9.61,5.09,;8.07,5.09,;7.3,3.75,;5.79,3.43,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.67,-3.15,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.25,-3.15,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;6.67,2.34,;8,1.57,;8,.03,;6.67,-.74,;5.33,.03,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N[C@H]2CCN(C[C@H]2F)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,18.18,23.25,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;6.67,3.88,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N[C@H]2CCN(C[C@H]2F)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,18.18,23.25,(-11.44,2.34,;-10.11,1.57,;-8.77,2.34,;-7.44,1.57,;-7.44,.03,;-6.1,2.34,;-4.77,1.57,;-3.44,2.34,;-3.44,3.88,;-2.1,4.65,;-.77,3.88,;.56,4.65,;-.77,2.34,;-2.1,1.57,;.56,1.57,;1.9,2.34,;3.23,1.57,;4.56,2.34,;5.9,1.57,;5.9,.03,;7.23,-.74,;8.57,.03,;8.57,1.57,;7.23,2.34,;7.23,3.88,;9.9,-.74,;10.67,-2.07,;11.44,-.74,;3.23,.03,;4.56,-.74,;1.9,-.74,;.56,.03,;1.9,-2.28,;3.14,-3.19,;4.61,-2.71,;2.67,-4.65,;1.13,-4.65,;.65,-3.19,;-.81,-2.71,)|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CC2(C1)CCOCC2 |r|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1Cc2cnn(C)c2C1 |r|
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1Cc2nccnc2C1 |r|
CNC[C@@H](O)COc1ccc(c(c1)-c1nc(N2Cc3cncnc3C2)c(C)c(n1)-c1c(C)noc1C)C(F)(F)F |r,wD:3.3,(-10.38,1.57,;-9.04,.8,;-7.71,1.57,;-6.37,.8,;-6.37,-.74,;-5.04,1.57,;-3.71,.8,;-2.37,1.57,;-2.37,3.11,;-1.04,3.88,;.29,3.11,;.29,1.57,;-1.04,.8,;1.63,.8,;2.96,1.57,;4.29,.8,;5.63,1.57,;5.79,3.1,;7.3,3.42,;8.07,4.76,;9.61,4.76,;10.38,3.42,;9.61,2.09,;8.07,2.09,;7.04,.94,;4.29,-.74,;5.63,-1.51,;2.96,-1.51,;1.63,-.74,;2.96,-3.05,;4.21,-3.96,;5.67,-3.48,;3.73,-5.42,;2.19,-5.42,;1.72,-3.96,;.25,-3.48,;1.63,3.88,;2.96,3.11,;1.63,5.42,;2.96,4.65,)|
CNC[C@@H](O)COc1ccc(c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C)C(F)(F)F |r,wD:3.3,(-12,1.57,;-10.67,.8,;-9.34,1.57,;-8,.8,;-8,-.74,;-6.67,1.57,;-5.33,.8,;-4,1.57,;-4,3.11,;-2.67,3.88,;-1.33,3.11,;-1.33,1.57,;-2.67,.8,;,.8,;1.33,1.57,;2.67,.8,;4,1.57,;5.33,.8,;5.33,-.74,;6.67,-1.51,;8,-.74,;8,.8,;6.67,1.57,;9.34,-1.51,;9.34,-3.05,;10.67,-.74,;12,-1.51,;2.67,-.74,;4,-1.51,;1.33,-1.51,;,-.74,;1.33,-3.05,;2.58,-3.96,;4.07,-3.56,;2.1,-5.42,;.56,-5.42,;.09,-3.96,;-1.4,-3.56,;,3.88,;1.33,3.11,;,5.42,;1.33,4.65,)|
CNC[C@@H](O)COc1ccc(c(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C)C(F)(F)F |r,wD:3.3,(-10,1.57,;-8.67,.8,;-7.34,1.57,;-6,.8,;-6,-.74,;-4.67,1.57,;-3.33,.8,;-2,1.57,;-2,3.11,;-.67,3.88,;.67,3.11,;.67,1.57,;-.67,.8,;2,.8,;3.33,1.57,;4.67,.8,;6,1.57,;7.34,.8,;7.34,-.74,;8.67,-1.51,;10,-.74,;10,.8,;8.67,1.57,;4.67,-.74,;6,-1.51,;3.33,-1.51,;2,-.74,;3.33,-3.05,;4.58,-3.96,;6.07,-3.56,;4.1,-5.42,;2.56,-5.42,;2.09,-3.96,;.6,-3.56,;2,3.88,;3.33,3.11,;2,5.42,;3.33,4.65,)|
CNC[C@@H](O)COc1cccc(c1)-c1nc(-c2cn(c3ncncc23)S(C)(=O)=O)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.21,1.2,;-8.88,.43,;-7.54,1.2,;-6.21,.43,;-6.21,-1.11,;-4.88,1.2,;-3.54,.43,;-2.21,1.2,;-2.21,2.74,;-.88,3.51,;.46,2.74,;.46,1.2,;-.88,.43,;1.79,.43,;3.12,1.2,;4.46,.43,;5.79,1.2,;5.95,2.73,;7.46,3.05,;8.23,1.72,;9.74,1.4,;10.21,-.07,;9.18,-1.21,;7.67,-.89,;7.2,.57,;8.09,4.46,;8.86,5.79,;6.71,5.16,;9.46,3.76,;4.46,-1.11,;5.79,-1.88,;3.12,-1.88,;1.79,-1.11,;3.12,-3.42,;1.88,-4.33,;.41,-3.85,;2.35,-5.79,;3.89,-5.79,;4.37,-4.33,;5.84,-3.85,)|
CNC[C@@H](O)COc1cccc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1c[nH]c2ncncc12 |r|
CNC[C@@H](O)COc1cccc(c1)-c1nc(N(C)C2CCOCC2)c(C)c(n1)-c1cn(c2ncncc12)S(C)(=O)=O |r|
CNC[C@@H](O)COc1cccc(c1)-c1nc(NC2CCN(C(C)C2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;9.34,2.34,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNC[C@@H](O)COc1cccc(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNC[C@@H](O)COc1cccc(c1)-c1nc(NC2CCN(CC2)C(=O)OC)cc(n1)-c1c(C)nnn1C |r|
CNC[C@@H](O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNC[C@@H](O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1c(C)noc1C |r|
CNC[C@@H](O)COc1cccc(c1)-c1nc(NCC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;9.34,1.57,;10.67,2.34,;10.67,3.88,;9.34,4.65,;8,3.88,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.38,-2.71,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,)|
CNC[C@@H](O)COc1cccc(c1)-c1nc(NCC2CCOCC2)cc(n1)-c1cn(c2ncncc12)S(C)(=O)=O |r|
CNC[C@@H](O)COc1cccc(c1)-c1nc(N[C@@H]2CCN(C[C@@H]2F)C2CC2)c(Cl)c(n1)-c1c(C)noc1C |r,wU:17.17,22.24,wD:3.3,(-11.44,2.34,;-10.11,1.57,;-8.77,2.34,;-7.44,1.57,;-7.44,.03,;-6.1,2.34,;-4.77,1.57,;-3.44,2.34,;-3.44,3.88,;-2.1,4.65,;-.77,3.88,;-.77,2.34,;-2.1,1.57,;.56,1.57,;1.9,2.34,;3.23,1.57,;4.56,2.34,;5.9,1.57,;5.9,.03,;7.23,-.74,;8.57,.03,;8.57,1.57,;7.23,2.34,;7.23,3.88,;9.9,-.74,;10.67,-2.07,;11.44,-.74,;3.23,.03,;4.56,-.74,;1.9,-.74,;.56,.03,;1.9,-2.28,;3.14,-3.19,;4.63,-2.79,;2.67,-4.65,;1.13,-4.65,;.65,-3.19,;-.84,-2.79,)|
CNC[C@@H](O)COc1cccc(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1cn(c2ncncc12)S(C)(=O)=O |r|
CNC[C@@H](O)COc1cccc(c1)-c1nc(cc(n1)-c1c[nH]c2ncncc12)N(C)C1CCOCC1 |r|
CNC[C@@H](O)COc1cccc(c1)-c1nc(cc(n1)-c1cn(c2ncncc12)S(C)(=O)=O)N(C)C1CCOCC1 |r|
CNC[C@@H](O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2cnccn12)N(C)C1CCOCC1 |r|
CNC[C@@H](O)COc1cccc(c1)-c1nc(cc(n1)N1CC2(CCNCC2)c2ccccc12)N(C)C1CCOCC1 |r|
CNC[C@H](O)CN1CCc2c(C1)cccc2OCc1ccc(cc1)-c1nccs1 |r|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N(C)[C@H]2C[C@](C)(C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,21.22,wD:19.19,21.25,(-10.77,2.34,;-9.43,1.57,;-8.1,2.34,;-6.77,1.57,;-6.77,.03,;-5.43,2.34,;-4.1,1.57,;-2.76,2.34,;-2.76,3.88,;-1.43,4.65,;-.1,3.88,;1.24,4.65,;-.1,2.34,;-1.43,1.57,;1.24,1.57,;2.57,2.34,;3.9,1.57,;5.24,2.34,;5.24,3.88,;6.57,1.57,;6.97,.08,;8.46,.48,;9.23,-.85,;8.06,1.97,;10,.48,;10.77,-.85,;3.9,.03,;5.24,-.74,;2.57,-.74,;1.24,.03,;2.57,-2.28,;1.32,-3.19,;-.14,-2.71,;1.8,-4.65,;3.34,-4.65,;3.82,-3.19,;5.28,-2.71,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CC3(C2)CCN(CC3)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-11.72,1.13,;-10.38,.36,;-9.05,1.13,;-7.71,.36,;-7.71,-1.18,;-6.38,1.13,;-5.05,.36,;-3.71,1.13,;-3.71,2.67,;-2.38,3.44,;-1.05,2.67,;.29,3.44,;-1.05,1.13,;-2.38,.36,;.29,.36,;1.62,1.13,;2.95,.36,;4.29,1.13,;5.78,.73,;6.17,2.22,;4.69,2.62,;7.51,1.45,;8.84,2.22,;8.84,3.76,;7.51,4.53,;6.17,3.76,;10.18,4.53,;11.72,4.53,;10.95,5.86,;2.95,-1.18,;4.29,-1.95,;1.62,-1.95,;.29,-1.18,;1.62,-3.49,;.38,-4.4,;-1.11,-4,;.85,-5.86,;2.39,-5.86,;2.87,-4.4,;4.35,-4,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CCN(C3)C3CC3)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-11.81,1.67,;-10.47,.9,;-9.14,1.67,;-7.81,.9,;-7.81,-.64,;-6.47,1.67,;-5.14,.9,;-3.81,1.67,;-3.81,3.21,;-2.47,3.98,;-1.14,3.21,;.19,3.98,;-1.14,1.67,;-2.47,.9,;.19,.9,;1.53,1.67,;2.86,.9,;4.2,1.67,;4.2,3.21,;5.66,3.69,;6.57,2.44,;7.47,1.2,;8.93,1.67,;8.93,3.21,;7.47,3.69,;10.27,3.98,;11.81,3.98,;11.04,5.32,;5.66,1.2,;2.86,-.64,;4.2,-1.41,;1.53,-1.41,;.19,-.64,;1.53,-2.95,;2.77,-3.85,;4.11,-3.08,;2.3,-5.32,;.76,-5.32,;.28,-3.85,;-1.05,-3.08,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CN(C3)C(=O)OC)CC2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-12.28,1.03,;-10.95,.26,;-9.61,1.03,;-8.28,.26,;-8.28,-1.28,;-6.94,1.03,;-5.61,.26,;-4.28,1.03,;-4.28,2.57,;-2.94,3.34,;-1.61,2.57,;-.28,3.34,;-1.61,1.03,;-2.94,.26,;-.28,.26,;1.06,1.03,;2.39,.26,;3.72,1.03,;5.06,.26,;6.39,1.03,;6.39,2.57,;7.88,2.17,;8.28,3.65,;6.79,4.05,;9.61,4.42,;9.61,5.96,;10.95,3.65,;12.28,4.42,;5.06,3.34,;3.72,2.57,;2.39,-1.28,;3.72,-2.05,;1.06,-2.05,;-.28,-1.28,;1.06,-3.59,;2.3,-4.5,;3.77,-4.02,;1.83,-5.96,;.29,-5.96,;-.19,-4.5,;-1.65,-4.02,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CN(C3)S(C)(=O)=O)CC2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-11.61,1.13,;-10.28,.36,;-8.95,1.13,;-7.61,.36,;-7.61,-1.18,;-6.28,1.13,;-4.94,.36,;-3.61,1.13,;-3.61,2.67,;-2.28,3.44,;-.94,2.67,;.39,3.44,;-.94,1.13,;-2.28,.36,;.39,.36,;1.72,1.13,;3.06,.36,;4.39,1.13,;5.73,.36,;7.06,1.13,;7.06,2.67,;8.55,2.27,;8.95,3.76,;7.46,4.16,;10.28,4.53,;11.61,5.3,;9.51,5.86,;11.05,3.19,;5.73,3.44,;4.39,2.67,;3.06,-1.18,;4.39,-1.95,;1.72,-1.95,;.39,-1.18,;1.72,-3.49,;2.97,-4.4,;4.46,-4,;2.49,-5.86,;.95,-5.86,;.48,-4.4,;-1.01,-4,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCN(C)C(C2)C(F)F)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;5.33,3.88,;6.67,4.65,;8,3.88,;9.34,4.65,;8,2.34,;6.67,1.57,;9.34,1.57,;10.67,2.34,;9.34,.03,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.4,-2.79,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.07,-2.79,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cc(Cl)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-11.15,1.9,;-9.81,1.13,;-8.48,1.9,;-7.14,1.13,;-7.14,-.41,;-5.81,1.9,;-4.48,1.13,;-3.14,1.9,;-3.14,3.44,;-1.81,4.21,;-.48,3.44,;.86,4.21,;-.48,1.9,;-1.81,1.13,;.86,1.13,;2.19,1.9,;3.52,1.13,;4.86,1.9,;6.27,1.28,;7.3,2.42,;8.84,2.42,;9.61,3.75,;11.15,3.75,;8.84,5.09,;7.3,5.09,;6.53,3.75,;5.02,3.43,;3.52,-.41,;4.86,-1.18,;2.19,-1.18,;.86,-.41,;2.19,-2.72,;3.44,-3.62,;4.9,-3.15,;2.96,-5.09,;1.42,-5.09,;.95,-3.62,;-.52,-3.15,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cc(F)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-11.15,1.9,;-9.81,1.13,;-8.48,1.9,;-7.14,1.13,;-7.14,-.41,;-5.81,1.9,;-4.48,1.13,;-3.14,1.9,;-3.14,3.44,;-1.81,4.21,;-.48,3.44,;.86,4.21,;-.48,1.9,;-1.81,1.13,;.86,1.13,;2.19,1.9,;3.52,1.13,;4.86,1.9,;6.27,1.28,;7.3,2.42,;8.84,2.42,;9.61,3.75,;11.15,3.75,;8.84,5.09,;7.3,5.09,;6.53,3.75,;5.02,3.43,;3.52,-.41,;4.86,-1.18,;2.19,-1.18,;.86,-.41,;2.19,-2.72,;3.44,-3.62,;4.9,-3.15,;2.96,-5.09,;1.42,-5.09,;.95,-3.62,;-.52,-3.15,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cccnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.67,-3.15,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.25,-3.15,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3ccncc3C2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.67,-3.15,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.25,-3.15,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cn(nc3C2)C(C)C)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-11.39,1.16,;-10.05,.39,;-8.72,1.16,;-7.39,.39,;-7.39,-1.15,;-6.05,1.16,;-4.72,.39,;-3.39,1.16,;-3.39,2.7,;-2.05,3.47,;-.72,2.7,;.62,3.47,;-.72,1.16,;-2.05,.39,;.62,.39,;1.95,1.16,;3.28,.39,;4.62,1.16,;6.02,.53,;7.05,1.67,;8.56,1.99,;8.72,3.52,;7.31,4.15,;6.28,3.01,;4.78,2.69,;10.05,4.29,;11.39,3.52,;10.05,5.83,;3.28,-1.15,;4.62,-1.92,;1.95,-1.92,;.62,-1.15,;1.95,-3.46,;3.19,-4.37,;4.66,-3.89,;2.72,-5.83,;1.18,-5.83,;.7,-4.37,;-.76,-3.89,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(Cl)c(n1)-c1c(C)noc1C |r,wU:3.3,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(NCC2COCCO2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;8,3.88,;9.34,4.65,;10.67,3.88,;10.67,2.34,;9.34,1.57,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.04,-2.71,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.38,-2.71,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(NCCC(C)(C)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;6,1.57,;7.34,2.34,;8.67,1.57,;7.9,.24,;9.44,.24,;10,2.34,;11.34,1.57,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;3.25,-3.19,;4.73,-2.79,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.73,-2.79,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(NC[C@H]2COCCN2C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,19.19,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;8,2.34,;8,3.88,;9.34,4.65,;10.67,3.88,;10.67,2.34,;9.34,1.57,;9.34,.03,;8,-.74,;10.67,-.74,;10.67,-2.28,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;1.42,-3.19,;-.07,-2.79,;1.9,-4.65,;3.44,-4.65,;3.91,-3.19,;5.4,-2.79,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@@H]2CCN([C@@H](C)C2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,18.18,wD:22.23,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;9.34,2.34,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@@H]2CCOC2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,18.18,(-9.89,2.34,;-8.55,1.57,;-7.22,2.34,;-5.89,1.57,;-5.89,.03,;-4.55,2.34,;-3.22,1.57,;-1.89,2.34,;-1.89,3.88,;-.55,4.65,;.78,3.88,;2.12,4.65,;.78,2.34,;-.55,1.57,;2.12,1.57,;3.45,2.34,;4.78,1.57,;6.12,2.34,;7.45,1.57,;7.61,.04,;9.12,-.28,;9.89,1.05,;8.86,2.2,;4.78,.03,;6.12,-.74,;3.45,-.74,;2.12,.03,;3.45,-2.28,;4.7,-3.19,;6.16,-2.71,;4.22,-4.65,;2.68,-4.65,;2.2,-3.19,;.74,-2.71,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CCN(C[C@H]2F)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,wD:18.18,23.25,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;6.67,3.88,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CCN(C[C@H]2F)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,wD:18.18,23.25,(-11.44,2.34,;-10.11,1.57,;-8.77,2.34,;-7.44,1.57,;-7.44,.03,;-6.1,2.34,;-4.77,1.57,;-3.44,2.34,;-3.44,3.88,;-2.1,4.65,;-.77,3.88,;.56,4.65,;-.77,2.34,;-2.1,1.57,;.56,1.57,;1.9,2.34,;3.23,1.57,;4.56,2.34,;5.9,1.57,;5.9,.03,;7.23,-.74,;8.57,.03,;8.57,1.57,;7.23,2.34,;7.23,3.88,;9.9,-.74,;10.67,-2.07,;11.44,-.74,;3.23,.03,;4.56,-.74,;1.9,-.74,;.56,.03,;1.9,-2.28,;3.14,-3.19,;4.63,-2.79,;2.67,-4.65,;1.13,-4.65,;.65,-3.19,;-.84,-2.79,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2CCN([C@H](C)C2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,22.23,wD:18.18,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;9.34,2.34,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2C[C@@H](C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,18.18,wD:20.23,(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;1.72,4.65,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;8.55,1.97,;8.95,.48,;7.46,.08,;10.28,-.29,;10.28,-1.83,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;1.81,-3.19,;.32,-2.79,;2.29,-4.65,;3.83,-4.65,;4.3,-3.19,;5.79,-2.79,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(N[C@H]2C[C@H](C2)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,18.18,20.23,(-10.28,2.34,;-8.95,1.57,;-7.61,2.34,;-6.28,1.57,;-6.28,.03,;-4.94,2.34,;-3.61,1.57,;-2.28,2.34,;-2.28,3.88,;-.94,4.65,;.39,3.88,;1.72,4.65,;.39,2.34,;-.94,1.57,;1.72,1.57,;3.06,2.34,;4.39,1.57,;5.73,2.34,;7.06,1.57,;8.55,1.97,;8.95,.48,;7.46,.08,;10.28,-.29,;10.28,-1.83,;4.39,.03,;5.73,-.74,;3.06,-.74,;1.72,.03,;3.06,-2.28,;1.81,-3.19,;.32,-2.79,;2.29,-4.65,;3.83,-4.65,;4.3,-3.19,;5.79,-2.79,)|
CNC[C@H](O)COc1ccc(Cl)c(c1)-c1nc(cc(n1)-c1c(C)noc1C)N1CC2(C1)CCN(CC2)C1CC1 |r|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(-c2c(C)noc2C)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-9.22,2.18,;-7.89,1.41,;-6.55,2.18,;-5.22,1.41,;-5.22,-.13,;-3.89,2.18,;-2.55,1.41,;-1.22,2.18,;-1.22,3.72,;.11,4.49,;1.45,3.72,;2.78,4.49,;1.45,2.18,;.11,1.41,;2.78,1.41,;2.78,-.13,;4.12,-.9,;4.12,-2.44,;5.36,-3.34,;6.85,-2.94,;4.89,-4.81,;3.35,-4.81,;2.87,-3.34,;1.38,-2.94,;5.45,-.13,;6.78,-.9,;5.45,1.41,;4.12,2.18,;6.78,2.18,;6.94,3.72,;5.86,4.81,;8.45,4.04,;9.22,2.7,;8.19,1.56,;8.59,.07,)|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(N2CCC3(CCN(C3)C(=O)OC)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-12.44,1.82,;-11.11,1.05,;-9.77,1.82,;-8.44,1.05,;-8.44,-.49,;-7.11,1.82,;-5.77,1.05,;-4.44,1.82,;-4.44,3.36,;-3.1,4.13,;-1.77,3.36,;-.44,4.13,;-1.77,1.82,;-3.1,1.05,;-.44,1.05,;.9,1.82,;2.23,1.05,;3.56,1.82,;3.73,3.35,;5.23,3.67,;6,2.34,;6.77,1.01,;8.28,1.33,;8.44,2.86,;7.03,3.48,;9.77,3.63,;9.77,5.17,;11.11,2.86,;12.44,3.63,;4.97,1.2,;2.23,-.49,;3.56,-1.26,;.9,-1.26,;-.44,-.49,;.9,-2.8,;2.14,-3.7,;3.61,-3.23,;1.67,-5.17,;.13,-5.17,;-.35,-3.7,;-1.81,-3.23,)|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(N2CCC3(CN(C3)C(=O)OC)CC2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-12.28,1.03,;-10.95,.26,;-9.61,1.03,;-8.28,.26,;-8.28,-1.28,;-6.94,1.03,;-5.61,.26,;-4.28,1.03,;-4.28,2.57,;-2.94,3.34,;-1.61,2.57,;-.28,3.34,;-1.61,1.03,;-2.94,.26,;-.28,.26,;1.06,1.03,;2.39,.26,;3.72,1.03,;5.06,.26,;6.39,1.03,;6.39,2.57,;7.88,2.17,;8.28,3.65,;6.79,4.05,;9.61,4.42,;9.61,5.96,;10.95,3.65,;12.28,4.42,;5.06,3.34,;3.72,2.57,;2.39,-1.28,;3.72,-2.05,;1.06,-2.05,;-.28,-1.28,;1.06,-3.59,;2.3,-4.5,;3.77,-4.02,;1.83,-5.96,;.29,-5.96,;-.19,-4.5,;-1.65,-4.02,)|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(N2CCC3(CN(C3)S(C)(=O)=O)CC2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-11.61,1.13,;-10.28,.36,;-8.95,1.13,;-7.61,.36,;-7.61,-1.18,;-6.28,1.13,;-4.94,.36,;-3.61,1.13,;-3.61,2.67,;-2.28,3.44,;-.94,2.67,;.39,3.44,;-.94,1.13,;-2.28,.36,;.39,.36,;1.72,1.13,;3.06,.36,;4.39,1.13,;5.73,.36,;7.06,1.13,;7.06,2.67,;8.55,2.27,;8.95,3.76,;7.46,4.16,;10.28,4.53,;11.61,5.3,;9.51,5.86,;11.05,3.19,;5.73,3.44,;4.39,2.67,;3.06,-1.18,;4.39,-1.95,;1.72,-1.95,;.39,-1.18,;1.72,-3.49,;2.97,-4.4,;4.46,-4,;2.49,-5.86,;.95,-5.86,;.48,-4.4,;-1.01,-4,)|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3cccnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;5.79,3.43,;7.3,3.75,;8.07,5.09,;9.61,5.09,;10.38,3.75,;9.61,2.42,;8.07,2.42,;7.04,1.28,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.67,-3.15,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.25,-3.15,)|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;6.67,2.34,;8,1.57,;8,.03,;6.67,-.74,;5.33,.03,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(NC2CCOC(C)C2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-10.67,2.34,;-9.34,1.57,;-8,2.34,;-6.67,1.57,;-6.67,.03,;-5.33,2.34,;-4,1.57,;-2.67,2.34,;-2.67,3.88,;-1.33,4.65,;,3.88,;1.33,4.65,;,2.34,;-1.33,1.57,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,-.74,;9.34,.03,;9.34,1.57,;10.67,2.34,;8,2.34,;4,.03,;5.33,-.74,;2.67,-.74,;1.33,.03,;2.67,-2.28,;3.91,-3.19,;5.4,-2.79,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.07,-2.79,)|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;2,4.65,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.07,-2.79,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.6,-2.79,)|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(NCCC(C)(C)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-11.34,2.34,;-10,1.57,;-8.67,2.34,;-7.34,1.57,;-7.34,.03,;-6,2.34,;-4.67,1.57,;-3.33,2.34,;-3.33,3.88,;-2,4.65,;-.67,3.88,;.67,4.65,;-.67,2.34,;-2,1.57,;.67,1.57,;2,2.34,;3.33,1.57,;4.67,2.34,;6,1.57,;7.34,2.34,;8.67,1.57,;7.9,.24,;9.44,.24,;10,2.34,;11.34,1.57,;3.33,.03,;4.67,-.74,;2,-.74,;.67,.03,;2,-2.28,;3.25,-3.19,;4.71,-2.71,;2.77,-4.65,;1.23,-4.65,;.75,-3.19,;-.71,-2.71,)|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(N[C@H]2CCN(C[C@H]2F)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,wD:18.18,23.25,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;6.67,3.88,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNC[C@H](O)COc1ccc(F)c(c1)-c1nc(N[C@H]2CCN(C[C@H]2F)C2CC2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,wD:18.18,23.25,(-11.44,2.34,;-10.11,1.57,;-8.77,2.34,;-7.44,1.57,;-7.44,.03,;-6.1,2.34,;-4.77,1.57,;-3.44,2.34,;-3.44,3.88,;-2.1,4.65,;-.77,3.88,;.56,4.65,;-.77,2.34,;-2.1,1.57,;.56,1.57,;1.9,2.34,;3.23,1.57,;4.56,2.34,;5.9,1.57,;5.9,.03,;7.23,-.74,;8.57,.03,;8.57,1.57,;7.23,2.34,;7.23,3.88,;9.9,-.74,;10.67,-2.07,;11.44,-.74,;3.23,.03,;4.56,-.74,;1.9,-.74,;.56,.03,;1.9,-2.28,;3.14,-3.19,;4.61,-2.71,;2.67,-4.65,;1.13,-4.65,;.65,-3.19,;-.81,-2.71,)|
CNC[C@H](O)COc1cccc(c1)-c1nc(NC2CCN(C(C)C2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;9.34,2.34,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.07,-2.79,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.4,-2.79,)|
CNC[C@H](O)COc1cccc(c1)-c1nc(NC2CCN(CC2)C(=O)OC)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-12,2.34,;-10.67,1.57,;-9.34,2.34,;-8,1.57,;-8,.03,;-6.67,2.34,;-5.33,1.57,;-4,2.34,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;-1.33,2.34,;-2.67,1.57,;,1.57,;1.33,2.34,;2.67,1.57,;4,2.34,;5.33,1.57,;5.33,.03,;6.67,-.74,;8,.03,;8,1.57,;6.67,2.34,;9.34,-.74,;9.34,-2.28,;10.67,.03,;12,-.74,;2.67,.03,;4,-.74,;1.33,-.74,;,.03,;1.33,-2.28,;2.58,-3.19,;4.04,-2.71,;2.1,-4.65,;.56,-4.65,;.09,-3.19,;-1.38,-2.71,)|
CNC[C@H](O)COc1cccc(c1)-c1nc(NC2CCOCC2)c(C)c(n1)-c1c(C)noc1C |r,wU:3.3,(-10,2.34,;-8.67,1.57,;-7.34,2.34,;-6,1.57,;-6,.03,;-4.67,2.34,;-3.33,1.57,;-2,2.34,;-2,3.88,;-.67,4.65,;.67,3.88,;.67,2.34,;-.67,1.57,;2,1.57,;3.33,2.34,;4.67,1.57,;6,2.34,;7.34,1.57,;7.34,.03,;8.67,-.74,;10,.03,;10,1.57,;8.67,2.34,;4.67,.03,;6,-.74,;3.33,-.74,;2,.03,;3.33,-2.28,;4.58,-3.19,;6.04,-2.71,;4.1,-4.65,;2.56,-4.65,;2.09,-3.19,;.62,-2.71,)|
CNC[C@H](O)COc1cccc(c1)-c1nc(NC2CCOCC2)cc(n1)-c1c(C)noc1C |r|
CNC[C@H](O)COc1cccc(c1)-c1nc(cc(n1)-c1cnc2cnccn12)N(C)C1CCOCC1 |r|
CN[C@@H](C)CN1CCC(CC1)c1cc(C)c2nc([nH]c2c1)-c1cccnc1OC |r|
CN[C@H](C)CN1CCC(CC1)c1cc(C)c2nc([nH]c2c1)-c1cccnc1OC |r|
CNc1ncnc2n(cnc12)[C@@H]1O[C@H](CN(CCCNC(=O)Nc2ccc(cc2)C(C)(C)C)C(C)C)[C@@H](O)[C@H]1O |r|
CNc1ncnc2n(cnc12)[C@@H]1O[C@H](CN(CCI)CCC[C@H](N)C(O)=O)[C@@H](O)[C@H]1O |r|
CNc1ncnc2n(cnc12)[C@@H]1O[C@H](CSCC[C@H](N)C(O)=O)[C@@H](O)[C@H]1O |r|
COC(=O)N1CC[C@@H](C[C@@H]1C)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CN(C)C)ccc1Cl |r,wD:31.34,7.11,9.10,(12,-.74,;10.67,.03,;9.34,-.74,;9.34,-2.28,;8,.03,;6.67,-.74,;5.33,.03,;5.33,1.57,;6.67,2.34,;8,1.57,;9.34,2.34,;4,2.34,;2.67,1.57,;1.33,2.34,;,1.57,;,.03,;1.33,-.74,;1.33,-2.28,;.09,-3.19,;-1.4,-2.79,;.56,-4.65,;2.1,-4.65,;2.58,-3.19,;4.07,-2.79,;2.67,.03,;4,-.74,;-1.33,2.34,;-2.67,1.57,;-4,2.34,;-5.33,1.57,;-6.67,2.34,;-8,1.57,;-8,.03,;-9.34,2.34,;-10.67,1.57,;-12,2.34,;-10.67,.03,;-4,3.88,;-2.67,4.65,;-1.33,3.88,;,4.65,)|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCCCCNC(=N)NC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCCNC(=N)NC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCNC(=N)NCCC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCNC(=N)NCC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCNC(=N)NC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCNC(=N)NC\C=C\[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCNC(=N)NC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2ccc(NC(=O)NCCCCCCNC(=N)NC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)cc2c1 |r|
COC(=O)c1ccccc1CNC(=O)c1cc(nn1-c1csc(CNC(=O)[C@H](C)N)c1)C(F)(F)F |r|
COC(=O)c1ccccc1NC(=O)CSc1nc2cc(OC)ccc2[nH]1
COc1ccc(CCNC(=O)[C@@H](N)CC[C@@H](C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)NCc2ccccc2)cc1 |r|
COc1ccc(CCNC(=O)[C@@H](N)CC[C@H](CNCc2ccccc2)C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cc1 |r|
COc1ccc(cc1C)-c1csc(Nc2ccc(O)c(c2)C(O)=O)n1
COc1cccc(CNC(=O)c2cc(nn2-c2csc(CNC(=O)[C@H](C)N)c2)C(F)(F)F)c1 |r|
COc1cccc(c1)-c1nnc(o1)-c1cc(nn1-c1cccc(CNC(=O)[C@H](C)N)c1)C(F)(F)F |r|
COc1ccccc1-c1nnc(o1)-c1cc(nn1-c1cccc(CNC(=O)[C@H](C)N)c1)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1cc(CNC(=O)[C@H](C)N)ccn1)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1ccc(CNC(=O)[C@H](C)N)s1)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc(CCNC(=O)[C@H](C)N)c1)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc(CNC(=O)[C@H](C)N)c1)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc(CNC(=O)[C@H](C)N)n1)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc(CNC(=O)[C@H](C)O)c1)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc(CNC(=S)[C@H](C)N)c1)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc(CNC2CCNC2)c1)C(F)(F)F
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc(CNCCN(C)C)c1)C(F)(F)F
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc(CNCCN)c1)C(F)(F)F
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc(c1)-c1nnc([nH]1)[C@H](C)N)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc(c1)-c1noc(n1)[C@H](C)N)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc2CN(Cc12)C(=O)[C@H](C)N)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1cccc2cc(CNC(=O)[C@H](C)N)oc12)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1csc(CNC(=O)[C@H](C)N)c1)C(F)(F)F |r|
COc1ccccc1CNC(=O)c1cc(nn1-c1nc(CNC(=O)[C@H](C)N)cs1)C(F)(F)F |r|
COc1ccccc1Nc1nnc(o1)-c1cc(nn1-c1cccc(CNC(=O)[C@H](C)N)c1)C(F)(F)F |r|
COc1ncccc1-c1nc2c(C)cc(cc2[nH]1)C1CCNCC1
CS(=O)(=O)c1ccc(cc1)-c1cnc(NCc2ccco2)n2cnnc12
CS(=O)(=O)c1cccc(NC(=O)c2cc(nn2-c2cccc(CNC(=O)CN)c2)C(F)(F)F)c1
CS(=O)(=O)c1ccccc1-c1ccc(NC(=O)c2cc(nn2-c2cccc(CNC(=O)C(N)C(F)(F)F)c2)C(F)(F)F)c(F)c1
CS(=O)(=O)c1ccccc1-c1ccc(NC(=O)c2cc(nn2-c2cccc(CNC(=O)CCN)c2)C(F)(F)F)c(F)c1
CS(=O)(=O)c1ccccc1-c1ccc(NC(=O)c2cc(nn2-c2cccc(CNC(=O)CN)c2)C(F)(F)F)cc1
C[C@@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1-c1nnc(o1)-c1cccc2[nH]ccc12)C(F)(F)F |r|
C[C@@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1C(=O)Nc1ccc(cc1F)-c1ccccc1S(C)(=O)=O)C(F)(F)F |r|
C[C@@H](N)C(=O)NCc1cccnc1Oc1ccc(F)cc1F |r|
C[C@H](N)C(=O)N(C)Cc1cccc(c1)-n1nc(cc1-c1nnc(o1)-c1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cc(cs1)-n1nc(cc1C(=O)NCc1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cc(cs1)-n1nc(cc1C(=O)NCc1ccccc1C)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cc(cs1)-n1nc(cc1C(=O)NCc1ccccc1F)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cc(cs1)-n1nc(cc1C(=O)NCc1ccccn1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1ccc(cc1)-n1nc(cc1C(=O)NCc1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1ccc(s1)-n1nc(cc1C(=O)NCc1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1ccc(s1)-n1nc(cc1C(=O)NCc1ccccc1C(F)(F)F)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1ccc(s1)-n1nc(cc1C(=O)NCc1ccccc1F)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-c1c(cnn1C)-c1nnc(o1)-c1ccccc1 |r|
C[C@H](N)C(=O)NCc1cccc(c1)-c1nn(C)cc1-c1nnc(o1)-c1ccccc1 |r|
C[C@H](N)C(=O)NCc1cccc(c1)-c1ocnc1-c1nnc(o1)-c1ccccc1 |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1cncc1-c1nnc(o1)-c1ccccc1 |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(C)cc1-c1nnc(o1)-c1ccccc1 |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1-c1nc(no1)-c1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1-c1nnc(Cc2ccccc2)o1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1-c1nnc(o1)-c1cccc2[nH]ccc12)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1-c1nnc(o1)-c1cccc2ncsc12)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1-c1nnc(o1)-c1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1-c1nnc(o1)-c1ccccc1Cl)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1-c1nnc(o1)-c1ccncc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1C(=O)N(C)Cc1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1C(=O)NC1CCCCC1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1C(=O)NCCc1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1C(=O)N[C@@H](C)c1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1C(=O)N[C@H](C)c1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1C(=O)Nc1ccc(cc1F)-c1ccccc1S(C)(=O)=O)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1C(=O)Nc1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccc(c1)-n1nc(cc1NC(=O)OCc1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1ccccc1-n1nc(cc1C(=O)NCc1ccccc1)C(F)(F)F |r|
C[C@H](N)C(=O)NCc1cccnc1N(C)Cc1ccccc1 |r|
C[C@H](N)C(=O)NCc1cccnc1Oc1ccc(F)c(F)c1 |r|
C[C@H](N)C(=O)NCc1cccnc1Oc1ccc(F)cc1F |r|
C[C@H](N)CNCc1cccc(c1)-n1nc(cc1-c1nnc(o1)-c1ccccc1)C(F)(F)F |r|
C[C@H](Oc1ccc(cc1)-c1cc2c(ncnc2[nH]1)C1=CCNCC1)c1ccccc1 |r,t:21|
C[C@H]1C[C@H](CCN1C1CC1)Nc1nc(nc(-c2c(C)noc2C)c1C)-c1cc(OC[C@H](O)CN(C)C)ccc1Cl |r,wD:30.34,3.11,1.0,(9.9,2.34,;8.57,1.57,;7.23,2.34,;5.9,1.57,;5.9,.03,;7.23,-.74,;8.57,.03,;9.9,-.74,;10.67,-2.07,;11.44,-.74,;4.56,2.34,;3.23,1.57,;1.9,2.34,;.56,1.57,;.56,.03,;1.9,-.74,;1.9,-2.28,;.65,-3.19,;-.84,-2.79,;1.13,-4.65,;2.67,-4.65,;3.14,-3.19,;4.63,-2.79,;3.23,.03,;4.56,-.74,;-.77,2.34,;-2.1,1.57,;-3.44,2.34,;-4.77,1.57,;-6.1,2.34,;-7.44,1.57,;-7.44,.03,;-8.77,2.34,;-10.11,1.57,;-11.44,2.34,;-10.11,.03,;-3.44,3.88,;-2.1,4.65,;-.77,3.88,;.56,4.65,)|
C[S+](CC[C@@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
Cc1ccc(CN2C\C(=C/c3ccc(O)c(Br)c3)C(=O)\C(C2)=C\c2ccc(O)c(Br)c2)cc1
Cc1cccc(CN2C\C(=C/c3ccc(O)c(Br)c3)C(=O)\C(C2)=C\c2ccc(O)c(Br)c2)c1
Cc1ccccc1CN1C\C(=C/c2ccc(O)c(Br)c2)C(=O)\C(C1)=C\c1ccc(O)c(Br)c1
Cc1noc(C)c1-c1cc(NC2CCOCC2)nc(n1)-c1cccc(OC[C@@H](O)CN)c1 |r|
Cc1noc(C)c1-c1cc(NC2CCOCC2)nc(n1)-c1cccc(OC[C@H](O)CN)c1 |r|
Cc1noc(C)c1-c1nc(nc(NC2CCOCC2)c1C)-c1cccc(OCC(O)CN)c1 |(5.38,-2.71,;3.91,-3.19,;3.44,-4.65,;1.9,-4.65,;1.42,-3.19,;-.04,-2.71,;2.67,-2.28,;2.67,-.74,;1.33,.03,;1.33,1.57,;2.67,2.34,;4,1.57,;5.33,2.34,;6.67,1.57,;6.67,.03,;8,-.74,;9.34,.03,;9.34,1.57,;8,2.34,;4,.03,;5.33,-.74,;,2.34,;,3.88,;-1.33,4.65,;-2.67,3.88,;-2.67,2.34,;-4,1.57,;-5.33,2.34,;-6.67,1.57,;-6.67,.03,;-8,2.34,;-9.34,1.57,;-1.33,1.57,)|
Cl.COc1ccccc1Oc1ccc(CNC(=O)[C@H](C)N)cc1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2cc(C)cc(C)c2)c(C)c1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2cc(Cl)cc(Cl)c2)cc1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2ccc(F)cc2)c(C)c1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2cccc(Cl)c2Cl)cc1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2cccc3ccccc23)cc1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2ccccc2F)c(F)c1 |r|
Cl.Cl.CNCCNCc1ccc(Oc2ccccc2F)c(F)c1
Cl.Nc1cccc2c(cccc12)S(=O)(=O)NCc1ccccc1
NC(=N)c1ccc(Nc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C(N)=N)cc1
NC(=N)c1ccc(Nc2ncnc(Nc3ccc(cc3)C#N)c2[N+]([O-])=O)cc1
NC(=N)c1ccc(\C=C\c2ccc(cc2)C(N)=N)cc1
NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N |w:1.0,20.23|
NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(nc1)C(N)=N
NC(=O)N\N=C\c1ccc(o1)-c1ccc(Cl)cc1
NCC(=O)NCCc1ccccc1
NCC(=O)NCc1cccc(c1)-n1nc(cc1C(=O)Nc1ccc(cc1)-c1ccccc1)C(F)(F)F
NCC(=O)NCc1cccc(c1)-n1nc(cc1C(=O)Nc1ccccc1)C(F)(F)F
NCC(=O)NCc1cccnc1Oc1ccc(F)cc1F
NCC(O)COc1cccc(c1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
NCC(O)COc1cccc(c1)-c1nc(cc(n1)N1CCOCC1)N1CCOCC1
NCCCN(CCCCCNC(N)=N)C[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)n1cnc2c(N)ncnc12 |r|
NCCCN(CCCCNC(N)=N)C[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)n1cnc2c(N)ncnc12 |r|
NCCCN(CCCNC(N)=N)C[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)n1cnc2c(N)ncnc12 |r|
NCCCN(CCCNc1ccccn1)C[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)n1cnc2c(N)ncnc12 |r|
NCCN1CCC(CC1)c1nnc(Cn2ccnc2)n1C1CC1
NCCN1CCC(Cc2ccccc2)CC1
N[C@@H](CCCN(CCI)C[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)n1cnc2c(N)ncnc12)C(O)=O |r|
N[C@@H](CCCN(CCI)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccccc3)ncnc12)C(O)=O |r|
N[C@@H](CCSC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)n1cnc2c(N)ncnc12)C(O)=O |r|
N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O
Nc1nc(N)c2nc3c(ccc4ccccc34)nc2n1
O[C@@H](CNC(=O)c1ccc2CN(CCc2c1)C(=O)c1ccc(Br)cc1)CN1CCc2ccccc2C1 |r|
Oc1ccc(C=C2CN(CC(=O)c3ccccc3)CC(=Cc3ccc(O)c(Br)c3)C2=O)cc1Br |w:20.21,5.4|
Oc1ccc(\C=C2/CN(CCCc3ccccc3)C\C(=C/c3ccc(O)c(Br)c3)C2=O)cc1Br
Oc1ccc(\C=C2/CN(CCc3ccccc3)C\C(=C/c3ccc(O)c(Br)c3)C2=O)cc1Br
Oc1ccc(\C=C2/CN(Cc3ccc(Cl)cc3)C\C(=C/c3ccc(O)c(Br)c3)C2=O)cc1Br
Oc1ccc(\C=C2/CN(Cc3cccc(Cl)c3)C\C(=C/c3ccc(O)c(Br)c3)C2=O)cc1Br
Oc1ccc(\C=C2/CN(Cc3ccccc3)C\C(=C/c3ccc(O)c(Br)c3)C2=O)cc1Br
Oc1ccc(\C=C2/CN(Cc3ccccc3Cl)C\C(=C/c3ccc(O)c(Br)c3)C2=O)cc1Br
[I-].C(CN1\C(Sc2c1ccc1ccccc21)=C\C=C\c1sc2c(ccc3ccccc23)[n+]1CCCc1ccccc1)Cc1ccccc1
[I-].CCCCN1\C(=C\C=C(/Br)\C=C\C2=[N+](CCCC)c3ccc(Br)cc3C2(C)C)C(C)(C)c2cc(Br)ccc12 |c:12|
[I-].CCCCN1\C(Sc2ccc(Br)cc12)=C\C=C\c1sc2ccc(Br)cc2[n+]1CCCC
[Na+].COc1ccc(cc1)\N=N\c1c(O)c2ccc(Nc3nc(Cl)nc(Cl)n3)cc2cc1S([O-])(=O)=O