518 SMILES Strings for Interleukin-17 receptor A/

Compound Name
SMILES String
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@H]2CCCc3ccccc23)cc1 |r|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1F |r,wU:16.17,(-7.54,1.43,;-7.54,2.97,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.88,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.28,;6.13,5.6,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;-3.54,.66,;-4.88,1.43,;-6.21,.66,)|
C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r,wU:7.8,1.0,wD:4.7,(1.79,-5.5,;1.79,-3.96,;.46,-3.19,;.46,-1.65,;1.79,-.88,;3.13,-1.65,;3.13,-3.19,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.28,;6.13,5.6,;6.9,4.26,;5.87,3.12,;6.19,1.61,;.46,1.43,;.46,2.97,;-.88,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
CCn1nccc1C(=O)N[C@@H]([C@H]1CC[C@@H](CC1)C(F)(F)F)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r,wU:10.10,14.18,wD:11.11,(5.04,.58,;6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.6,;4.62,5.28,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;1.79,-5.5,;.46,-6.27,;3.13,-6.27,;1.79,-7.04,;.46,1.43,;.46,2.97,;-.88,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
CCc1nocc1C(=O)N[C@@H](C1CCCC1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F |r|
CCc1nocc1C(=O)N[C@@H]([C@@H]1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C |r|
CCn1nccc1C(=O)N[C@@H]([C@H]1CC[C@H](CC1)C(F)(F)F)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r,wU:10.10,11.17,14.18,(5.04,.58,;6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;3.13,-1.65,;3.13,-3.19,;1.79,-3.96,;.46,-3.19,;.46,-1.65,;1.79,-5.5,;.46,-6.27,;3.13,-6.27,;1.79,-7.04,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
CCc1nocc1C(=O)N[C@@H]([C@H]1CC[C@H](CC1)C(F)(F)F)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r,wU:10.10,11.17,14.18,(5.04,.58,;6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;3.13,-1.65,;3.13,-3.19,;1.79,-3.96,;.46,-3.19,;.46,-1.65,;1.79,-5.5,;.46,-6.27,;3.13,-6.27,;1.79,-7.04,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1nocc1C(=O)N[C@@H]([C@@H]1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F |r|
CCc1n[nH]cc1C(=O)N[C@@H]([C@@H]1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F |r|
CCc1n[nH]cc1C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F |r|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCC(F)=CC2)cc1 |r,c:32|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@H]2CCC(F)=CC2)cc1 |r,c:32|
CCn1nccc1C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C |r|
CCn1nccc1C(=O)N[C@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C |r|
Cc1nocc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:9.9,(6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
COCCn1nccc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:12.12,(4.22,-1.96,;5.36,-.93,;5.04,.58,;6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2CCO)C2CCCCC2)cc1F |r,wU:16.17,(-7.54,1.43,;-7.54,2.97,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;5.04,.58,;5.36,-.93,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;-3.54,.66,;-4.88,1.43,;-6.21,.66,)|
Cc1nscc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:9.9,(6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CC[C@@H](CC2)C(F)(F)F)cc1 |r,wU:16.17,29.34,(-7.54,1.43,;-7.54,2.97,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;1.79,-5.5,;.46,-6.27,;3.13,-6.27,;1.79,-7.04,;-3.54,.66,;-4.88,1.43,)|
Cc1nocc1C(=O)N[C@@H](C1CC[C@@H](CC1)C(F)(F)F)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:9.9,13.17,(6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;1.79,-5.5,;.46,-6.27,;3.13,-6.27,;1.79,-7.04,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
CCn1nccc1C(=O)N[C@@H](C1CCCC1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F |r|
Cc1nocc1C(=O)N[C@@H](C1CCCC1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F |r|
Cc1nocc1C(=O)N[C@@H]([C@H]1CC[C@@H](CC1)C(F)(F)F)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r,wU:9.9,13.17,wD:10.11,(3.48,6.31,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;1.79,-5.5,;.46,-6.27,;3.13,-6.27,;1.79,-7.04,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@H]2CC[C@@H](CC2)C(F)(F)F)cc1 |r,wU:16.17,29.34,wD:26.28,(-4.88,6.05,;-6.21,5.28,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,;-6.21,3.74,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;1.79,-5.5,;.46,-6.27,;3.13,-6.27,;1.79,-7.04,;-3.54,.66,;-4.88,1.43,)|
COCc1nocc1C(=O)N[C@@H]([C@H]1CC[C@@H](CC1)C(F)(F)F)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r,wU:11.11,15.19,wD:12.13,(5.36,-.93,;5.04,.58,;6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;1.79,-5.5,;.46,-6.27,;3.13,-6.27,;1.79,-7.04,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
CCc1nocc1C(=O)N[C@@H]([C@H]1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F |r|
Cc1c(-c2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCC(F)(F)CC3)cc2)c(cc[n+]1[O-])C(F)(F)F |r|
CCc1nocc1C(=O)N[C@@H]([C@H]1CCC(F)=CC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r,c:16|
Cc1nocc1C(=O)N[C@@H]([C@H]1CCC(F)=CC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r,c:15|
CCc1nocc1C(=O)N[C@@H]([C@H]1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
CCc1nocc1C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCC(F)(F)CC2)cc1 |r|
COCc1nocc1C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
CCc1nocc1C(=O)N[C@@H](C1CCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
CCn1nccc1C(=O)N[C@@H](C1CCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCC2)cc1 |r|
Cc1nocc1C(=O)N[C@@H](C1CCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
Cc1nocc1C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1 |r|
CC(C)n1nccc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCCC2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C2CC2)C2CCCCCC2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)C(NC(=O)c2ccnn2C)C2(C)CCCCC2)cc1
Cc1nocc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cn1)-c1c(C)cc[n+]([O-])c1C
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1 |r|
C[C@H]1CCC(CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:7.8,1.0,(1.79,-5.5,;1.79,-3.96,;.46,-3.19,;.46,-1.65,;1.79,-.88,;3.13,-1.65,;3.13,-3.19,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1cc[n+]([O-])c(Cl)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCCC2)nc1
CC(C)n1nccc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cn1)-c1c(C)cc[n+]([O-])c1Cl
Cc1nocc1C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C |r|
CC(C)n1nccc1C(=O)N[C@@H](C1CCCc2ccccc12)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
CCc1nocc1C(=O)NC(C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCC(F)(F)CC2)cc1 |r|
Cc1occc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1 |r|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1 |r|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCC(F)=CC2)cc1 |r,c:32|
C[C@H]1CC[C@H](CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:7.8,4.3,1.0,(1.79,-5.5,;1.79,-3.96,;.46,-3.19,;.46,-1.65,;1.79,-.88,;3.13,-1.65,;3.13,-3.19,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1nocc1C(=O)N[C@@H]([C@@H]1C[C@@H]2C[C@@H]2C1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:9.9,10.11,12.13,14.14,(6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.55,-1.78,;1.02,-3.25,;1.65,-4.65,;2.56,-3.25,;3.04,-1.78,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
CCn1nccc1C(=O)N[C@@H]([C@@H]1C[C@@H]2C[C@@H]2C1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:10.10,11.12,13.14,15.15,(5.04,.58,;6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.55,-1.78,;1.02,-3.25,;1.65,-4.65,;2.56,-3.25,;3.04,-1.78,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)c(F)c1 |r|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)nc1 |r|
Cc1c(c(Cl)cc[n+]1[O-])-c1c(F)cc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1F |r,wU:17.18,(-7.54,1.43,;-7.54,2.97,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-4.88,2.97,;-3.54,3.74,;-3.54,5.28,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;-3.54,.66,;-4.88,1.43,;-6.21,.66,)|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)c(F)c1F |r,wU:16.17,(-7.54,1.43,;-7.54,2.97,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;-3.54,.66,;-3.54,-.88,;-4.88,1.43,;-6.21,.66,)|
Cc1c(c(Cl)cc[n+]1[O-])-c1cc(F)c(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1F |r,wU:17.18,(-7.54,1.43,;-7.54,2.97,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-4.88,2.97,;-4.88,1.43,;-3.54,.66,;-3.54,-.88,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;-2.21,2.97,;-3.54,3.74,;-3.54,5.28,)|
Cc1c(-c2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)[C@@H]3C[C@@H]4C[C@@H]4C3)cc2)c(cc[n+]1[O-])C(F)(F)F |r|
Cc1c(-c2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)c(F)c2)c(cc[n+]1[O-])C(F)(F)F |r|
Cc1c(-c2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2F)c(cc[n+]1[O-])C(F)(F)F |r,wU:10.10,(-7.54,1.43,;-7.54,2.97,;-6.21,3.74,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;-3.54,.66,;-4.88,1.43,;-6.21,.66,;-6.21,5.28,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-4.88,6.05,;-4.88,7.59,;-3.54,5.28,;-4.88,4.51,)|
Cc1c(-c2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2)c(cc[n+]1[O-])C(F)(F)F |r|
CC(C)n1nccc1C(=O)N[C@@H](C(c1ccccc1)c1ccccc1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
CC(C)n1nccc1C(=O)N[C@@H](C(c1ccccc1)c1ccccc1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C |r|
CCn1nccc1C(=O)NC(C1CC2CC2C1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
Cc1nocc1C(=O)NC(C1CC2CC2C1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
Cc1nocc1C(=O)N[C@@H](Cc1ccccc1F)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
Cc1nc(c(s1)C(=O)N[C@@H](C1CCCC1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F)C(F)(F)F |r|
Cc1nocc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccnn2C)cc1 |r|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2CC(O)=O)C2CCCCC2)cc1F |r,wU:16.17,(-7.54,1.43,;-7.54,2.97,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;7.65,1.13,;8.8,2.16,;7.97,-.37,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;-3.54,.66,;-4.88,1.43,;-6.21,.66,)|
CN(C)CCn1nccc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:13.13,(6.83,-1.4,;7.97,-.37,;9.44,-.85,;7.65,1.13,;6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2conc2CO)[C@H]2CC[C@@H](CC2)C(F)(F)F)cc1 |r,wU:16.17,30.35,wD:27.29,(-4.88,6.05,;-6.21,5.28,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,;-6.21,3.74,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;7.65,1.13,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;1.79,-5.5,;.46,-6.27,;3.13,-6.27,;1.79,-7.04,;-3.54,.66,;-4.88,1.43,)|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2conc2CN)C2CCCCC2)cc1 |r|
CN(C)Cc1nocc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
Cc1cc[n+]([O-])cc1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1 |r|
CC(C)n1nccc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1ccc[n+]([O-])c1C |r|
Cc1c(ccc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1F |r|
C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(c(F)c1)-c1c(C)cc[n+]([O-])c1C |r,wU:7.8,1.0,wD:4.3,(1.79,-5.5,;1.79,-3.96,;.46,-3.19,;.46,-1.65,;1.79,-.88,;3.13,-1.65,;3.13,-3.19,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)c(Cl)c1 |r|
CCc1nocc1C(=O)N[C@@H](C1CCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |r|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCC(F)(F)C2)cc1 |r|
Cc1nocc1C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(c(F)c1)-c1c(C)cc[n+]([O-])c1C |r,wU:9.9,(6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;.39,-4.58,;3.04,-4.86,;3.13,-3.19,;3.13,-1.65,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1cc[n+]([O-])c(Cl)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1F |r,wU:16.17,(-4.88,6.05,;-6.21,5.28,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,;-6.21,3.74,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;-3.54,.66,;-4.88,1.43,;-6.21,.66,)|
COCc1nocc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c(C)cc[n+]([O-])c1Cl |r,wU:11.11,(5.36,-.93,;5.04,.58,;6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@H]2CC[C@@H](CC2)C(F)(F)F)cc1F |r,wU:16.17,29.34,wD:26.28,(-4.88,6.05,;-6.21,5.28,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,;-6.21,3.74,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;1.79,-5.5,;.46,-6.27,;3.13,-6.27,;1.79,-7.04,;-3.54,.66,;-4.88,1.43,;-6.21,.66,)|
Cc1c(cc(Cl)c[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1F |r|
Cn1nccc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c[n+]([O-])ccc1Cl |r|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C2CC2)C2CCCCC2)cc1 |r|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1F |r,wU:16.17,(-4.88,6.05,;-6.21,5.28,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,;-6.21,3.74,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;-3.54,.66,;-4.88,1.43,;-6.21,.66,)|
CC(C)n1nccc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c(C)cc[n+]([O-])c1C |r,wU:11.11,(5.04,.58,;6.19,1.61,;7.65,1.13,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;3.13,-3.19,;3.13,-1.65,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1c[n+]([O-])cc(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1 |r|
Cc1c[n+]([O-])cc(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C2CC2)C2CCCCC2)cc1 |r|
Cc1c[n+]([O-])cc(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCCC2)cc1
Cc1c[n+]([O-])cc(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C2CC2)C2CCCCCC2)cc1
CC(C)n1nccc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)c[n+]([O-])cc1C
Cc1c[n+]([O-])cc(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C2CCC2)C2CCCCCC2)cc1
Cc1c[n+]([O-])cc(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@H]2CCc3ccccc3C2)cc1 |r|
Cc1cc[n+]([O-])c(C(F)F)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1 |r|
Cn1nccc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1c(Cl)[n+]([O-])ccc1C(F)(F)F |r|
Cc1nocc1C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:9.9,(6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;.46,-4.73,;3.13,-4.73,;3.13,-3.19,;3.13,-1.65,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCC(F)(F)CC2)cc1F |r,wU:16.17,(-7.54,1.43,;-7.54,2.97,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;.46,-4.73,;3.13,-4.73,;3.13,-3.19,;3.13,-1.65,;-3.54,.66,;-4.88,1.43,;-6.21,.66,)|
CCn1nccc1C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |r,wU:10.10,(5.04,.58,;6.19,1.61,;5.87,3.12,;6.9,4.26,;6.13,5.59,;4.62,5.27,;4.46,3.74,;3.13,2.97,;1.79,3.74,;3.13,1.43,;1.79,.66,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;.46,-4.73,;3.13,-4.73,;3.13,-3.19,;3.13,-1.65,;.46,1.43,;.46,2.97,;-.87,.66,;-2.21,1.43,;-2.21,2.97,;-3.54,3.74,;-4.88,2.97,;-4.88,1.43,;-6.21,.66,;-3.54,.66,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,)|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCC(F)(F)CC2)cc1F |r,wU:16.17,(-4.88,6.05,;-6.21,5.28,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-7.54,2.97,;-7.54,1.43,;-6.21,3.74,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;.46,-1.65,;.46,-3.19,;1.79,-3.96,;.46,-4.73,;3.13,-4.73,;3.13,-3.19,;3.13,-1.65,;-3.54,.66,;-4.88,1.43,;-6.21,.66,)|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@H]2CCCC(F)(F)C2)cc1F |r,wU:16.17,26.35,(-7.54,1.43,;-7.54,2.97,;-6.21,3.74,;-6.21,5.28,;-4.88,6.05,;-7.54,6.05,;-8.88,5.28,;-8.88,3.74,;-10.21,2.97,;-4.88,2.97,;-3.54,3.74,;-2.21,2.97,;-2.21,1.43,;-.87,.66,;.46,1.43,;.46,2.97,;1.79,.66,;3.13,1.43,;3.13,2.97,;1.79,3.74,;4.46,3.74,;4.62,5.27,;6.13,5.59,;6.9,4.26,;5.87,3.12,;6.19,1.61,;1.79,-.88,;3.13,-1.65,;3.13,-3.19,;1.79,-3.96,;.46,-3.19,;.46,-4.73,;-.87,-2.42,;.46,-1.65,;-3.54,.66,;-4.88,1.43,;-6.21,.66,)|
Cc1c[n+]([O-])ccc1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1F |r|
Cn1nccc1C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1c[n+]([O-])ccc1Cl |r|
Cc1cc(c(C)[n+]([O-])c1)-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1 |r|
Cc1cc[n+]([O-])c(F)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1 |r|
Cc1c(cc(CO)c[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1 |r|
Cc1c[n+]([O-])cc(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CNCCn23)C2CCCCCC2)cc1
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)c[n+]([O-])cc1C
CC(=O)N1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)c[n+]([O-])cc1C
CN1CCn2ccc(C(=O)N[C@@H](C3CCCCCC3)C(=O)Nc3ccc(cc3)-c3c(C)cc[n+]([O-])c3C)c2C1
CN1CCc2ccc(C(=O)N[C@@H](C3CCCCCC3)C(=O)Nc3ccc(cc3)-c3c(C)cc[n+]([O-])c3C)n2C1
C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccc2CN(C)CCn12)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |wU:7.8,1.0,wD:4.3,(3.79,-10.38,;2.76,-9.23,;1.25,-9.55,;.22,-8.41,;.7,-6.94,;2.2,-6.62,;3.23,-7.77,;-.33,-5.8,;.14,-4.33,;1.65,-4.01,;2.68,-5.16,;2.13,-2.55,;1.22,-1.3,;2.13,-.06,;3.59,-.53,;4.92,.24,;6.26,-.53,;7.59,.24,;6.26,-2.07,;4.92,-2.84,;3.59,-2.07,;-1.84,-6.12,;-2.87,-4.97,;-2.31,-7.58,;-3.82,-7.9,;-4.85,-6.76,;-6.36,-7.08,;-6.83,-8.54,;-5.8,-9.69,;-4.3,-9.37,;-8.34,-8.86,;-9.37,-7.72,;-8.89,-6.25,;-10.88,-8.04,;-11.35,-9.5,;-10.32,-10.65,;-10.8,-12.11,;-8.82,-10.33,;-7.79,-11.47,)|
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |wU:13.14,(7.59,.24,;6.26,-.53,;6.26,-2.07,;4.92,-2.84,;3.59,-2.07,;3.59,-.53,;4.92,.24,;2.13,-.06,;1.22,-1.3,;2.13,-2.55,;1.65,-4.01,;2.68,-5.16,;.14,-4.33,;-.33,-5.8,;.7,-6.94,;2.18,-6.51,;3.44,-7.4,;3.53,-8.93,;2.38,-9.96,;.86,-9.71,;.11,-8.37,;-1.84,-6.12,;-2.87,-4.97,;-2.31,-7.58,;-3.82,-7.9,;-4.85,-6.76,;-6.36,-7.08,;-6.83,-8.54,;-5.8,-9.69,;-6.28,-11.15,;-4.3,-9.37,;-8.34,-8.86,;-9.37,-7.72,;-8.89,-6.25,;-10.88,-8.04,;-11.35,-9.5,;-10.32,-10.65,;-10.8,-12.11,;-8.82,-10.33,;-7.79,-11.47,)|
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |wU:13.14,(7.59,.24,;6.26,-.53,;6.26,-2.07,;4.92,-2.84,;3.59,-2.07,;3.59,-.53,;4.92,.24,;2.13,-.06,;1.22,-1.3,;2.13,-2.55,;1.65,-4.01,;2.68,-5.16,;.14,-4.33,;-.33,-5.8,;.7,-6.94,;.22,-8.41,;1.25,-9.55,;2.76,-9.23,;3.23,-7.77,;2.2,-6.62,;-1.84,-6.12,;-2.87,-4.97,;-2.31,-7.58,;-3.82,-7.9,;-4.85,-6.76,;-6.36,-7.08,;-6.83,-8.54,;-5.8,-9.69,;-6.28,-11.15,;-4.3,-9.37,;-8.34,-8.86,;-9.37,-7.72,;-8.89,-6.25,;-10.88,-8.04,;-11.35,-9.5,;-10.32,-10.65,;-10.8,-12.11,;-8.82,-10.33,;-7.79,-11.47,)|
CN1CCn2c(C1)ccc2C(=O)N[C@@H]([C@H]1CC[C@@H](CC1)C(F)(F)F)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |wU:13.14,17.22,wD:14.16,(7.59,.24,;6.26,-.53,;6.26,-2.07,;4.92,-2.84,;3.59,-2.07,;3.59,-.53,;4.92,.24,;2.13,-.06,;1.22,-1.3,;2.13,-2.55,;1.65,-4.01,;2.68,-5.16,;.14,-4.33,;-.33,-5.8,;.7,-6.94,;.22,-8.41,;1.25,-9.55,;2.76,-9.23,;3.23,-7.77,;2.2,-6.62,;3.79,-10.38,;3.31,-11.84,;5.3,-10.06,;4.82,-11.52,;-1.84,-6.12,;-2.87,-4.97,;-2.31,-7.58,;-3.82,-7.9,;-4.85,-6.76,;-6.36,-7.08,;-6.83,-8.54,;-5.8,-9.69,;-4.3,-9.37,;-8.34,-8.86,;-9.37,-7.72,;-8.89,-6.25,;-10.88,-8.04,;-11.35,-9.5,;-10.32,-10.65,;-10.8,-12.11,;-8.82,-10.33,;-7.79,-11.47,)|
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1ccc[n+]([O-])c1C
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCC(F)=CC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |c:20|
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCC(F)CC1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C |wU:13.14,(7.59,.24,;6.26,-.53,;6.26,-2.07,;4.92,-2.84,;3.59,-2.07,;3.59,-.53,;4.92,.24,;2.13,-.06,;1.22,-1.3,;2.13,-2.55,;1.65,-4.01,;2.68,-5.16,;.14,-4.33,;-.33,-5.8,;.7,-6.94,;.22,-8.41,;1.25,-9.55,;2.76,-9.23,;3.79,-10.38,;3.23,-7.77,;2.2,-6.62,;-1.84,-6.12,;-2.87,-4.97,;-2.31,-7.58,;-3.82,-7.9,;-4.85,-6.76,;-6.36,-7.08,;-6.83,-8.54,;-5.8,-9.69,;-4.3,-9.37,;-8.34,-8.86,;-9.37,-7.72,;-8.89,-6.25,;-10.88,-8.04,;-11.35,-9.5,;-10.32,-10.65,;-10.8,-12.11,;-8.82,-10.33,;-7.79,-11.47,)|
CN1CCn2c(C1)ccc2C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CN(CCn23)C2CC2)C2CCCCC2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CN(CCn23)C2COC2)[C@H]2CC[C@@H](CC2)C(F)(F)F)cc1 |wU:16.17,33.37,wD:36.43,(-7.79,-11.47,;-8.82,-10.33,;-10.32,-10.65,;-11.35,-9.5,;-10.88,-8.04,;-11.91,-6.89,;-9.37,-7.72,;-8.89,-6.25,;-8.34,-8.86,;-6.83,-8.54,;-6.36,-7.08,;-4.85,-6.76,;-3.82,-7.9,;-2.31,-7.58,;-1.84,-6.12,;-2.87,-4.97,;-.33,-5.8,;.14,-4.33,;1.65,-4.01,;2.68,-5.16,;2.13,-2.55,;1.22,-1.3,;2.13,-.06,;3.59,-.53,;4.92,.24,;6.26,-.53,;6.26,-2.07,;4.92,-2.84,;3.59,-2.07,;7.59,.24,;7.99,1.72,;9.48,1.33,;9.08,-.16,;.7,-6.94,;2.2,-6.62,;3.23,-7.77,;2.76,-9.23,;1.25,-9.55,;.22,-8.41,;3.79,-10.38,;4.82,-11.52,;2.64,-11.41,;4.93,-9.35,;-4.3,-9.37,;-5.8,-9.69,)|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CN(CCn23)C2COC2)C2CCCCC2)cc1F |wU:16.17,(-8.89,-6.25,;-9.37,-7.72,;-8.34,-8.86,;-8.82,-10.33,;-7.79,-11.47,;-10.32,-10.65,;-11.35,-9.5,;-10.88,-8.04,;-11.91,-6.89,;-6.83,-8.54,;-6.36,-7.08,;-4.85,-6.76,;-3.82,-7.9,;-2.31,-7.58,;-1.84,-6.12,;-2.87,-4.97,;-.33,-5.8,;.14,-4.33,;1.65,-4.01,;2.68,-5.16,;2.13,-2.55,;1.22,-1.3,;2.13,-.06,;3.59,-.53,;4.92,.24,;6.26,-.53,;6.26,-2.07,;4.92,-2.84,;3.59,-2.07,;7.59,.24,;7.99,1.72,;9.48,1.33,;9.08,-.16,;.7,-6.94,;2.2,-6.62,;3.23,-7.77,;2.76,-9.23,;1.25,-9.55,;.22,-8.41,;-4.3,-9.37,;-5.8,-9.69,;-6.28,-11.15,)|
CC(=O)N1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |wU:15.16,(7.59,5.92,;7.59,4.38,;8.93,3.61,;6.26,3.61,;6.26,2.07,;4.92,1.3,;3.59,2.07,;3.59,3.61,;4.92,4.38,;2.13,4.09,;1.22,2.84,;2.13,1.6,;1.65,.13,;2.68,-1.01,;.14,-.19,;-.33,-1.65,;.7,-2.8,;2.18,-2.37,;3.44,-3.25,;3.53,-4.79,;2.38,-5.82,;.86,-5.57,;.11,-4.22,;-1.84,-1.97,;-2.87,-.83,;-2.31,-3.44,;-3.82,-3.76,;-4.3,-5.22,;-5.8,-5.54,;-6.83,-4.4,;-6.36,-2.93,;-7.39,-1.79,;-4.85,-2.61,;-8.34,-4.72,;-8.82,-6.18,;-7.79,-7.33,;-10.32,-6.5,;-11.35,-5.36,;-10.88,-3.89,;-11.91,-2.75,;-9.37,-3.57,;-8.89,-2.11,)|
COCCN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
Cc1ccnc(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@H]2CCCc3ccccc23)cc1
Cc1nccc(Cl)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1F |wU:15.16,(-8.89,-6.25,;-9.37,-7.72,;-10.88,-8.04,;-11.35,-9.5,;-10.32,-10.65,;-8.82,-10.33,;-7.79,-11.47,;-8.34,-8.86,;-6.83,-8.54,;-5.8,-9.69,;-4.3,-9.37,;-3.82,-7.9,;-2.31,-7.58,;-1.84,-6.12,;-2.87,-4.97,;-.33,-5.8,;.14,-4.33,;1.65,-4.01,;2.68,-5.16,;2.13,-2.55,;1.22,-1.3,;2.13,-.06,;3.59,-.53,;3.59,-2.07,;4.92,-2.84,;.7,-6.94,;2.2,-6.62,;3.23,-7.77,;2.76,-9.23,;1.25,-9.55,;.22,-8.41,;-4.85,-6.76,;-6.36,-7.08,;-7.39,-5.93,)|
C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(cc1)-c1c(C)ccnc1C |wU:7.8,1.0,wD:4.4,(3.79,-10.38,;2.76,-9.23,;1.25,-9.55,;.22,-8.41,;.7,-6.94,;2.2,-6.62,;3.23,-7.77,;-.33,-5.8,;.14,-4.33,;1.65,-4.01,;2.68,-5.16,;2.13,-2.55,;1.22,-1.3,;2.13,-.06,;3.59,-.53,;3.59,-2.07,;4.92,-2.84,;-1.84,-6.12,;-2.87,-4.97,;-2.31,-7.58,;-3.82,-7.9,;-4.85,-6.76,;-6.36,-7.08,;-6.83,-8.54,;-5.8,-9.69,;-4.3,-9.37,;-8.34,-8.86,;-8.82,-10.33,;-7.79,-11.47,;-10.32,-10.65,;-11.35,-9.5,;-10.88,-8.04,;-9.37,-7.72,;-8.89,-6.25,)|
CCc1nocc1C(=O)N[C@@H](C1CCCC1)C(=O)Nc1ccc(cc1)-c1c(C)nccc1C(F)(F)F
CCc1nocc1C(=O)N[C@@H]([C@H]1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)nccc1Cl
CCn1nccc1C(=O)N[C@@H]([C@H]1CC[C@@H](CC1)C(F)(F)F)C(=O)Nc1ccc(cc1)-c1c(C)ccnc1C |wU:10.10,14.18,wD:11.12,(4.92,-4.38,;4.92,-2.84,;3.59,-2.07,;3.59,-.53,;2.13,-.06,;1.22,-1.3,;2.13,-2.55,;1.65,-4.01,;2.68,-5.16,;.14,-4.33,;-.33,-5.8,;.7,-6.94,;.22,-8.41,;1.25,-9.55,;2.76,-9.23,;3.23,-7.77,;2.2,-6.62,;3.79,-10.38,;3.31,-11.84,;5.3,-10.06,;4.82,-11.52,;-1.84,-6.12,;-2.87,-4.97,;-2.31,-7.58,;-3.82,-7.9,;-4.85,-6.76,;-6.36,-7.08,;-6.83,-8.54,;-5.8,-9.69,;-4.3,-9.37,;-8.34,-8.86,;-8.82,-10.33,;-7.79,-11.47,;-10.32,-10.65,;-11.35,-9.5,;-10.88,-8.04,;-9.37,-7.72,;-8.89,-6.25,)|
CCc1nocc1C(=O)N[C@@H]([C@H]1CC[C@@H](CC1)C(F)(F)F)C(=O)Nc1ccc(cc1)-c1c(C)ccnc1C |wU:10.10,14.18,wD:11.12,(4.92,-4.38,;4.92,-2.84,;3.59,-2.07,;3.59,-.53,;2.13,-.06,;1.22,-1.3,;2.13,-2.55,;1.65,-4.01,;2.68,-5.16,;.14,-4.33,;-.33,-5.8,;.7,-6.94,;.22,-8.41,;1.25,-9.55,;2.76,-9.23,;3.23,-7.77,;2.2,-6.62,;3.79,-10.38,;3.31,-11.84,;5.3,-10.06,;4.82,-11.52,;-1.84,-6.12,;-2.87,-4.97,;-2.31,-7.58,;-3.82,-7.9,;-4.85,-6.76,;-6.36,-7.08,;-6.83,-8.54,;-5.8,-9.69,;-4.3,-9.37,;-8.34,-8.86,;-8.82,-10.33,;-7.79,-11.47,;-10.32,-10.65,;-11.35,-9.5,;-10.88,-8.04,;-9.37,-7.72,;-8.89,-6.25,)|
Cc1nocc1C(=O)N[C@@H]([C@H]1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)nccc1C(F)(F)F
Cc1ccnc(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@H]2CCC(F)=CC2)cc1 |c:31|
CCn1nccc1C(=O)N[C@@H](C1C[C@@H]2C[C@H]2C1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
Cc1nocc1C(=O)N[C@@H]([C@@H]1C[C@@H]2C[C@@H]2C1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
CCn1nccc1C(=O)N[C@@H](C1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCCC2)nc1
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cn1)-c1c(C)cc[n+]([O-])c1C
CN1CCn2c(C1)ccc2C(=O)N[C@@H]([C@@H]1C[C@@H]2C[C@@H]2C1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
CCn1nccc1C(=O)N[C@H]([C@@H]1C[C@@H]2C[C@@H]2C1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@H](NC(=O)c2conc2CO)C2CCC(F)(F)CC2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@H](NC(=O)c2ccnn2C)C2CCCC(F)(F)CC2)cc1
CC(C)c1[nH]ncc1C(=O)N[C@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
CC(C)n1nccc1C(=O)N[C@H](C1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
CCn1nccc1C(=O)N[C@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@H](NC(=O)c2ccnn2C)C2CCCC(F)(F)C2)cc1
CC(C)n1nccc1C(=O)NC(C1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
Cc1nocc1C(=O)N[C@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
COCc1nocc1C(=O)N[C@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |wU:11.11,(1.52,-6.14,;2.55,-4.99,;4.06,-5.31,;5.09,-4.17,;6.6,-4.49,;7.37,-3.16,;6.34,-2.01,;4.93,-2.64,;3.6,-1.87,;3.6,-.33,;2.26,-2.64,;.93,-1.87,;.93,-.33,;2.26,.44,;2.26,1.98,;.93,2.75,;2.17,3.66,;-.41,3.52,;-.41,1.98,;-.41,.44,;-.41,-2.64,;-.41,-4.18,;-1.74,-1.87,;-3.07,-2.64,;-3.07,-4.18,;-4.41,-4.95,;-5.74,-4.18,;-5.74,-2.64,;-7.07,-1.87,;-4.41,-1.87,;-7.07,-4.95,;-7.07,-6.49,;-5.74,-7.26,;-8.41,-7.26,;-9.74,-6.49,;-9.74,-4.95,;-11.07,-4.18,;-8.41,-4.18,;-8.41,-2.64,)|
CN1CCn2c(C1)ccc2C(=O)N[C@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |wU:13.14,(6.52,-8.56,;6.04,-7.1,;4.54,-6.78,;4.06,-5.31,;5.09,-4.17,;6.6,-4.49,;7.07,-5.95,;7.37,-3.16,;6.34,-2.01,;4.93,-2.64,;3.6,-1.87,;3.6,-.33,;2.26,-2.64,;.93,-1.87,;.93,-.33,;-.41,.44,;-.41,1.98,;.93,2.75,;-.41,3.52,;2.17,3.66,;2.26,1.98,;2.26,.44,;-.41,-2.64,;-.41,-4.18,;-1.74,-1.87,;-3.07,-2.64,;-3.07,-4.18,;-4.41,-4.95,;-5.74,-4.18,;-5.74,-2.64,;-7.07,-1.87,;-4.41,-1.87,;-7.07,-4.95,;-7.07,-6.49,;-5.74,-7.26,;-8.41,-7.26,;-9.74,-6.49,;-9.74,-4.95,;-11.07,-4.18,;-8.41,-4.18,;-8.41,-2.64,)|
CN1CCn2c(C1)ccc2C(=O)N[C@H]([C@@H]1C[C@H]2[C@@H](C1)C2(F)F)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
CN1CCn2c(C1)ccc2C(=O)N[C@H](C1CCCC(F)(F)C1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F
Cc1c(cnn1C)C(=O)N[C@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
Cc1cc[n+]([O-])cc1-c1ccc(NC(=O)[C@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1F
Cc1nocc1C(=O)N[C@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1cc(C)c[n+]([O-])c1C
CCn1nccc1C(=O)N[C@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1cc(Cl)c[n+]([O-])c1C
Cc1cc(c(C)[n+]([O-])c1)-c1ccc(NC(=O)[C@H](NC(=O)c2ccnn2C)C2CCC(F)(F)CC2)cc1
Cc1nocc1C(=O)N[C@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(c(F)c1)-c1cc(Cl)c[n+]([O-])c1C
Cc1nocc1C(=O)N[C@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1cc(Cl)c[n+]([O-])c1C
Cc1c(cc(Cl)c[n+]1[O-])-c1ccc(NC(=O)[C@H](NC(=O)c2ccnn2C)C2CCC(F)(F)CC2)cc1F
Cc1c(cc(Cl)c[n+]1[O-])-c1ccc(NC(=O)[C@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1
COCc1nocc1C(=O)N[C@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1cc(Cl)c[n+]([O-])c1C
Cc1c(cc(Cl)c[n+]1[O-])-c1ccc(NC(=O)[C@H](NC(=O)c2ccnn2C)C2CCC(F)(F)CC2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CNCCn23)[C@H]2CC[C@@H](CC2)C(F)(F)F)cc1 |wU:29.32,wD:16.17,32.38,(-5.74,-7.26,;-7.07,-6.49,;-8.41,-7.26,;-9.74,-6.49,;-9.74,-4.95,;-11.07,-4.18,;-8.41,-4.18,;-8.41,-2.64,;-7.07,-4.95,;-5.74,-4.18,;-5.74,-2.64,;-4.41,-1.87,;-3.07,-2.64,;-1.74,-1.87,;-.41,-2.64,;-.41,-4.18,;.93,-1.87,;2.26,-2.64,;3.6,-1.87,;3.6,-.33,;4.93,-2.64,;6.34,-2.01,;7.37,-3.16,;6.6,-4.49,;7.07,-5.95,;6.04,-7.1,;4.54,-6.78,;4.06,-5.31,;5.09,-4.17,;.93,-.33,;-.41,.44,;-.41,1.98,;.93,2.75,;2.26,1.98,;2.26,.44,;.93,4.29,;-.41,5.06,;2.26,5.06,;2.26,3.52,;-3.07,-4.18,;-4.41,-4.95,)|
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CNCCn23)C2CCC(F)(F)CC2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@H](Cc2ccccc2Cl)NC(=O)c2ccnn2C)cc1
Cc1nocc1C(=O)N[C@H](C1C[C@@H]2C[C@H]2C1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)C(NC(=O)c2ccnn2C)C2CCCC(F)C2)cc1
Cc1c(-c2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)[C@H]3CCCC(F)(F)C3)cc2)c(cc[n+]1[O-])C(F)(F)F
CC(=O)N1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(cc1F)-c1c(Cl)cc[n+]([O-])c1C
CC(=O)N1CCn2ccc(C(=O)N[C@@H](C3CCCCCC3)C(=O)Nc3ccc(cc3)-c3c(C)cc[n+]([O-])c3C)c2C1
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CNCCn23)[C@H]2CCCc3ccccc23)cc1F |wD:16.17,29.32,(-8.41,-2.64,;-8.41,-4.18,;-7.07,-4.95,;-7.07,-6.49,;-5.74,-7.26,;-8.41,-7.26,;-9.74,-6.49,;-9.74,-4.95,;-11.07,-4.18,;-5.74,-4.18,;-4.41,-4.95,;-3.07,-4.18,;-3.07,-2.64,;-1.74,-1.87,;-.41,-2.64,;-.41,-4.18,;.93,-1.87,;2.26,-2.64,;3.6,-1.87,;3.6,-.33,;4.93,-2.64,;6.34,-2.01,;7.37,-3.16,;6.6,-4.49,;7.07,-5.95,;6.04,-7.1,;4.54,-6.78,;4.06,-5.31,;5.09,-4.17,;.93,-.33,;2.26,.44,;2.26,1.98,;.93,2.75,;-.41,1.98,;-1.74,2.75,;-3.07,1.98,;-3.07,.44,;-1.74,-.33,;-.41,.44,;-4.41,-1.87,;-5.74,-2.64,;-7.07,-1.87,)|
CC(=O)N1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(c(F)c1)-c1c(Cl)cc[n+]([O-])c1C |wD:15.16,(5.49,-9.71,;6.52,-8.56,;8.02,-8.88,;6.04,-7.1,;4.54,-6.78,;4.06,-5.31,;5.09,-4.17,;6.6,-4.49,;7.07,-5.95,;7.37,-3.16,;6.34,-2.01,;4.93,-2.64,;3.6,-1.87,;3.6,-.33,;2.26,-2.64,;.93,-1.87,;.93,-.33,;2.26,.44,;2.26,1.98,;.93,2.75,;-.41,1.98,;-.41,.44,;-.41,-2.64,;-.41,-4.18,;-1.74,-1.87,;-3.07,-2.64,;-3.07,-4.18,;-4.41,-4.95,;-5.74,-4.18,;-5.74,-2.64,;-7.07,-1.87,;-4.41,-1.87,;-7.07,-4.95,;-7.07,-6.49,;-5.74,-7.26,;-8.41,-7.26,;-9.74,-6.49,;-9.74,-4.95,;-11.07,-4.18,;-8.41,-4.18,;-8.41,-2.64,)|
CC(=O)N1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccn3CCNCc23)C2CCCCCC2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@H](Cc2ccccc2Cl)NC(=O)c2ccc3CNCCn23)cc1
CC(=O)N1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CNCCn23)C2C[C@@H]3C[C@H]3C2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C(c2ccccc2)c2ccccc2)cc1
CC(=O)N1CCn2c(C1)ccc2C(=O)N[C@@H](C1C[C@@H]2C[C@H]2C1)C(=O)Nc1ccc(c(F)c1)-c1c(C)cc[n+]([O-])c1C |wU:18.20,wD:15.16,20.21,(8.02,-8.88,;6.52,-8.56,;5.49,-9.71,;6.04,-7.1,;4.54,-6.78,;4.06,-5.31,;5.09,-4.17,;6.6,-4.49,;7.07,-5.95,;7.37,-3.16,;6.34,-2.01,;4.93,-2.64,;3.6,-1.87,;3.6,-.33,;2.26,-2.64,;.93,-1.87,;.93,-.33,;2.17,.58,;1.7,2.04,;.93,3.38,;.16,2.04,;-.32,.58,;-.41,-2.64,;-.41,-4.18,;-1.74,-1.87,;-3.07,-2.64,;-3.07,-4.18,;-4.41,-4.95,;-5.74,-4.18,;-5.74,-2.64,;-7.07,-1.87,;-4.41,-1.87,;-7.07,-4.95,;-7.07,-6.49,;-5.74,-7.26,;-8.41,-7.26,;-9.74,-6.49,;-9.74,-4.95,;-11.07,-4.18,;-8.41,-4.18,;-8.41,-2.64,)|
CC(=O)N1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cc1F)-c1c(C)cc[n+]([O-])c1C
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCC[C@H](F)CC2)c(F)c1
Cc1nocc1C(=O)N[C@H]([C@@H]1C[C@@H]2C[C@@H]2C1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
CC(=O)N1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCCCC1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CNCCn23)C2CCC(F)CC2)cc1 |wU:16.17,(-7.79,-7.33,;-8.82,-6.18,;-10.32,-6.5,;-11.35,-5.36,;-10.88,-3.89,;-11.91,-2.75,;-9.37,-3.57,;-8.89,-2.11,;-8.34,-4.72,;-6.83,-4.4,;-5.8,-5.54,;-4.3,-5.22,;-3.82,-3.76,;-2.31,-3.44,;-1.84,-1.97,;-2.87,-.83,;-.33,-1.65,;.14,-.19,;1.65,.13,;2.68,-1.01,;2.13,1.6,;1.22,2.84,;2.13,4.09,;3.59,3.61,;4.92,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;3.59,2.07,;.7,-2.8,;.22,-4.26,;1.25,-5.41,;2.76,-5.09,;3.79,-6.23,;3.23,-3.62,;2.2,-2.48,;-4.85,-2.61,;-6.36,-2.93,)|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@H](NC(=O)c2ccc3CNCCn23)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CNCCn23)C2CCCCCC2)cc1
CN1CCn2c(C1)ccc2C(=O)N[C@H]([C@@H]1C[C@@H]2C[C@@H]2C1)C(=O)Nc1ccc(cc1)-c1c(Cl)cc[n+]([O-])c1C
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@H](NC(=O)c2ccc3CNCCn23)[C@H]2C[C@@H]3C[C@@H]3C2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@H](NC(=O)c2ccc3CNCCn23)C2CCCCC2)cc1
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@H](NC(=O)c2ccc3CNCCn23)C2CCCCC2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@H](NC(=O)c2ccc3CNCCn23)C2CCC(F)(F)CC2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CNCCn23)[C@H]2CCCC(F)(F)C2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccc3CNCCn23)[C@H]2C[C@@H]3C[C@@H]3C2)cc1
CC(=O)N1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCC(F)(F)CC1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)C(NC(=O)c2ccc3CNCCn23)[C@@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1
CC(C(NC(=O)c1ccc2CN(C)CCn12)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C)c1ccccc1Cl
CC([C@H](NC(=O)c1ccc2CN(C)CCn12)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C)c1ccccc1Cl
CN1CCn2c(C1)ccc2C(=O)N[C@@H](C1CCC(F)CC1)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |wU:13.14,(7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;3.59,2.07,;3.59,3.61,;4.92,4.38,;2.13,4.09,;1.22,2.84,;2.13,1.6,;1.65,.13,;2.68,-1.01,;.14,-.19,;-.33,-1.65,;.7,-2.8,;.22,-4.26,;1.25,-5.41,;2.76,-5.09,;3.79,-6.23,;3.23,-3.62,;2.2,-2.48,;-1.84,-1.97,;-2.87,-.83,;-2.31,-3.44,;-3.82,-3.76,;-4.3,-5.22,;-5.8,-5.54,;-6.83,-4.4,;-6.36,-2.93,;-4.85,-2.61,;-8.34,-4.72,;-8.82,-6.18,;-7.79,-7.33,;-10.32,-6.5,;-11.35,-5.36,;-10.88,-3.89,;-11.91,-2.75,;-9.37,-3.57,;-8.89,-2.11,)|
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCC(F)CC2)cc1
CC([C@H](NC(=O)c1ccc2CNCCn12)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C)c1ccccc1Cl
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@H](Cc2ccccc2F)NC(=O)c2ccnn2C)cc1
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CC3CC3C2)cc1
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCC(F)=C2)cc1 |c:33|
C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccc2CNCCn12)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C |wU:7.8,1.0,wD:4.3,(3.79,-6.23,;2.76,-5.09,;1.25,-5.41,;.22,-4.26,;.7,-2.8,;2.2,-2.48,;3.23,-3.62,;-.33,-1.65,;.14,-.19,;1.65,.13,;2.68,-1.01,;2.13,1.6,;1.22,2.84,;2.13,4.09,;3.59,3.61,;4.92,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;3.59,2.07,;-1.84,-1.97,;-2.87,-.83,;-2.31,-3.44,;-3.82,-3.76,;-4.3,-5.22,;-5.8,-5.54,;-6.83,-4.4,;-6.36,-2.93,;-4.85,-2.61,;-8.34,-4.72,;-8.82,-6.18,;-7.79,-7.33,;-10.32,-6.5,;-11.35,-5.36,;-10.88,-3.89,;-11.91,-2.75,;-9.37,-3.57,;-8.89,-2.11,)|
CC([C@H](NC(=O)c1conc1C)C(=O)Nc1ccc(cc1)-c1c(C)cc[n+]([O-])c1C)c1ccccc1Cl
Cc1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)C(NC(=O)c2ccnn2C)C2CC(F)CC(F)C2)cc1
CCn1nccc1C(=O)N[C@@H](C1CC2CC2C1)C(=O)Nc1ccc(cc1)-c1c(C)[n+]([O-])ccc1C(F)(F)F
CC(C)c1cc[n+]([O-])c(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)C2CCCCC2)cc1
Cc1c(c(Cl)cc[n+]1[O-])-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1F |wU:16.17,26.28,28.30,30.31,(-8.89,-2.11,;-9.37,-3.57,;-8.34,-4.72,;-8.82,-6.18,;-7.79,-7.33,;-10.32,-6.5,;-11.35,-5.36,;-10.88,-3.89,;-11.91,-2.75,;-6.83,-4.4,;-5.8,-5.54,;-4.3,-5.22,;-3.82,-3.76,;-2.31,-3.44,;-1.84,-1.97,;-2.87,-.83,;-.33,-1.65,;.14,-.19,;1.65,.13,;2.68,-1.01,;2.13,1.6,;1.22,2.84,;2.13,4.09,;3.59,3.61,;3.59,2.07,;4.84,1.17,;.7,-2.8,;.38,-4.3,;1.71,-5.07,;3.22,-5.39,;2.86,-4.04,;2.23,-2.64,;-4.85,-2.61,;-6.36,-2.93,;-7.39,-1.79,)|
CNC(=O)C1(N2CC(C)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CNC(=O)C1(N2C[C@@H](C(C)C)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3cccc(Oc4c(C)n[nH]c4C)c3)C3CCCCC3)cc2C1
COCC1(N2CC(C)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
COc1ccc(CNC(=O)C2(N3C[C@@H](C(C)C)NC3=O)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)cc1
CC1CN(C2Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CC(C)[C@@H]1CN(C2(C(=O)Nc3ccccc3)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CNC(=O)C1Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)C(NC(=O)c3ccnn3C)C3CCC(C(C)C)CC3)cc2C1
CNC(=O)C1(N2CC(C)NC2=O)Cc2cc3nc([C@@H](NC(=O)c4ccnn4C)C4CCCCC4)[nH]c3cc2C1
N#Cc1cccc(C(=O)N[C@H](C(=O)Nc2ccc3c(c2)CC(C(=O)NC)(N2CC4(CC4)CNC2=O)C3)C2CCCCC2)c1
CNC(=O)C1(N2CC(C)NC2=O)COc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2OC1
CCn1nccc1C(=O)N[C@H](C(=O)Nc1ccc2c(c1)CC(C(=O)NC)(N1CC3(CC3)CNC1=O)C2)C1CCCCC1
CNC(=O)C1(N2CC(C)NC2=O)CCc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2CC1
CC(C)[C@@H]1CN(C2(C(=O)NC34CC5CC(CC(C5)C3)C4)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CNC(=O)C1(N2CC(C)NC2=O)CCc2cc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)ccc21
COCC1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CNC(=O)C1(N2CC(C)NC2=O)Cc2cc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)sc2C1
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccc(C#N)n3C3CC3)C3CCCCC3)cc2C1
CNC(=O)C1(N2CC(C)NC2=O)CCc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)C(F)(F)c3cccc(C#N)c3)C3CCCCC3)cc2C1
CC1CN(Cc2cc3cc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)ccc3o2)C(=O)N1
COCC1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C(C3CC3)C3CC3)cc2C1
CC1CN(Cc2cc3cc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)ccc3[nH]2)C(=O)N1
COCC1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C(C)C)C(C3CC3)C3CC3)cc2C1
CNC(=O)C1(N2CCNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
Cn1nccc1C(=O)N[C@H](C(=O)Nc1ccc2c(c1)CC(C(=O)Nc1ccccc1)(N1CC3(CC3)CNC1=O)C2)C1CCCCC1
CNC(=O)C1(N2CC(C)NC2=O)Cc2cc3nc([C@@H](NC(=O)c4nonc4C)C4CCCCC4)[nH]c3cc2C1
CC(C)[C@@H]1CN(C2Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CC1CN(C2(C(N)=O)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CC(C)[C@@H]1CN(C2(C(=O)NCc3ccccn3)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CNC(=O)C1(N2CC(C)NC2=O)Cc2ccc(NC(=O)[C@H](CC3CCCCC3)NC(=O)c3ccnn3C)cc2C1
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)C(NC(=O)c3ccnn3C)C3CCC(C(F)(F)F)CC3)cc2C1
CNC(=O)C1(N2C(=O)NCC2C)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CC[C@H]1CC[C@H]([C@H](NC(=O)c2ccnn2C)C(=O)Nc2ccc3c(c2)CC(COC)(N2CC4(CC4)CNC2=O)C3)CC1
CC[C@H]1CN(C2(C(=O)NC)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CC[C@@H]1CN(C2(C(=O)NC)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C(C4CC4)C4CC4)cc3C2)C(=O)N1
CC[C@@H]1CN(C2(C(=O)NC)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3c(F)cnn3C)C3CCCCC3)cc2C1
CNC(=O)C1(N2CC(C)(C)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)C(NC(=O)c3ccnn3C)C3CCC(CC(F)(F)F)CC3)cc2C1
CC1CN(CC2Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3O2)C(=O)N1
CC(C)[C@@H]1CN(C2(c3nc4ccccc4[nH]3)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CC1CN(C2(CO)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CC(C)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CC1CN(C2(C(=O)O)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CC[C@H]1CC[C@H]([C@H](NC(=O)c2ccnn2C)C(=O)Nc2ccc3c(c2)CC(C(=O)NC)(N2CC4(CC4)CNC2=O)C3)CC1
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CNC(=O)C1(N2CC(C(C)C)NC2=O)Cc2cc3nc([C@@H](NC(=O)c4ccnn4C)C4CCCCC4)[nH]c3cc2C1
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CCOC(=O)N[C@H](C(=O)Nc1ccc2c(c1)CC(C(=O)NC)(N1C[C@@H](C(C)C)NC1=O)C2)C1CCCCC1
CC(C)n1nccc1C(=O)N[C@H](C(=O)Nc7ccc6CC(c3nc2cccc(C(F)(F)F)c2[nH]3)(N5CC4(CC4)CNC5=O)Cc6c7)C(C8CC8)C9CC9
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CNC(=O)C1(N2CC(C(F)(F)F)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CNC(=O)C1(N2C[C@@H](C(C)C)NS2(=O)=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
Cc1nonc1C(=O)N[C@H](C(=O)Nc1ccc2c(c1)CC(C(=O)Nc1cccc(F)c1)(N1CC3(CC3)CNC1=O)C2)C1CCC(F)(F)CC1
CNC(=O)C1(N2C[C@@H](Cc3ccc(OC)cc3)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
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CCC(CC)OC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3nonc3C)C3CCC(F)(F)CC3)cc2C1
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CC(C)[C@@H]1CC(C2Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
CNC(=O)C1(N2C[C@@H](Cc3ccc(C)cc3)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
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C#CCC1CN(C2(C(=O)NC)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C(=O)N1
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CNC(=O)C1(N2C[C@@H](C(C)C)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ncnn3C)C3CCCCC3)cc2C1
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Cc1nonc1C(=O)N[C@H](C(=O)Nc1ccc2c(c1)CC(N1C[C@@H](C(F)(F)F)NC1=O)C2)C1CCCCC1
CNC(=O)C1(N2C[C@@H](C(C)C)NC2=O)Cc2ccc(NC(=O)[C@H](Cc3ccccc3)NC(=O)c3ccnn3C)cc2C1
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CNC(=O)C1(N2C[C@@H](C(C)C)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCC(F)(F)CC3)cc2C1
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CC(C)[C@@H]5CN(C4(C(=O)NCC(F)(F)F)Cc3ccc(NC(=O)[C@@H](NC(=O)c1ccnn1C)C2CCCCC2)cc3C4)C(=O)N5
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CCC1CNC(=O)N(C2(C(=O)NC)Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C)C4CCCCC4)cc3C2)C1
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CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccn(C4CC(O)C4)n3)C3CCCCC3)cc2C1
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Cc1nonc1C(=O)N[C@H](C(=O)Nc5ccc4CC(C(=O)NC2CCCC2)(N3C[C@@H](C(C)C)NC3=O)Cc4c5)C(C6CC6)C7CC7
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2cc3nc([C@@H](NC(=O)c4ccnn4C)C4CCCCC4)[nH]c3cc2C1
Cc1nonc1C(=O)N[C@H](C(=O)Nc5ccc4CC(C(=O)Nc2ccccc2C#N)(N3C[C@@H](C(C)C)NC3=O)Cc4c5)C(C6CC6)C7CC7
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3nonc3C)C3CCC(F)(F)CC3)cc2C1
Cc1nonc1C(=O)N[C@H](C(=O)Nc5ccc4CC(C(=O)Nc2ccncc2Cl)(N3C[C@@H](C(C)C)NC3=O)Cc4c5)C(C6CC6)C7CC7
CCC1CCC(C(NC(=O)c2ccnn2C)C(=O)Nc2ccc3c(c2)CC(C(=O)NC)(N2CC4(CC4)CNC2=O)C3)CC1
Cc1nonc1C(=O)N[C@H](C(=O)Nc5ccc4CC(C(=O)Nc2cncs2)(N3C[C@@H](C(C)C)NC3=O)Cc4c5)C(C6CC6)C7CC7
CNC(=O)C1(N2CC(Cc3ccc(C#N)cc3)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CC(C)[C@@H]1CN(CC2Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C(C)C)C(C4CC4)C4CC4)cc3N2)C(=O)N1
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C3CC3)C3CCCCC3)cc2C1
CC(C)[C@@H]1CN(CC2Cc3ccc(NC(=O)[C@@H](NC(=O)c4ccnn4C(C)C)C(C4CC4)C4CC4)cc3N2C)C(=O)N1
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCC(F)(F)CC3)cc2C1
CC(=N)/C(=NO)C(=O)N[C@H](C(=O)Nc1ccc2c(c1)CC(C(=O)Nc1ccccc1C(C)C)(N1C[C@@H](C(C)C)NC1=O)C2)C(C1CC1)C1CC1
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)C(NC(=O)c3ccnn3C)C3CCC(C(C)(F)F)CC3)cc2C1
CCc1ccccc1NC(=O)C1(N2C[C@@H](C(C)C)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)/C(=N/O)C(C)=N)C(C3CC3)C3CC3)cc2C1
CNC(=O)C1(N2C(=O)NC3CCC2C3)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CC(C)n1nccc1C(=O)N[C@H](C(=O)Nc5ccc4CC(C(C2CC2)N3C[C@@H](C(F)(F)F)NC3=O)Oc4c5)C(C6CC6)C7CC7
CNC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
Cn1nccc1C(=O)N[C@H](C(=O)Nc1ccc2c(c1)CC(N1C[C@@H](C(F)(F)F)NC1=O)C2)C1CCCCC1
Cn1nccc1C(=O)N[C@H](C(=O)Nc1ccc2c(c1)OCC(CN1CC(C(F)(F)F)NC1=O)C2)C1CCCCC1
CNC(=O)C1(N2CC3(CCCC3)CNC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C)C3CCCCC3)cc2C1
CNC(C(F)(F)F)C1(N2C[C@@H](C(C)C)NC2=O)Cc2ccc(NC(=O)[C@@H](NC(=O)c3nonc3C)C(C3CC3)C3CC3)cc2C1
COC(=O)C1(N2CC3(CC3)CNC2=O)Cc2ccc(NC(=O)C(NC(=O)c3ccnn3C)C3CCC(C(C)C)CC3)cc2C1
Cc1nonc1C(=O)N[C@H](C(=O)Cc4ccc3OC(CN2C[C@@H](C(F)(F)F)NC2=O)Cc3c4)C(C5CC5)C6CC6