BindingDB logo
myBDB logout

316 SMILES Strings for KiSS-1 receptor

Compound NameSMILES String
BDBM26342 CC(C)C\C(=C/[C@@H](O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:33.34,6.6,wD:12.20,44.45,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;6.76,.89,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM26343 CC(C)C\C(=C/[C@H](O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:33.34,wD:12.20,44.45,6.6,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;6.76,.89,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM26344 CC(C)C[C@@H](C[C@@H](O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:4.31,33.34,6.6,wD:12.20,44.45,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;6.76,.89,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM26345 CC(C)C[C@H](C[C@@H](O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:33.34,6.6,wD:12.20,4.31,44.45,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;6.76,.89,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM26346 CC(C)C[C@@H](C[C@H](O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:4.31,33.34,wD:12.20,44.45,6.6,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;6.76,.89,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM26347 CC(C)C[C@H](C[C@H](O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:33.34,wD:12.20,4.31,44.45,6.6,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;6.76,.89,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM26348 CC(C)C[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:33.34,4.4,wD:12.20,44.45,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;6.76,.89,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM26349 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:83.86,72.75,12.20,29.34,37.50,51.58,59.62,wD:4.4,23.26,(23.93,-21.81,;22.46,-22.29,;22.15,-23.79,;21.33,-21.26,;21.65,-19.76,;20.51,-18.74,;19.04,-19.2,;18.73,-20.72,;17.9,-18.17,;16.44,-18.65,;15.29,-17.62,;15.61,-16.12,;13.83,-18.1,;12.69,-17.06,;13.01,-15.57,;11.86,-14.54,;12.18,-13.03,;13.65,-12.55,;14.79,-13.59,;14.47,-15.08,;13.51,-19.6,;12.05,-20.08,;10.9,-19.05,;11.73,-21.57,;12.87,-22.61,;14.34,-22.12,;10.27,-22.05,;9.94,-23.55,;11.09,-24.58,;8.49,-24.03,;7.34,-23,;7.67,-21.49,;6.52,-20.46,;9.12,-21.02,;8.16,-25.53,;6.7,-26.01,;5.56,-24.98,;6.38,-27.51,;4.92,-27.99,;4.6,-29.49,;5.63,-30.63,;4.86,-31.97,;3.35,-31.65,;2.11,-32.56,;.71,-31.92,;.55,-30.4,;1.79,-29.49,;3.2,-30.12,;7.53,-28.54,;8.98,-28.07,;9.31,-26.56,;10.13,-29.1,;9.81,-30.6,;8.35,-31.08,;8.02,-32.58,;7.2,-30.05,;11.59,-28.62,;12.74,-29.65,;12.42,-31.16,;14.21,-29.18,;14.52,-27.67,;15.34,-30.2,;16.8,-29.73,;17.12,-28.22,;18.58,-27.75,;19.72,-28.77,;21.19,-28.3,;19.41,-30.28,;17.94,-30.75,;23.11,-19.28,;23.42,-17.77,;24.24,-20.31,;25.71,-19.83,;26.03,-18.32,;27.49,-17.85,;27.81,-16.34,;29.28,-15.87,;29.59,-14.36,;28.45,-13.34,;31.06,-13.9,;26.85,-20.86,;26.53,-22.37,;28.32,-20.39,;29.46,-21.42,;30.93,-20.94,;32.07,-21.97,;33.53,-21.49,;34.68,-22.52,;34.35,-24.03,;32.89,-24.5,;31.75,-23.47,;29.14,-22.92,;27.68,-23.4,;30.28,-23.95,)|
BDBM26338 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:33.34,wD:12.20,4.4,44.45,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;6.76,.89,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM26339 CC(C)C[C@H](\C=C\CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:32.33,wD:11.19,4.4,43.44,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM26340 CC(C)C[C@H](CCCNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:32.33,wD:11.19,4.4,43.44,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM26341 CC(C)C\C(=C/CCNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:32.33,wD:11.19,43.44,(10.76,-1.42,;10.76,.12,;12.1,.89,;9.43,.89,;9.43,2.43,;8.09,3.2,;6.76,2.43,;5.43,3.2,;4.09,2.43,;2.76,3.2,;2.76,4.74,;1.43,2.43,;1.43,.89,;.66,-.45,;-.87,-.66,;-1.45,-2.09,;-.5,-3.3,;1.02,-3.09,;1.6,-1.66,;.09,3.2,;-1.24,2.43,;-1.24,.89,;-2.57,3.2,;-2.57,4.74,;-3.91,5.51,;-5.24,4.74,;-6.58,5.51,;-5.24,3.2,;-3.91,2.43,;10.76,3.2,;10.76,4.74,;12.1,2.43,;13.43,3.2,;13.43,4.74,;12.1,5.51,;12.1,7.05,;10.76,7.82,;10.76,9.36,;12.1,10.13,;9.43,10.13,;14.76,2.43,;14.76,.89,;16.1,3.2,;17.43,2.43,;17.43,.89,;18.76,.12,;18.15,-1.3,;19.3,-2.32,;20.63,-1.53,;22.1,-2,;23.23,-.96,;22.9,.55,;21.43,1.01,;20.3,-.03,;18.76,3.2,;20.1,2.43,;18.76,4.74,)|
BDBM107306 CNCC(=O)N[C@@H](CC(C)C)C(C)=O |r|
BDBM107307 CNC\C=C\[C@@H](CC(C)C)C(C)=O |r|
BDBM107308 CNCCC[C@@H](CC(C)C)C(C)=O |r|
BDBM107309 CNCCC=C(CC(C)C)C(C)=O |w:4.3|
BDBM107312 CNC[C@H](O)CC(CC(C)C)C(C)=O |r|
BDBM107314 CNC[C@@H](O)CC(CC(C)C)C(C)=O |r|
BDBM107316 CNCC(=O)N[C@H](CC(C)C)C(C)=O |r|
BDBM50203817 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1cnc[nH]1)C(N)=O |wU:58.61,4.4,72.75,87.91,36.37,12.13,106.110,wD:66.69,24.24,95.99,16.16,44.45,(-20.28,-19.15,;-20.26,-20.69,;-21.58,-21.47,;-18.91,-21.43,;-18.9,-22.99,;-20.24,-23.76,;-17.57,-23.76,;-17.57,-25.3,;-16.25,-22.99,;-15.77,-21.53,;-14.22,-21.54,;-13.74,-22.99,;-14.99,-23.9,;-14.99,-25.44,;-16.34,-26.21,;-13.67,-26.22,;-13.67,-27.76,;-15,-28.52,;-15,-30.06,;-13.68,-30.84,;-16.33,-30.83,;-12.34,-28.53,;-12.34,-30.07,;-10.99,-27.76,;-9.66,-28.53,;-9.66,-30.07,;-8.33,-30.84,;-8.33,-32.38,;-7.01,-33.15,;-5.66,-32.38,;-4.33,-33.15,;-5.67,-30.83,;-6.99,-30.07,;-8.32,-27.76,;-8.32,-26.22,;-6.99,-28.53,;-5.66,-27.77,;-5.66,-26.23,;-4.32,-25.46,;-2.99,-26.23,;-4.32,-23.92,;-4.32,-28.54,;-4.33,-30.08,;-2.99,-27.77,;-1.65,-28.54,;-1.66,-30.08,;-.33,-30.85,;.93,-29.86,;2.16,-30.85,;1.68,-32.32,;2.44,-33.63,;1.68,-34.96,;.14,-34.96,;-.62,-33.63,;.15,-32.31,;-.32,-27.77,;-.32,-26.23,;1.01,-28.54,;2.35,-27.77,;2.35,-26.23,;3.68,-25.47,;5.02,-26.24,;3.68,-23.93,;3.67,-28.55,;3.67,-30.09,;5.01,-27.78,;6.34,-28.55,;6.34,-30.09,;7.68,-30.86,;7.68,-27.78,;7.68,-26.24,;9.01,-28.55,;10.34,-27.78,;10.35,-26.24,;11.68,-25.48,;13.01,-26.24,;14.35,-25.48,;14.35,-23.93,;13.01,-23.16,;11.68,-23.94,;11.68,-28.56,;11.68,-30.1,;13.01,-27.79,;14.35,-28.55,;15.68,-27.78,;15.68,-26.24,;17.01,-28.55,;18.35,-27.78,;18.35,-26.24,;19.68,-25.48,;19.68,-23.94,;21.02,-26.25,;19.68,-28.56,;19.68,-30.1,;21.02,-27.79,;22.35,-28.56,;22.35,-30.1,;23.68,-30.87,;23.68,-32.41,;25.01,-33.18,;25.01,-34.72,;26.34,-35.49,;23.68,-35.49,;23.69,-27.79,;23.69,-26.25,;25.02,-28.56,;26.35,-27.79,;26.35,-26.25,;27.69,-25.48,;29.15,-25.94,;30.05,-24.69,;29.14,-23.45,;27.67,-23.94,;27.69,-28.57,;29.02,-27.8,;27.68,-30.11,)|
BDBM50203818 NCCCn1nc(C2=C(C(=O)NC2=O)c2cn(-c3csc4ccccc34)c3ccccc23)c2ccccc12 |t:7|
BDBM50203779 CCCC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:29.34,86.91,12.20,4.4,51.58,79.82,106.110,wD:23.26,59.71,95.99,71.79,37.50,(27.31,-23.46,;25.97,-24.23,;25.97,-25.77,;24.64,-26.54,;24.64,-28.08,;23.3,-28.84,;21.97,-28.07,;21.97,-26.53,;20.64,-28.84,;19.3,-28.08,;17.97,-28.85,;17.97,-30.39,;16.63,-28.07,;16.63,-26.53,;17.97,-25.77,;19.3,-26.53,;20.64,-25.77,;20.64,-24.23,;19.29,-23.45,;17.97,-24.23,;15.3,-28.84,;13.97,-28.07,;13.97,-26.53,;12.63,-28.84,;12.63,-30.38,;13.97,-31.15,;11.3,-28.07,;9.96,-28.84,;9.96,-30.38,;8.63,-28.07,;8.64,-26.53,;9.97,-25.76,;11.3,-26.53,;9.97,-24.22,;7.3,-28.83,;5.96,-28.06,;5.97,-26.52,;4.63,-28.83,;4.63,-30.37,;5.95,-31.14,;7.22,-30.15,;8.45,-31.14,;7.97,-32.61,;8.73,-33.92,;7.97,-35.25,;6.43,-35.25,;5.67,-33.92,;6.44,-32.6,;3.3,-28.06,;1.96,-28.83,;1.96,-30.37,;.63,-28.06,;.63,-26.52,;1.97,-25.75,;3.3,-26.52,;1.97,-24.21,;-.7,-28.82,;-2.03,-28.05,;-2.03,-26.51,;-3.37,-28.82,;-3.38,-30.36,;-2.04,-31.13,;-2.05,-32.67,;-.72,-33.44,;.62,-32.67,;1.95,-33.44,;.62,-31.12,;-.71,-30.36,;-4.7,-28.05,;-6.04,-28.82,;-6.04,-30.36,;-7.37,-28.05,;-8.7,-28.82,;-8.7,-30.36,;-7.38,-31.13,;-10.04,-31.12,;-7.37,-26.51,;-8.7,-25.74,;-10.04,-26.5,;-8.7,-24.2,;-7.45,-23.28,;-7.93,-21.83,;-9.46,-21.83,;-9.94,-23.29,;-11.27,-24.05,;-11.27,-25.59,;-12.61,-23.28,;-13.95,-24.05,;-12.62,-21.72,;-13.97,-20.98,;-13.99,-19.44,;-15.3,-21.76,;25.97,-28.85,;25.97,-30.39,;27.31,-28.08,;28.64,-28.85,;28.63,-30.39,;29.97,-31.16,;29.97,-32.7,;31.3,-33.47,;31.3,-35.01,;32.63,-35.79,;29.97,-35.78,;29.98,-28.08,;29.98,-26.54,;31.31,-28.85,;32.64,-28.09,;32.64,-26.55,;33.98,-25.78,;35.3,-26.56,;36.64,-25.79,;36.64,-24.25,;35.3,-23.48,;33.97,-24.25,;33.97,-28.86,;35.31,-28.09,;33.97,-30.4,)|
BDBM50203780 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,87.92,36.37,12.13,103.107,wD:66.69,24.24,92.96,16.16,44.45,(-9.16,-19.13,;-9.14,-20.67,;-10.46,-21.46,;-7.79,-21.41,;-7.79,-22.97,;-9.12,-23.74,;-6.45,-23.74,;-6.45,-25.28,;-5.12,-22.97,;-4.64,-21.51,;-3.1,-21.52,;-2.63,-22.98,;-3.88,-23.89,;-3.88,-25.43,;-5.22,-26.19,;-2.55,-26.2,;-2.55,-27.74,;-3.88,-28.51,;-3.89,-30.05,;-2.55,-30.82,;-5.22,-30.82,;-1.22,-28.51,;-1.22,-30.05,;.12,-27.74,;1.45,-28.51,;1.45,-30.05,;2.78,-30.82,;2.77,-32.36,;4.11,-33.13,;5.44,-32.36,;6.78,-33.13,;5.44,-30.81,;4.12,-30.06,;2.78,-27.74,;2.79,-26.2,;4.12,-28.51,;5.45,-27.75,;5.45,-26.21,;6.79,-25.44,;8.12,-26.21,;6.79,-23.9,;6.78,-28.52,;6.78,-30.06,;8.12,-27.75,;9.45,-28.52,;9.45,-30.06,;10.78,-30.83,;12.03,-29.84,;13.27,-30.83,;12.79,-32.3,;13.55,-33.62,;12.79,-34.94,;11.25,-34.94,;10.49,-33.61,;11.26,-32.29,;10.79,-27.75,;10.79,-26.21,;12.12,-28.52,;13.45,-27.75,;13.46,-26.21,;14.79,-25.45,;16.12,-26.22,;14.79,-23.91,;14.79,-28.53,;14.79,-30.07,;16.12,-27.76,;17.45,-28.53,;17.45,-30.07,;16.12,-30.84,;18.79,-27.76,;18.79,-26.22,;20.12,-28.53,;21.46,-27.76,;21.46,-26.22,;22.79,-25.45,;24.12,-26.23,;25.46,-25.46,;25.46,-23.92,;24.12,-23.15,;22.79,-23.92,;22.79,-28.53,;22.79,-30.07,;24.12,-27.77,;25.46,-28.54,;26.79,-27.77,;26.79,-26.23,;28.12,-28.54,;29.46,-27.77,;29.46,-26.23,;30.79,-28.54,;30.79,-30.08,;32.13,-27.77,;33.46,-28.55,;33.46,-30.09,;34.79,-30.86,;34.79,-32.4,;36.12,-33.17,;36.12,-34.71,;37.45,-35.48,;34.79,-35.48,;34.79,-27.78,;34.79,-26.24,;36.13,-28.55,;37.46,-27.78,;37.46,-26.24,;38.8,-25.47,;40.13,-26.25,;41.46,-25.49,;41.46,-23.94,;40.12,-23.17,;38.79,-23.94,;38.79,-28.55,;40.13,-27.78,;38.79,-30.09,)|
BDBM50203781 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,71.74,86.90,36.37,12.13,105.109,wD:66.70,24.24,94.98,16.16,44.45,(-10.05,-20.48,;-10.03,-22.02,;-11.35,-22.81,;-8.68,-22.76,;-8.68,-24.32,;-10.01,-25.09,;-7.34,-25.09,;-7.34,-26.63,;-6.01,-24.33,;-5.53,-22.87,;-3.99,-22.87,;-3.52,-24.33,;-4.77,-25.24,;-4.77,-26.78,;-6.11,-27.55,;-3.44,-27.55,;-3.44,-29.09,;-4.77,-29.86,;-4.78,-31.4,;-3.44,-32.17,;-6.11,-32.17,;-2.11,-29.86,;-2.11,-31.4,;-.77,-29.09,;.56,-29.86,;.56,-31.4,;1.89,-32.18,;1.88,-33.71,;3.22,-34.48,;4.55,-33.71,;5.89,-34.48,;4.55,-32.17,;3.23,-31.41,;1.89,-29.1,;1.9,-27.56,;3.23,-29.87,;4.56,-29.1,;4.56,-27.56,;5.9,-26.79,;7.23,-27.56,;5.9,-25.25,;5.89,-29.87,;5.89,-31.41,;7.23,-29.1,;8.56,-29.87,;8.56,-31.41,;9.89,-32.18,;11.14,-31.19,;12.38,-32.18,;11.9,-33.65,;12.66,-34.97,;11.9,-36.29,;10.36,-36.29,;9.6,-34.96,;10.37,-33.64,;9.9,-29.1,;9.9,-27.56,;11.23,-29.88,;12.56,-29.11,;12.57,-27.57,;13.9,-26.8,;15.23,-27.57,;13.9,-25.26,;13.9,-29.88,;13.9,-31.42,;15.23,-29.11,;16.56,-29.88,;16.56,-31.42,;17.9,-29.11,;17.9,-27.57,;19.23,-29.88,;20.57,-29.12,;20.57,-27.58,;21.9,-26.81,;23.23,-27.58,;24.57,-26.82,;24.57,-25.27,;23.23,-24.5,;21.9,-25.27,;21.9,-29.89,;21.9,-31.43,;23.23,-29.12,;24.57,-29.89,;25.9,-29.12,;25.9,-27.58,;27.23,-29.89,;28.57,-29.12,;28.57,-27.58,;29.9,-26.82,;29.91,-25.28,;31.24,-27.59,;29.9,-29.9,;29.9,-31.44,;31.24,-29.13,;32.57,-29.9,;32.57,-31.44,;33.9,-32.21,;33.9,-33.75,;35.23,-34.52,;35.23,-36.06,;36.56,-36.83,;33.9,-36.83,;33.9,-29.13,;33.91,-27.59,;35.24,-29.9,;36.57,-29.13,;36.57,-27.59,;37.91,-26.82,;39.24,-27.6,;40.57,-26.84,;40.57,-25.3,;39.23,-24.52,;37.9,-25.3,;37.9,-29.9,;39.24,-29.13,;37.9,-31.44,)|
BDBM50203782 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:72.75,87.91,36.37,12.13,106.110,58.61,4.4,wD:66.69,24.24,95.99,16.16,44.45,(-6.95,-18.11,;-6.92,-19.65,;-8.24,-20.44,;-5.57,-20.4,;-5.57,-21.96,;-6.9,-22.73,;-4.23,-22.73,;-4.23,-24.27,;-2.9,-21.96,;-2.42,-20.5,;-.89,-20.5,;-.41,-21.96,;-1.66,-22.87,;-1.66,-24.41,;-3,-25.18,;-.33,-25.18,;-.33,-26.72,;-1.66,-27.49,;-1.66,-29.03,;-.33,-29.8,;-3,-29.8,;1,-27.49,;1,-29.03,;2.34,-26.72,;3.67,-27.5,;3.67,-29.04,;5,-29.81,;5,-31.34,;6.32,-32.11,;7.67,-31.35,;9,-32.12,;7.66,-29.8,;6.34,-29.04,;5.01,-26.73,;5.01,-25.19,;6.34,-27.5,;7.67,-26.73,;7.67,-25.19,;9.01,-24.42,;10.34,-25.19,;9.01,-22.88,;9.01,-27.5,;9,-29.04,;10.34,-26.73,;11.67,-27.5,;11.67,-29.04,;13,-29.81,;14.26,-28.82,;15.49,-29.81,;15.01,-31.28,;15.77,-32.6,;15.01,-33.92,;13.47,-33.92,;12.71,-32.59,;13.48,-31.27,;13.01,-26.74,;13.01,-25.2,;14.34,-27.51,;15.67,-26.74,;15.68,-25.2,;17.01,-24.43,;18.35,-25.2,;17.01,-22.89,;17,-27.51,;17,-29.05,;18.34,-26.74,;19.67,-27.51,;19.67,-29.05,;21.01,-29.83,;21.01,-26.75,;21.01,-25.21,;22.34,-27.52,;23.67,-26.75,;23.67,-25.21,;25.01,-24.44,;26.34,-25.21,;27.68,-24.44,;27.68,-22.9,;26.33,-22.13,;25.01,-22.9,;25.01,-27.52,;25.01,-29.06,;26.34,-26.75,;27.68,-27.51,;29.01,-26.75,;29.01,-25.21,;30.34,-27.52,;31.68,-26.75,;31.68,-25.21,;33.01,-24.44,;33.01,-22.9,;34.35,-25.21,;33.01,-27.52,;33.01,-29.06,;34.35,-26.75,;35.68,-27.52,;35.68,-29.06,;37.01,-29.84,;37.01,-31.38,;38.34,-32.15,;38.34,-33.69,;39.67,-34.46,;37.01,-34.46,;37.02,-26.76,;37.02,-25.22,;38.35,-27.53,;39.68,-26.76,;39.68,-25.22,;41.02,-24.45,;42.48,-24.95,;43.41,-23.72,;42.52,-22.45,;42.87,-20.96,;41.75,-19.9,;40.27,-20.36,;39.93,-21.85,;41.05,-22.9,;41.02,-27.53,;42.35,-26.76,;41.01,-29.07,)|
BDBM50203783 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:83.87,58.61,4.4,72.75,36.37,12.13,102.106,wD:91.95,66.69,24.24,16.16,44.45,(-20.28,-19.15,;-20.26,-20.69,;-21.58,-21.47,;-18.91,-21.43,;-18.9,-22.99,;-20.24,-23.76,;-17.57,-23.76,;-17.57,-25.3,;-16.25,-22.99,;-15.77,-21.53,;-14.22,-21.54,;-13.74,-22.99,;-14.99,-23.9,;-14.99,-25.44,;-16.34,-26.21,;-13.67,-26.22,;-13.67,-27.76,;-15,-28.52,;-15,-30.06,;-13.68,-30.84,;-16.33,-30.83,;-12.34,-28.53,;-12.34,-30.07,;-10.99,-27.76,;-9.66,-28.53,;-9.66,-30.07,;-8.33,-30.84,;-8.33,-32.38,;-7.01,-33.15,;-5.66,-32.38,;-4.33,-33.15,;-5.67,-30.83,;-6.99,-30.07,;-8.32,-27.76,;-8.32,-26.22,;-6.99,-28.53,;-5.66,-27.77,;-5.66,-26.23,;-4.32,-25.46,;-2.99,-26.23,;-4.32,-23.92,;-4.32,-28.54,;-4.33,-30.08,;-2.99,-27.77,;-1.65,-28.54,;-1.66,-30.08,;-.33,-30.85,;.93,-29.86,;2.16,-30.85,;1.68,-32.32,;2.44,-33.63,;1.68,-34.96,;.14,-34.96,;-.62,-33.63,;.15,-32.31,;-.32,-27.77,;-.32,-26.23,;1.01,-28.54,;2.35,-27.77,;2.35,-26.23,;3.68,-25.47,;5.02,-26.24,;3.68,-23.93,;3.67,-28.55,;3.67,-30.09,;5.01,-27.78,;6.34,-28.55,;6.34,-30.09,;7.68,-30.86,;7.68,-27.78,;7.68,-26.24,;9.01,-28.55,;10.34,-27.78,;10.35,-26.24,;11.68,-25.48,;13,-26.26,;14.34,-25.5,;14.35,-23.96,;13.01,-23.18,;11.68,-23.94,;11.68,-28.56,;11.68,-30.1,;13,-27.79,;14.33,-28.59,;15.67,-27.84,;16.99,-28.63,;18.34,-27.88,;16.97,-30.17,;14.3,-30.13,;12.95,-30.87,;15.62,-30.92,;15.59,-32.46,;14.25,-33.21,;14.22,-34.75,;12.88,-35.5,;12.85,-37.03,;11.5,-37.78,;11.48,-39.32,;10.18,-36.99,;16.92,-33.26,;18.26,-32.51,;16.89,-34.79,;18.21,-35.58,;19.55,-34.83,;20.87,-35.63,;20.84,-37.16,;22.16,-37.95,;23.51,-37.21,;23.53,-35.66,;22.21,-34.87,;18.18,-37.13,;19.5,-37.91,;16.84,-37.87,)|
BDBM50203784 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(N)=O)C(N)=O |wU:58.61,4.4,72.75,87.91,36.37,12.13,106.110,wD:66.69,24.24,95.99,16.16,44.45,(-20.28,-19.15,;-20.26,-20.69,;-21.58,-21.47,;-18.91,-21.43,;-18.9,-22.99,;-20.24,-23.76,;-17.57,-23.76,;-17.57,-25.3,;-16.25,-22.99,;-15.77,-21.53,;-14.22,-21.54,;-13.74,-22.99,;-14.99,-23.9,;-14.99,-25.44,;-16.34,-26.21,;-13.67,-26.22,;-13.67,-27.76,;-15,-28.52,;-15,-30.06,;-13.68,-30.84,;-16.33,-30.83,;-12.34,-28.53,;-12.34,-30.07,;-10.99,-27.76,;-9.66,-28.53,;-9.66,-30.07,;-8.33,-30.84,;-8.33,-32.38,;-7.01,-33.15,;-5.66,-32.38,;-4.33,-33.15,;-5.67,-30.83,;-6.99,-30.07,;-8.32,-27.76,;-8.32,-26.22,;-6.99,-28.53,;-5.66,-27.77,;-5.66,-26.23,;-4.32,-25.46,;-2.99,-26.23,;-4.32,-23.92,;-4.32,-28.54,;-4.33,-30.08,;-2.99,-27.77,;-1.65,-28.54,;-1.66,-30.08,;-.33,-30.85,;.93,-29.86,;2.16,-30.85,;1.68,-32.32,;2.44,-33.63,;1.68,-34.96,;.14,-34.96,;-.62,-33.63,;.15,-32.31,;-.32,-27.77,;-.32,-26.23,;1.01,-28.54,;2.35,-27.77,;2.35,-26.23,;3.68,-25.47,;5.02,-26.24,;3.68,-23.93,;3.67,-28.55,;3.67,-30.09,;5.01,-27.78,;6.34,-28.55,;6.34,-30.09,;7.68,-30.86,;7.68,-27.78,;7.68,-26.24,;9.01,-28.55,;10.34,-27.78,;10.35,-26.24,;11.68,-25.48,;13.01,-26.24,;14.35,-25.48,;14.35,-23.93,;13.01,-23.16,;11.68,-23.94,;11.68,-28.56,;11.68,-30.1,;13.01,-27.79,;14.35,-28.55,;15.68,-27.78,;15.68,-26.24,;17.01,-28.55,;18.35,-27.78,;18.35,-26.24,;19.68,-25.48,;19.68,-23.94,;21.02,-26.25,;19.68,-28.56,;19.68,-30.1,;21.02,-27.79,;22.35,-28.56,;22.35,-30.1,;23.68,-30.87,;23.68,-32.41,;25.01,-33.18,;25.01,-34.72,;26.34,-35.49,;23.68,-35.49,;23.69,-27.79,;23.69,-26.25,;25.02,-28.56,;26.35,-27.79,;26.35,-26.25,;27.69,-25.48,;27.68,-23.95,;26.34,-23.19,;29.01,-23.17,;27.69,-28.57,;29.02,-27.8,;27.68,-30.11,)|
BDBM50203785 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(N)=O |wU:58.61,4.4,72.75,87.91,36.37,12.13,106.111,wD:66.69,24.24,95.99,16.16,44.45,(-9.14,-21.26,;-9.11,-22.8,;-10.43,-23.59,;-7.77,-23.54,;-7.76,-25.1,;-9.09,-25.87,;-6.43,-25.87,;-6.43,-27.41,;-5.1,-25.1,;-4.61,-23.64,;-3.08,-23.65,;-2.6,-25.11,;-3.85,-26.02,;-3.86,-27.56,;-5.19,-28.33,;-2.52,-28.33,;-2.52,-29.87,;-3.86,-30.64,;-3.86,-32.18,;-2.53,-32.95,;-5.2,-32.95,;-1.19,-30.64,;-1.19,-32.18,;.14,-29.87,;1.48,-30.64,;1.47,-32.18,;2.81,-32.95,;2.8,-34.49,;4.13,-35.26,;5.47,-34.49,;6.8,-35.26,;5.46,-32.95,;4.14,-32.19,;2.81,-29.87,;2.81,-28.33,;4.14,-30.65,;5.48,-29.88,;5.48,-28.34,;6.81,-27.57,;8.15,-28.34,;6.82,-26.03,;6.81,-30.65,;6.81,-32.19,;8.14,-29.88,;9.48,-30.65,;9.48,-32.19,;10.8,-32.96,;12.06,-31.97,;13.29,-32.96,;12.82,-34.43,;13.58,-35.75,;12.82,-37.07,;11.28,-37.07,;10.52,-35.74,;11.28,-34.42,;10.81,-29.88,;10.81,-28.34,;12.15,-30.65,;13.48,-29.89,;13.48,-28.35,;14.82,-27.58,;16.15,-28.35,;14.82,-26.04,;14.81,-30.66,;14.81,-32.2,;16.15,-29.89,;17.48,-30.66,;17.48,-32.2,;18.81,-32.97,;18.81,-29.89,;18.82,-28.35,;20.15,-30.66,;21.48,-29.89,;21.48,-28.35,;22.82,-27.59,;24.15,-28.36,;25.48,-27.59,;25.49,-26.05,;24.14,-25.28,;22.81,-26.05,;22.81,-30.67,;22.81,-32.21,;24.15,-29.9,;25.48,-30.67,;26.82,-29.9,;26.82,-28.36,;28.15,-30.67,;29.48,-29.9,;29.49,-28.36,;30.82,-27.59,;30.82,-26.05,;32.15,-28.36,;30.82,-30.67,;30.82,-32.21,;32.15,-29.91,;33.48,-30.68,;33.48,-32.22,;34.82,-32.99,;34.81,-34.53,;36.15,-35.3,;36.15,-36.84,;37.48,-37.61,;34.81,-37.61,;34.82,-29.91,;34.82,-28.37,;36.15,-30.68,;37.49,-29.91,;37.49,-28.37,;38.82,-30.68,;40.15,-29.91,;38.82,-32.22,)|
BDBM50203786 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,86.90,36.37,12.13,105.109,wD:66.69,24.24,94.98,16.16,44.45,(-5.72,-19.26,;-5.69,-20.8,;-7.02,-21.58,;-4.35,-21.54,;-4.34,-23.1,;-5.68,-23.87,;-3.01,-23.87,;-3.01,-25.41,;-1.68,-23.11,;-1.2,-21.65,;.34,-21.65,;.82,-23.1,;-.43,-24.02,;-.43,-25.56,;-1.77,-26.32,;.9,-26.33,;.89,-27.87,;-.44,-28.64,;-.44,-30.18,;.89,-30.95,;-1.78,-30.94,;2.22,-28.64,;2.22,-30.18,;3.56,-27.87,;4.89,-28.64,;4.89,-30.18,;6.23,-30.95,;6.22,-32.49,;7.55,-33.26,;8.89,-32.49,;10.22,-33.26,;8.88,-30.94,;7.56,-30.18,;6.23,-27.87,;6.23,-26.33,;7.56,-28.64,;8.89,-27.88,;8.89,-26.34,;10.23,-25.57,;11.56,-26.34,;10.23,-24.03,;10.23,-28.65,;10.23,-30.19,;11.56,-27.88,;12.9,-28.65,;12.9,-30.19,;14.22,-30.96,;15.48,-29.97,;16.71,-30.96,;16.24,-32.43,;17,-33.74,;16.24,-35.07,;14.7,-35.07,;13.94,-33.74,;14.71,-32.42,;14.23,-27.88,;14.23,-26.34,;15.57,-28.65,;16.9,-27.89,;16.9,-26.35,;18.23,-25.58,;19.57,-26.35,;18.23,-24.04,;18.23,-28.66,;18.23,-30.2,;19.57,-27.89,;20.9,-28.66,;20.89,-30.2,;22.23,-30.97,;22.24,-27.89,;22.24,-26.35,;23.57,-28.66,;24.9,-27.9,;24.9,-26.36,;26.24,-25.59,;27.7,-26.07,;28.62,-24.82,;27.72,-23.57,;26.24,-24.03,;26.23,-28.67,;26.23,-30.21,;27.57,-27.9,;28.9,-28.66,;30.23,-27.89,;30.24,-26.35,;31.56,-28.66,;32.9,-27.9,;32.9,-26.36,;34.24,-25.59,;34.24,-24.05,;35.57,-26.36,;34.23,-28.67,;34.23,-30.21,;35.57,-27.9,;36.9,-28.67,;36.9,-30.21,;38.24,-30.98,;38.24,-32.52,;39.56,-33.29,;39.56,-34.83,;40.89,-35.61,;38.23,-35.6,;38.24,-27.9,;38.24,-26.36,;39.57,-28.67,;40.9,-27.91,;40.9,-26.37,;42.24,-25.6,;43.57,-26.38,;44.91,-25.61,;44.91,-24.07,;43.56,-23.3,;42.24,-24.07,;42.24,-28.68,;43.57,-27.91,;42.24,-30.22,)|
BDBM50203787 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:4.4,58.62,69.72,84.88,36.37,12.13,103.107,wD:63.66,24.24,92.96,16.16,44.45,(-9.93,-20.42,;-9.9,-21.96,;-11.22,-22.75,;-8.55,-22.7,;-8.55,-24.26,;-9.88,-25.03,;-7.21,-25.03,;-7.21,-26.57,;-5.88,-24.27,;-5.4,-22.81,;-3.86,-22.81,;-3.39,-24.27,;-4.64,-25.18,;-4.64,-26.72,;-5.98,-27.49,;-3.31,-27.49,;-3.31,-29.03,;-4.65,-29.8,;-4.65,-31.34,;-3.32,-32.11,;-5.98,-32.11,;-1.98,-29.8,;-1.98,-31.34,;-.64,-29.03,;.69,-29.8,;.69,-31.34,;2.02,-32.12,;2.01,-33.65,;3.34,-34.42,;4.68,-33.65,;6.01,-34.42,;4.68,-32.11,;3.35,-31.35,;2.02,-29.04,;2.02,-27.5,;3.36,-29.81,;4.69,-29.04,;4.69,-27.5,;6.03,-26.73,;7.36,-27.5,;6.03,-25.19,;6.02,-29.81,;6.02,-31.35,;7.36,-29.04,;8.69,-29.81,;8.69,-31.35,;10.02,-32.12,;11.27,-31.13,;12.51,-32.12,;12.03,-33.59,;12.79,-34.91,;12.03,-36.23,;10.49,-36.23,;9.73,-34.9,;10.5,-33.58,;10.03,-29.04,;10.03,-27.5,;11.36,-29.82,;12.69,-29.05,;12.69,-27.51,;14.03,-29.82,;14.02,-31.36,;15.36,-29.05,;16.69,-29.82,;16.69,-31.36,;18.02,-32.13,;18.03,-29.05,;18.03,-27.51,;19.36,-29.82,;20.69,-29.06,;20.7,-27.52,;22.03,-26.75,;23.36,-27.52,;24.7,-26.76,;24.7,-25.21,;23.36,-24.44,;22.03,-25.21,;22.03,-29.83,;22.03,-31.37,;23.36,-29.06,;24.7,-29.83,;26.03,-29.06,;26.03,-27.52,;27.36,-29.83,;28.7,-29.06,;28.7,-27.52,;30.03,-26.76,;30.03,-25.22,;31.37,-27.53,;30.03,-29.84,;30.03,-31.38,;31.36,-29.07,;32.7,-29.84,;32.7,-31.38,;34.03,-32.15,;34.03,-33.69,;35.36,-34.46,;35.36,-36,;36.69,-36.77,;34.02,-36.77,;34.03,-29.07,;34.03,-27.53,;35.36,-29.84,;36.7,-29.07,;36.7,-27.53,;38.04,-26.76,;39.36,-27.54,;40.7,-26.78,;40.7,-25.24,;39.36,-24.46,;38.03,-25.24,;38.03,-29.84,;39.37,-29.08,;38.03,-31.38,)|
BDBM50203788 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,87.90,36.37,12.13,106.109,wD:66.69,24.24,95.98,16.16,44.45,(-5.72,-19.26,;-5.69,-20.8,;-7.02,-21.58,;-4.35,-21.54,;-4.34,-23.1,;-5.68,-23.87,;-3.01,-23.87,;-3.01,-25.41,;-1.68,-23.11,;-1.2,-21.65,;.34,-21.65,;.82,-23.1,;-.43,-24.02,;-.43,-25.56,;-1.77,-26.32,;.9,-26.33,;.89,-27.87,;-.44,-28.64,;-.44,-30.18,;.89,-30.95,;-1.78,-30.94,;2.22,-28.64,;2.22,-30.18,;3.56,-27.87,;4.89,-28.64,;4.89,-30.18,;6.23,-30.95,;6.22,-32.49,;7.55,-33.26,;8.89,-32.49,;10.22,-33.26,;8.88,-30.94,;7.56,-30.18,;6.23,-27.87,;6.23,-26.33,;7.56,-28.64,;8.89,-27.88,;8.89,-26.34,;10.23,-25.57,;11.56,-26.34,;10.23,-24.03,;10.23,-28.65,;10.23,-30.19,;11.56,-27.88,;12.9,-28.65,;12.9,-30.19,;14.22,-30.96,;15.48,-29.97,;16.71,-30.96,;16.24,-32.43,;17,-33.74,;16.24,-35.07,;14.7,-35.07,;13.94,-33.74,;14.71,-32.42,;14.23,-27.88,;14.23,-26.34,;15.57,-28.65,;16.9,-27.89,;16.9,-26.35,;18.23,-25.58,;19.57,-26.35,;18.23,-24.04,;18.23,-28.66,;18.23,-30.2,;19.57,-27.89,;20.9,-28.66,;20.89,-30.2,;22.23,-30.97,;22.24,-27.89,;22.24,-26.35,;23.57,-28.66,;24.9,-27.9,;24.9,-26.36,;26.24,-25.59,;26.24,-24.05,;24.9,-23.28,;24.9,-21.74,;23.56,-20.97,;26.23,-20.97,;26.23,-28.67,;26.23,-30.21,;27.57,-27.9,;28.9,-28.66,;30.23,-27.89,;30.24,-26.35,;31.56,-28.66,;32.9,-27.9,;32.9,-26.36,;34.24,-25.59,;34.24,-24.05,;35.57,-26.36,;34.23,-28.67,;34.23,-30.21,;35.57,-27.9,;36.9,-28.67,;36.9,-30.21,;38.24,-30.98,;38.24,-32.52,;39.56,-33.29,;39.56,-34.83,;40.89,-35.61,;38.23,-35.6,;38.24,-27.9,;38.24,-26.36,;39.57,-28.67,;40.9,-27.91,;40.9,-26.37,;42.24,-25.6,;43.57,-26.38,;44.91,-25.61,;44.91,-24.07,;43.56,-23.3,;42.24,-24.07,;42.24,-28.68,;43.57,-27.91,;42.24,-30.22,)|
BDBM50203789 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,88.92,36.37,12.13,107.111,wD:66.69,24.24,96.100,16.16,44.45,(-5.72,-19.26,;-5.69,-20.8,;-7.02,-21.58,;-4.35,-21.54,;-4.34,-23.1,;-5.68,-23.87,;-3.01,-23.87,;-3.01,-25.41,;-1.68,-23.11,;-1.2,-21.65,;.34,-21.65,;.82,-23.1,;-.43,-24.02,;-.43,-25.56,;-1.77,-26.32,;.9,-26.33,;.89,-27.87,;-.44,-28.64,;-.44,-30.18,;.89,-30.95,;-1.78,-30.94,;2.22,-28.64,;2.22,-30.18,;3.56,-27.87,;4.89,-28.64,;4.89,-30.18,;6.23,-30.95,;6.22,-32.49,;7.55,-33.26,;8.89,-32.49,;10.22,-33.26,;8.88,-30.94,;7.56,-30.18,;6.23,-27.87,;6.23,-26.33,;7.56,-28.64,;8.89,-27.88,;8.89,-26.34,;10.23,-25.57,;11.56,-26.34,;10.23,-24.03,;10.23,-28.65,;10.23,-30.19,;11.56,-27.88,;12.9,-28.65,;12.9,-30.19,;14.22,-30.96,;15.48,-29.97,;16.71,-30.96,;16.24,-32.43,;17,-33.74,;16.24,-35.07,;14.7,-35.07,;13.94,-33.74,;14.71,-32.42,;14.23,-27.88,;14.23,-26.34,;15.57,-28.65,;16.9,-27.89,;16.9,-26.35,;18.23,-25.58,;19.57,-26.35,;18.23,-24.04,;18.23,-28.66,;18.23,-30.2,;19.57,-27.89,;20.9,-28.66,;20.89,-30.2,;22.23,-30.97,;22.24,-27.89,;22.24,-26.35,;23.57,-28.66,;24.9,-27.9,;24.9,-26.36,;26.24,-25.59,;27.56,-26.36,;28.9,-25.59,;28.91,-24.05,;30.24,-23.27,;27.56,-23.27,;26.23,-24.05,;26.23,-28.67,;26.23,-30.21,;27.57,-27.9,;28.9,-28.66,;30.23,-27.89,;30.24,-26.35,;31.56,-28.66,;32.9,-27.9,;32.9,-26.36,;34.24,-25.59,;34.24,-24.05,;35.57,-26.36,;34.23,-28.67,;34.23,-30.21,;35.57,-27.9,;36.9,-28.67,;36.9,-30.21,;38.24,-30.98,;38.24,-32.52,;39.56,-33.29,;39.56,-34.83,;40.89,-35.61,;38.23,-35.6,;38.24,-27.9,;38.24,-26.36,;39.57,-28.67,;40.9,-27.91,;40.9,-26.37,;42.24,-25.6,;43.57,-26.38,;44.91,-25.61,;44.91,-24.07,;43.56,-23.3,;42.24,-24.07,;42.24,-28.68,;43.57,-27.91,;42.24,-30.22,)|
BDBM50203790 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
BDBM50203791 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
BDBM50203792 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,91.95,36.37,12.13,110.114,wD:66.69,24.24,83.87,99.103,16.16,44.45,(-5.65,-20.93,;-5.62,-22.47,;-6.94,-23.26,;-4.27,-23.22,;-4.27,-24.78,;-5.6,-25.55,;-2.93,-25.55,;-2.93,-27.09,;-1.6,-24.78,;-1.12,-23.32,;.41,-23.32,;.89,-24.78,;-.36,-25.69,;-.36,-27.23,;-1.7,-28,;.97,-28,;.97,-29.54,;-.36,-30.31,;-.36,-31.85,;.97,-32.62,;-1.7,-32.62,;2.3,-30.32,;2.3,-31.86,;3.64,-29.55,;4.97,-30.32,;4.97,-31.86,;6.3,-32.63,;6.3,-34.17,;7.62,-34.94,;8.97,-34.17,;10.3,-34.94,;8.96,-32.62,;7.64,-31.86,;6.31,-29.55,;6.31,-28.01,;7.64,-30.32,;8.97,-29.55,;8.97,-28.01,;10.31,-27.24,;11.64,-28.02,;10.31,-25.7,;10.31,-30.33,;10.3,-31.87,;11.64,-29.56,;12.98,-30.33,;12.97,-31.87,;14.3,-32.64,;15.56,-31.64,;16.79,-32.64,;16.31,-34.1,;17.07,-35.42,;16.31,-36.75,;14.77,-36.75,;14.01,-35.41,;14.78,-34.1,;14.31,-29.56,;14.31,-28.02,;15.64,-30.33,;16.98,-29.56,;16.98,-28.02,;18.31,-27.25,;19.65,-28.03,;18.31,-25.71,;18.3,-30.33,;18.3,-31.87,;19.64,-29.57,;20.97,-30.34,;20.97,-31.88,;22.31,-32.65,;22.31,-29.57,;22.31,-28.03,;23.64,-30.34,;24.97,-29.57,;24.98,-28.03,;26.31,-27.26,;27.64,-28.03,;28.98,-27.26,;28.98,-25.72,;27.63,-24.95,;26.31,-25.72,;26.31,-30.34,;26.31,-31.88,;27.64,-29.58,;28.98,-30.34,;28.98,-31.88,;30.32,-32.64,;30.32,-34.18,;31.65,-31.87,;30.31,-29.57,;30.31,-28.03,;31.64,-30.34,;32.98,-29.57,;32.98,-28.03,;34.31,-27.26,;34.31,-25.72,;35.65,-28.04,;34.31,-30.34,;34.31,-31.88,;35.65,-29.58,;36.98,-30.35,;36.98,-31.89,;38.31,-32.66,;38.31,-34.2,;39.64,-34.97,;39.64,-36.51,;40.97,-37.28,;38.31,-37.28,;38.32,-29.58,;38.32,-28.04,;39.65,-30.35,;40.98,-29.58,;40.98,-28.04,;42.32,-27.27,;43.64,-28.06,;44.98,-27.29,;44.99,-25.75,;43.64,-24.98,;42.31,-25.75,;42.32,-30.35,;43.65,-29.59,;42.31,-31.89,)|
BDBM50203793 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
BDBM50203794 [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#7])=O
BDBM50203795 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,84.87,36.37,12.13,103.106,wD:66.69,24.24,92.95,16.16,44.45,(-5.72,-19.26,;-5.69,-20.8,;-7.02,-21.58,;-4.35,-21.54,;-4.34,-23.1,;-5.68,-23.87,;-3.01,-23.87,;-3.01,-25.41,;-1.68,-23.11,;-1.2,-21.65,;.34,-21.65,;.82,-23.1,;-.43,-24.02,;-.43,-25.56,;-1.77,-26.32,;.9,-26.33,;.89,-27.87,;-.44,-28.64,;-.44,-30.18,;.89,-30.95,;-1.78,-30.94,;2.22,-28.64,;2.22,-30.18,;3.56,-27.87,;4.89,-28.64,;4.89,-30.18,;6.23,-30.95,;6.22,-32.49,;7.55,-33.26,;8.89,-32.49,;10.22,-33.26,;8.88,-30.94,;7.56,-30.18,;6.23,-27.87,;6.23,-26.33,;7.56,-28.64,;8.89,-27.88,;8.89,-26.34,;10.23,-25.57,;11.56,-26.34,;10.23,-24.03,;10.23,-28.65,;10.23,-30.19,;11.56,-27.88,;12.9,-28.65,;12.9,-30.19,;14.22,-30.96,;15.48,-29.97,;16.71,-30.96,;16.24,-32.43,;17,-33.74,;16.24,-35.07,;14.7,-35.07,;13.94,-33.74,;14.71,-32.42,;14.23,-27.88,;14.23,-26.34,;15.57,-28.65,;16.9,-27.89,;16.9,-26.35,;18.23,-25.58,;19.57,-26.35,;18.23,-24.04,;18.23,-28.66,;18.23,-30.2,;19.57,-27.89,;20.9,-28.66,;20.89,-30.2,;22.23,-30.97,;22.24,-27.89,;22.24,-26.35,;23.57,-28.66,;24.9,-27.9,;24.9,-26.36,;26.24,-25.59,;27.56,-26.36,;26.23,-24.05,;26.23,-28.67,;26.23,-30.21,;27.57,-27.9,;28.9,-28.66,;30.23,-27.89,;30.24,-26.35,;31.56,-28.66,;32.9,-27.9,;32.9,-26.36,;34.24,-25.59,;34.24,-24.05,;35.57,-26.36,;34.23,-28.67,;34.23,-30.21,;35.57,-27.9,;36.9,-28.67,;36.9,-30.21,;38.24,-30.98,;38.24,-32.52,;39.56,-33.29,;39.56,-34.83,;40.89,-35.61,;38.23,-35.6,;38.24,-27.9,;38.24,-26.36,;39.57,-28.67,;40.9,-27.91,;40.9,-26.37,;42.24,-25.6,;43.57,-26.38,;44.91,-25.61,;44.91,-24.07,;43.56,-23.3,;42.24,-24.07,;42.24,-28.68,;43.57,-27.91,;42.24,-30.22,)|
BDBM50203796 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.76,81.84,36.37,12.13,100.103,wD:66.69,24.24,89.92,16.16,44.45,(-9.93,-20.61,;-9.9,-22.15,;-11.22,-22.94,;-8.55,-22.89,;-8.55,-24.45,;-9.88,-25.22,;-7.21,-25.22,;-7.21,-26.76,;-5.88,-24.45,;-5.4,-22.99,;-3.86,-23,;-3.39,-24.46,;-4.64,-25.37,;-4.64,-26.91,;-5.98,-27.68,;-3.31,-27.68,;-3.31,-29.22,;-4.65,-29.99,;-4.65,-31.53,;-3.32,-32.3,;-5.98,-32.3,;-1.98,-29.99,;-1.98,-31.53,;-.64,-29.22,;.69,-29.99,;.69,-31.53,;2.02,-32.3,;2.01,-33.84,;3.34,-34.61,;4.68,-33.84,;6.01,-34.61,;4.68,-32.3,;3.35,-31.54,;2.02,-29.22,;2.02,-27.68,;3.36,-30,;4.69,-29.23,;4.69,-27.69,;6.03,-26.92,;7.36,-27.69,;6.03,-25.38,;6.02,-30,;6.02,-31.54,;7.36,-29.23,;8.69,-30,;8.69,-31.54,;10.02,-32.31,;11.27,-31.32,;12.51,-32.31,;12.03,-33.78,;12.79,-35.1,;12.03,-36.42,;10.49,-36.42,;9.73,-35.09,;10.5,-33.77,;10.03,-29.23,;10.03,-27.69,;11.36,-30,;12.69,-29.23,;12.69,-27.69,;14.03,-26.93,;15.36,-27.7,;14.03,-25.39,;14.03,-30.01,;14.02,-31.55,;15.36,-29.24,;16.69,-30.01,;16.69,-31.55,;15.36,-32.32,;18.03,-29.24,;18.03,-27.7,;19.36,-30.01,;20.69,-29.24,;20.7,-27.7,;22.03,-30.01,;22.03,-31.55,;23.36,-29.25,;24.7,-30.02,;26.03,-29.25,;26.03,-27.71,;27.36,-30.02,;28.7,-29.25,;28.7,-27.71,;30.03,-26.94,;30.03,-25.4,;31.37,-27.71,;30.03,-30.02,;30.03,-31.56,;31.36,-29.25,;32.7,-30.03,;32.7,-31.57,;34.03,-32.34,;34.03,-33.88,;35.36,-34.65,;35.36,-36.19,;36.69,-36.96,;34.02,-36.96,;34.03,-29.26,;34.03,-27.72,;35.36,-30.03,;36.7,-29.26,;36.7,-27.72,;38.04,-26.95,;39.36,-27.73,;40.7,-26.97,;40.7,-25.42,;39.36,-24.65,;38.03,-25.42,;38.03,-30.03,;39.37,-29.26,;38.03,-31.57,)|
BDBM50203797 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |wU:72.75,87.91,36.37,12.13,106.110,58.61,4.4,wD:66.69,24.24,95.99,16.16,44.45,(-4.64,-18.24,;-4.61,-19.78,;-5.93,-20.57,;-3.26,-20.52,;-3.26,-22.09,;-4.59,-22.86,;-1.92,-22.86,;-1.92,-24.4,;-.59,-22.09,;-.11,-20.63,;1.42,-20.63,;1.9,-22.09,;.65,-23,;.65,-24.54,;-.69,-25.31,;1.98,-25.31,;1.98,-26.85,;.65,-27.62,;.65,-29.16,;1.98,-29.93,;-.69,-29.93,;3.31,-27.62,;3.31,-29.16,;4.65,-26.85,;5.98,-27.62,;5.98,-29.16,;7.31,-29.94,;7.31,-31.47,;8.63,-32.24,;9.98,-31.47,;11.31,-32.24,;9.97,-29.93,;8.65,-29.17,;7.32,-26.86,;7.32,-25.32,;8.65,-27.63,;9.98,-26.86,;9.98,-25.32,;11.32,-24.55,;12.65,-25.32,;11.32,-23.01,;11.32,-27.63,;11.31,-29.17,;12.65,-26.86,;13.98,-27.63,;13.98,-29.17,;15.31,-29.94,;16.57,-28.95,;17.8,-29.94,;17.32,-31.41,;18.08,-32.72,;17.32,-34.05,;15.78,-34.05,;15.02,-32.72,;15.79,-31.4,;15.32,-26.86,;15.32,-25.32,;16.65,-27.64,;17.98,-26.87,;17.99,-25.33,;19.32,-24.56,;20.66,-25.33,;19.32,-23.02,;19.31,-27.64,;19.31,-29.18,;20.65,-26.87,;21.98,-27.64,;21.98,-29.18,;23.32,-29.95,;23.32,-26.87,;23.32,-25.33,;24.65,-27.65,;25.98,-26.88,;25.98,-25.34,;27.32,-24.57,;28.65,-25.34,;29.99,-24.57,;29.99,-23.03,;28.64,-22.26,;27.32,-23.03,;27.32,-27.65,;27.32,-29.19,;28.65,-26.88,;29.99,-27.64,;31.32,-26.87,;31.32,-25.33,;32.65,-27.65,;33.99,-26.88,;33.99,-25.34,;35.32,-24.57,;35.32,-23.03,;36.66,-25.34,;35.32,-27.65,;35.32,-29.19,;36.66,-26.88,;37.99,-27.65,;37.99,-29.19,;39.32,-29.96,;39.32,-31.5,;40.65,-32.28,;40.65,-33.82,;41.98,-34.59,;39.32,-34.58,;39.33,-26.88,;39.33,-25.34,;40.66,-27.66,;41.99,-26.89,;41.99,-25.35,;43.32,-24.58,;44.65,-25.35,;45.98,-24.58,;45.99,-23.04,;47.32,-22.27,;44.65,-22.27,;43.32,-23.04,;43.33,-27.66,;44.66,-26.89,;43.32,-29.2,)|
BDBM50203798 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
BDBM50203799 CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:29.34,86.91,12.20,4.4,51.58,79.82,106.110,2.2,wD:23.26,59.71,95.99,71.79,37.50,(27.31,-26.54,;25.97,-25.77,;24.64,-26.54,;23.31,-25.76,;24.64,-28.08,;23.3,-28.84,;21.97,-28.07,;21.97,-26.53,;20.64,-28.84,;19.3,-28.08,;17.97,-28.85,;17.97,-30.39,;16.63,-28.07,;16.63,-26.53,;17.97,-25.77,;19.3,-26.53,;20.64,-25.77,;20.64,-24.23,;19.29,-23.45,;17.97,-24.23,;15.3,-28.84,;13.97,-28.07,;13.97,-26.53,;12.63,-28.84,;12.63,-30.38,;13.97,-31.15,;11.3,-28.07,;9.96,-28.84,;9.96,-30.38,;8.63,-28.07,;8.64,-26.53,;9.97,-25.76,;11.3,-26.53,;9.97,-24.22,;7.3,-28.83,;5.96,-28.06,;5.97,-26.52,;4.63,-28.83,;4.63,-30.37,;5.95,-31.14,;7.22,-30.15,;8.45,-31.14,;7.97,-32.61,;8.73,-33.92,;7.97,-35.25,;6.43,-35.25,;5.67,-33.92,;6.44,-32.6,;3.3,-28.06,;1.96,-28.83,;1.96,-30.37,;.63,-28.06,;.63,-26.52,;1.97,-25.75,;3.3,-26.52,;1.97,-24.21,;-.7,-28.82,;-2.03,-28.05,;-2.03,-26.51,;-3.37,-28.82,;-3.38,-30.36,;-2.04,-31.13,;-2.05,-32.67,;-.72,-33.44,;.62,-32.67,;1.95,-33.44,;.62,-31.12,;-.71,-30.36,;-4.7,-28.05,;-6.04,-28.82,;-6.04,-30.36,;-7.37,-28.05,;-8.7,-28.82,;-8.7,-30.36,;-7.38,-31.13,;-10.04,-31.12,;-7.37,-26.51,;-8.7,-25.74,;-10.04,-26.5,;-8.7,-24.2,;-7.45,-23.28,;-7.93,-21.83,;-9.46,-21.83,;-9.94,-23.29,;-11.27,-24.05,;-11.27,-25.59,;-12.61,-23.28,;-13.95,-24.05,;-12.62,-21.72,;-13.97,-20.98,;-13.99,-19.44,;-15.3,-21.76,;25.97,-28.85,;25.97,-30.39,;27.31,-28.08,;28.64,-28.85,;28.63,-30.39,;29.97,-31.16,;29.97,-32.7,;31.3,-33.47,;31.3,-35.01,;32.63,-35.79,;29.97,-35.78,;29.98,-28.08,;29.98,-26.54,;31.31,-28.85,;32.64,-28.09,;32.64,-26.55,;33.98,-25.78,;35.3,-26.56,;36.64,-25.79,;36.64,-24.25,;35.3,-23.48,;33.97,-24.25,;33.97,-28.86,;35.31,-28.09,;33.97,-30.4,)|
BDBM50203800 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC1CCCCC1)C(N)=O |wU:4.4,72.75,87.91,36.37,12.13,106.110,58.61,wD:66.69,24.24,95.99,16.16,44.45,(-20.28,-19.15,;-20.26,-20.69,;-21.58,-21.47,;-18.91,-21.43,;-18.9,-22.99,;-20.24,-23.76,;-17.57,-23.76,;-17.57,-25.3,;-16.25,-22.99,;-15.77,-21.53,;-14.22,-21.54,;-13.74,-22.99,;-14.99,-23.9,;-14.99,-25.44,;-16.34,-26.21,;-13.67,-26.22,;-13.67,-27.76,;-15,-28.52,;-15,-30.06,;-13.68,-30.84,;-16.33,-30.83,;-12.34,-28.53,;-12.34,-30.07,;-10.99,-27.76,;-9.66,-28.53,;-9.66,-30.07,;-8.33,-30.84,;-8.33,-32.38,;-7.01,-33.15,;-5.66,-32.38,;-4.33,-33.15,;-5.67,-30.83,;-6.99,-30.07,;-8.32,-27.76,;-8.32,-26.22,;-6.99,-28.53,;-5.66,-27.77,;-5.66,-26.23,;-4.32,-25.46,;-2.99,-26.23,;-4.32,-23.92,;-4.32,-28.54,;-4.33,-30.08,;-2.99,-27.77,;-1.65,-28.54,;-1.66,-30.08,;-.33,-30.85,;.93,-29.86,;2.16,-30.85,;1.68,-32.32,;2.44,-33.63,;1.68,-34.96,;.14,-34.96,;-.62,-33.63,;.15,-32.31,;-.32,-27.77,;-.32,-26.23,;1.01,-28.54,;2.35,-27.77,;2.35,-26.23,;3.68,-25.47,;5.02,-26.24,;3.68,-23.93,;3.67,-28.55,;3.67,-30.09,;5.01,-27.78,;6.34,-28.55,;6.34,-30.09,;7.68,-30.86,;7.68,-27.78,;7.68,-26.24,;9.01,-28.55,;10.34,-27.78,;10.35,-26.24,;11.68,-25.48,;13.01,-26.24,;14.35,-25.48,;14.35,-23.93,;13.01,-23.16,;11.68,-23.94,;11.68,-28.56,;11.68,-30.1,;13.01,-27.79,;14.35,-28.55,;15.68,-27.78,;15.68,-26.24,;17.01,-28.55,;18.35,-27.78,;18.35,-26.24,;19.68,-25.48,;19.68,-23.94,;21.02,-26.25,;19.68,-28.56,;19.68,-30.1,;21.02,-27.79,;22.35,-28.56,;22.35,-30.1,;23.68,-30.87,;23.68,-32.41,;25.01,-33.18,;25.01,-34.72,;26.34,-35.49,;23.68,-35.49,;23.69,-27.79,;23.69,-26.25,;25.02,-28.56,;26.35,-27.79,;26.35,-26.25,;27.68,-25.49,;29.01,-26.26,;30.34,-25.49,;30.35,-23.95,;29.01,-23.18,;27.68,-23.95,;27.69,-28.57,;29.02,-27.8,;27.68,-30.11,)|
BDBM50203801 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(N)=O |wU:58.61,4.4,72.76,81.84,36.37,12.13,100.104,wD:66.69,24.24,89.92,16.16,44.45,(-20.28,-19.15,;-20.26,-20.69,;-21.58,-21.47,;-18.91,-21.43,;-18.9,-22.99,;-20.24,-23.76,;-17.57,-23.76,;-17.57,-25.3,;-16.25,-22.99,;-15.77,-21.53,;-14.22,-21.54,;-13.74,-22.99,;-14.99,-23.9,;-14.99,-25.44,;-16.34,-26.21,;-13.67,-26.22,;-13.67,-27.76,;-15,-28.52,;-15,-30.06,;-13.68,-30.84,;-16.33,-30.83,;-12.34,-28.53,;-12.34,-30.07,;-10.99,-27.76,;-9.66,-28.53,;-9.66,-30.07,;-8.33,-30.84,;-8.33,-32.38,;-7.01,-33.15,;-5.66,-32.38,;-4.33,-33.15,;-5.67,-30.83,;-6.99,-30.07,;-8.32,-27.76,;-8.32,-26.22,;-6.99,-28.53,;-5.66,-27.77,;-5.66,-26.23,;-4.32,-25.46,;-2.99,-26.23,;-4.32,-23.92,;-4.32,-28.54,;-4.33,-30.08,;-2.99,-27.77,;-1.65,-28.54,;-1.66,-30.08,;-.33,-30.85,;.93,-29.86,;2.16,-30.85,;1.68,-32.32,;2.44,-33.63,;1.68,-34.96,;.14,-34.96,;-.62,-33.63,;.15,-32.31,;-.32,-27.77,;-.32,-26.23,;1.01,-28.54,;2.35,-27.77,;2.35,-26.23,;3.68,-25.47,;5.02,-26.24,;3.68,-23.93,;3.67,-28.55,;3.67,-30.09,;5.01,-27.78,;6.34,-28.55,;6.34,-30.09,;7.68,-30.86,;7.68,-27.78,;7.68,-26.24,;9.01,-28.55,;10.34,-27.78,;10.35,-26.24,;11.68,-28.56,;11.68,-30.1,;13.01,-27.79,;14.35,-28.55,;15.68,-27.78,;15.68,-26.24,;17.01,-28.55,;18.35,-27.78,;18.35,-26.24,;19.68,-25.48,;19.68,-23.94,;21.02,-26.25,;19.68,-28.56,;19.68,-30.1,;21.02,-27.79,;22.35,-28.56,;22.35,-30.1,;23.68,-30.87,;23.68,-32.41,;25.01,-33.18,;25.01,-34.72,;26.34,-35.49,;23.68,-35.49,;23.69,-27.79,;23.69,-26.25,;25.02,-28.56,;26.35,-27.79,;26.35,-26.25,;27.69,-28.57,;29.02,-27.8,;27.68,-30.11,)|
BDBM50203802 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cccnc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,87.91,36.37,12.13,106.110,wD:66.69,24.24,95.99,16.16,44.45,(-5.72,-19.26,;-5.69,-20.8,;-7.02,-21.58,;-4.35,-21.54,;-4.34,-23.1,;-5.68,-23.87,;-3.01,-23.87,;-3.01,-25.41,;-1.68,-23.11,;-1.2,-21.65,;.34,-21.65,;.82,-23.1,;-.43,-24.02,;-.43,-25.56,;-1.77,-26.32,;.9,-26.33,;.89,-27.87,;-.44,-28.64,;-.44,-30.18,;.89,-30.95,;-1.78,-30.94,;2.22,-28.64,;2.22,-30.18,;3.56,-27.87,;4.89,-28.64,;4.89,-30.18,;6.23,-30.95,;6.22,-32.49,;7.55,-33.26,;8.89,-32.49,;10.22,-33.26,;8.88,-30.94,;7.56,-30.18,;6.23,-27.87,;6.23,-26.33,;7.56,-28.64,;8.89,-27.88,;8.89,-26.34,;10.23,-25.57,;11.56,-26.34,;10.23,-24.03,;10.23,-28.65,;10.23,-30.19,;11.56,-27.88,;12.9,-28.65,;12.9,-30.19,;14.22,-30.96,;15.48,-29.97,;16.71,-30.96,;16.24,-32.43,;17,-33.74,;16.24,-35.07,;14.7,-35.07,;13.94,-33.74,;14.71,-32.42,;14.23,-27.88,;14.23,-26.34,;15.57,-28.65,;16.9,-27.89,;16.9,-26.35,;18.23,-25.58,;19.57,-26.35,;18.23,-24.04,;18.23,-28.66,;18.23,-30.2,;19.57,-27.89,;20.9,-28.66,;20.89,-30.2,;22.23,-30.97,;22.24,-27.89,;22.24,-26.35,;23.57,-28.66,;24.9,-27.9,;24.9,-26.36,;26.24,-25.59,;27.57,-26.36,;28.91,-25.6,;28.91,-24.05,;27.57,-23.27,;26.24,-24.05,;26.23,-28.67,;26.23,-30.21,;27.57,-27.9,;28.9,-28.66,;30.23,-27.89,;30.24,-26.35,;31.56,-28.66,;32.9,-27.9,;32.9,-26.36,;34.24,-25.59,;34.24,-24.05,;35.57,-26.36,;34.23,-28.67,;34.23,-30.21,;35.57,-27.9,;36.9,-28.67,;36.9,-30.21,;38.24,-30.98,;38.24,-32.52,;39.56,-33.29,;39.56,-34.83,;40.89,-35.61,;38.23,-35.6,;38.24,-27.9,;38.24,-26.36,;39.57,-28.67,;40.9,-27.91,;40.9,-26.37,;42.24,-25.6,;43.57,-26.38,;44.91,-25.61,;44.91,-24.07,;43.56,-23.3,;42.24,-24.07,;42.24,-28.68,;43.57,-27.91,;42.24,-30.22,)|
BDBM50203803 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,87.91,36.37,12.13,106.110,wD:66.69,24.24,95.99,16.16,44.45,(-13.2,3.34,;-13.16,1.8,;-14.49,1.01,;-11.81,1.05,;-11.81,-.5,;-13.14,-1.27,;-10.47,-1.27,;-10.47,-2.81,;-9.14,-.51,;-8.66,.95,;-7.12,.95,;-6.65,-.51,;-7.9,-1.42,;-7.9,-2.96,;-9.24,-3.73,;-6.57,-3.73,;-6.57,-5.27,;-7.91,-6.04,;-7.91,-7.58,;-6.57,-8.35,;-9.24,-8.35,;-5.24,-6.04,;-5.24,-7.58,;-3.9,-5.27,;-2.57,-6.04,;-2.57,-7.59,;-1.24,-8.36,;-1.25,-9.89,;.08,-10.66,;1.42,-9.9,;2.75,-10.67,;1.42,-8.35,;.09,-7.59,;-1.24,-5.28,;-1.24,-3.74,;.1,-6.05,;1.43,-5.28,;1.43,-3.74,;2.77,-2.97,;4.1,-3.74,;2.77,-1.43,;2.76,-6.05,;2.76,-7.59,;4.1,-5.28,;5.43,-6.05,;5.43,-7.59,;6.76,-8.36,;8.01,-7.37,;9.25,-8.36,;8.77,-9.83,;9.53,-11.15,;8.77,-12.47,;7.23,-12.47,;6.47,-11.14,;7.24,-9.82,;6.77,-5.28,;6.77,-3.74,;8.1,-6.06,;9.43,-5.29,;9.43,-3.75,;10.77,-2.98,;12.1,-3.75,;10.77,-1.44,;10.77,-6.06,;10.76,-7.6,;12.1,-5.29,;13.43,-6.06,;13.43,-7.6,;14.76,-8.37,;14.77,-5.29,;14.77,-3.75,;16.1,-6.06,;17.44,-5.3,;17.44,-3.76,;18.77,-2.99,;20.1,-3.76,;21.44,-3,;21.44,-1.45,;20.1,-.68,;18.77,-1.46,;18.77,-6.07,;18.77,-7.61,;20.1,-5.3,;21.44,-6.07,;22.77,-5.3,;22.77,-3.76,;24.1,-6.07,;25.44,-5.3,;25.44,-3.76,;26.77,-3,;26.78,-1.46,;28.11,-3.77,;26.77,-6.08,;26.77,-7.62,;28.1,-5.31,;29.44,-6.08,;29.44,-7.62,;30.77,-8.39,;30.77,-9.93,;32.1,-10.7,;32.1,-12.24,;33.43,-13.01,;30.76,-13.01,;30.77,-5.31,;30.77,-3.77,;32.1,-6.08,;33.44,-5.31,;33.44,-3.77,;34.78,-3,;36.1,-3.79,;37.44,-3.02,;37.44,-1.48,;36.1,-.7,;34.77,-1.48,;34.77,-6.08,;36.11,-5.32,;34.77,-7.62,)|
BDBM50203804 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O |wU:4.4,72.75,87.91,36.37,12.13,106.110,58.61,wD:66.69,24.24,95.99,16.16,44.45,(-20.28,-19.15,;-20.26,-20.69,;-21.58,-21.47,;-18.91,-21.43,;-18.9,-22.99,;-20.24,-23.76,;-17.57,-23.76,;-17.57,-25.3,;-16.25,-22.99,;-15.77,-21.53,;-14.22,-21.54,;-13.74,-22.99,;-14.99,-23.9,;-14.99,-25.44,;-16.34,-26.21,;-13.67,-26.22,;-13.67,-27.76,;-15,-28.52,;-15,-30.06,;-13.68,-30.84,;-16.33,-30.83,;-12.34,-28.53,;-12.34,-30.07,;-10.99,-27.76,;-9.66,-28.53,;-9.66,-30.07,;-8.33,-30.84,;-8.33,-32.38,;-7.01,-33.15,;-5.66,-32.38,;-4.33,-33.15,;-5.67,-30.83,;-6.99,-30.07,;-8.32,-27.76,;-8.32,-26.22,;-6.99,-28.53,;-5.66,-27.77,;-5.66,-26.23,;-4.32,-25.46,;-2.99,-26.23,;-4.32,-23.92,;-4.32,-28.54,;-4.33,-30.08,;-2.99,-27.77,;-1.65,-28.54,;-1.66,-30.08,;-.33,-30.85,;.93,-29.86,;2.16,-30.85,;1.68,-32.32,;2.44,-33.63,;1.68,-34.96,;.14,-34.96,;-.62,-33.63,;.15,-32.31,;-.32,-27.77,;-.32,-26.23,;1.01,-28.54,;2.35,-27.77,;2.35,-26.23,;3.68,-25.47,;5.02,-26.24,;3.68,-23.93,;3.67,-28.55,;3.67,-30.09,;5.01,-27.78,;6.34,-28.55,;6.34,-30.09,;7.68,-30.86,;7.68,-27.78,;7.68,-26.24,;9.01,-28.55,;10.34,-27.78,;10.35,-26.24,;11.68,-25.48,;13.01,-26.24,;14.35,-25.48,;14.35,-23.93,;13.01,-23.16,;11.68,-23.94,;11.68,-28.56,;11.68,-30.1,;13.01,-27.79,;14.35,-28.55,;15.68,-27.78,;15.68,-26.24,;17.01,-28.55,;18.35,-27.78,;18.35,-26.24,;19.68,-25.48,;19.68,-23.94,;21.02,-26.25,;19.68,-28.56,;19.68,-30.1,;21.02,-27.79,;22.35,-28.56,;22.35,-30.1,;23.68,-30.87,;23.68,-32.41,;25.01,-33.18,;25.01,-34.72,;26.34,-35.49,;23.68,-35.49,;23.69,-27.79,;23.69,-26.25,;25.02,-28.56,;26.35,-27.79,;26.35,-26.25,;27.69,-25.48,;27.68,-23.95,;26.34,-23.19,;26.33,-21.65,;25,-20.88,;27.66,-20.87,;27.69,-28.57,;29.02,-27.8,;27.68,-30.11,)|
BDBM50203805 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |wU:58.61,4.4,72.75,87.91,36.37,12.13,106.110,wD:66.69,24.24,95.99,16.16,44.45,(-15.98,-18.31,;-15.96,-19.85,;-17.29,-20.63,;-14.62,-20.59,;-14.61,-22.15,;-15.94,-22.92,;-13.27,-22.92,;-13.27,-24.46,;-11.94,-22.16,;-11.46,-20.7,;-9.92,-20.7,;-9.44,-22.15,;-10.69,-23.07,;-10.69,-24.61,;-12.03,-25.37,;-9.36,-25.38,;-9.36,-26.92,;-10.7,-27.69,;-10.7,-29.23,;-9.37,-30,;-12.04,-29.99,;-8.04,-27.69,;-8.04,-29.23,;-6.7,-26.92,;-5.37,-27.69,;-5.37,-29.23,;-4.03,-30,;-4.04,-31.54,;-2.71,-32.31,;-1.37,-31.54,;-.04,-32.31,;-1.37,-29.99,;-2.7,-29.24,;-4.03,-26.92,;-4.03,-25.38,;-2.7,-27.7,;-1.37,-26.93,;-1.36,-25.39,;-.03,-24.62,;1.3,-25.39,;-.02,-23.08,;-.03,-27.7,;-.03,-29.24,;1.3,-26.93,;2.64,-27.7,;2.64,-29.24,;3.96,-30.01,;5.22,-29.02,;6.45,-30.01,;5.98,-31.48,;6.74,-32.79,;5.98,-34.12,;4.44,-34.12,;3.68,-32.79,;4.45,-31.47,;3.97,-26.93,;3.97,-25.39,;5.31,-27.7,;6.64,-26.94,;6.64,-25.4,;7.97,-24.63,;9.31,-25.4,;7.97,-23.09,;7.97,-27.71,;7.97,-29.25,;9.31,-26.94,;10.64,-27.71,;10.64,-29.25,;11.97,-30.02,;11.98,-26.94,;11.98,-25.4,;13.31,-27.71,;14.64,-26.95,;14.64,-25.41,;15.98,-24.64,;17.31,-25.41,;18.65,-24.64,;18.65,-23.1,;17.3,-22.33,;15.98,-23.1,;15.98,-27.72,;15.97,-29.26,;17.31,-26.95,;18.65,-27.71,;19.98,-26.94,;19.98,-25.4,;21.31,-27.71,;22.64,-26.95,;22.65,-25.41,;23.98,-24.64,;23.98,-23.1,;25.32,-25.41,;23.97,-27.72,;23.97,-29.26,;25.31,-26.95,;26.64,-27.72,;26.64,-29.26,;27.98,-30.03,;27.98,-31.57,;29.31,-32.34,;29.3,-33.88,;30.63,-34.66,;27.97,-34.65,;27.98,-26.95,;27.98,-25.41,;29.31,-27.72,;30.64,-26.96,;30.64,-25.42,;31.98,-24.65,;33.31,-25.43,;34.65,-24.66,;34.65,-23.12,;33.3,-22.35,;31.98,-23.12,;31.98,-27.73,;33.31,-26.96,;31.98,-29.27,)|
BDBM50203806 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:105.110,58.61,4.4,72.75,36.37,12.13,wD:90.96,94.99,66.69,24.24,16.16,44.45,(-13.85,-15.59,;-13.83,-17.13,;-15.16,-17.91,;-12.49,-17.87,;-12.48,-19.43,;-13.81,-20.2,;-11.13,-20.2,;-11.13,-21.74,;-9.81,-19.44,;-9.33,-17.98,;-7.79,-17.98,;-7.31,-19.43,;-8.56,-20.35,;-8.56,-21.89,;-9.9,-22.65,;-7.23,-22.66,;-7.23,-24.2,;-8.57,-24.97,;-8.57,-26.51,;-7.24,-27.28,;-9.91,-27.27,;-5.91,-24.97,;-5.91,-26.51,;-4.57,-24.2,;-3.24,-24.97,;-3.24,-26.51,;-1.9,-27.28,;-1.91,-28.82,;-.58,-29.59,;.76,-28.82,;2.09,-29.59,;.76,-27.27,;-.57,-26.51,;-1.9,-24.2,;-1.9,-22.66,;-.57,-24.97,;.76,-24.21,;.77,-22.67,;2.11,-21.9,;3.43,-22.67,;2.11,-20.36,;2.1,-24.98,;2.1,-26.52,;3.43,-24.21,;4.77,-24.98,;4.77,-26.52,;6.09,-27.29,;7.35,-26.3,;8.58,-27.29,;8.11,-28.76,;8.87,-30.07,;8.11,-31.4,;6.57,-31.4,;5.81,-30.07,;6.58,-28.75,;6.1,-24.21,;6.1,-22.67,;7.44,-24.98,;8.77,-24.22,;8.77,-22.68,;10.1,-21.91,;11.44,-22.68,;10.11,-20.37,;10.1,-24.99,;10.1,-26.53,;11.44,-24.22,;12.77,-24.99,;12.77,-26.53,;14.1,-27.3,;14.11,-24.22,;14.11,-22.68,;15.44,-24.99,;16.77,-24.22,;16.77,-22.68,;18.11,-21.92,;19.44,-22.68,;20.78,-21.92,;20.78,-20.38,;19.43,-19.6,;18.11,-20.38,;18.11,-25,;18.1,-26.54,;19.44,-24.23,;20.78,-24.99,;22.11,-24.22,;22.11,-22.68,;23.44,-24.99,;23.36,-26.53,;24.8,-27.08,;25.76,-25.88,;24.93,-24.6,;25.69,-23.26,;24.91,-21.93,;27.23,-23.25,;28.01,-24.58,;27.25,-25.92,;28.03,-27.25,;27.26,-28.59,;28.04,-29.92,;27.28,-31.26,;28.05,-32.58,;25.74,-31.27,;29.55,-24.58,;30.31,-23.24,;30.33,-25.9,;31.86,-25.89,;32.63,-24.55,;34.17,-24.55,;34.94,-25.88,;36.48,-25.88,;37.24,-24.54,;36.45,-23.2,;34.92,-23.22,;32.65,-27.22,;34.18,-27.21,;31.88,-28.56,)|
BDBM50203807 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:87.92,16.16,72.75,58.61,100.104,36.37,wD:12.13,4.4,66.69,24.24,44.45,92.96,111.115,(-21.16,-38.2,;-20.07,-37.12,;-20.46,-35.63,;-18.58,-37.52,;-17.5,-36.43,;-17.89,-34.94,;-16,-36.83,;-14.92,-35.74,;-15.69,-38.34,;-16.71,-39.48,;-15.94,-40.8,;-14.44,-40.48,;-14.28,-38.96,;-12.95,-38.19,;-12.95,-36.65,;-11.48,-38.64,;-10.03,-38.11,;-10.03,-36.57,;-8.7,-35.79,;-7.37,-36.57,;-8.7,-34.26,;-8.7,-38.88,;-8.7,-40.42,;-7.47,-37.95,;-6.33,-38.98,;-6.33,-40.52,;-5,-41.29,;-3.68,-40.52,;-2.36,-41.29,;-2.36,-42.83,;-1.02,-43.6,;-3.68,-43.59,;-5,-42.82,;-5,-38.21,;-5,-36.67,;-3.67,-38.98,;-2.34,-38.21,;-2.34,-36.67,;-1.01,-35.89,;.44,-36.34,;-1.01,-34.36,;-1.01,-38.98,;-1.01,-40.52,;.22,-38.05,;1.36,-39.09,;1.36,-40.62,;2.69,-41.39,;4.17,-40.77,;5.27,-41.85,;4.37,-43.11,;4.86,-44.46,;3.82,-45.49,;2.39,-45.18,;1.95,-43.77,;2.96,-42.75,;2.69,-38.31,;2.69,-36.77,;4.02,-39.09,;5.36,-38.31,;5.36,-36.77,;6.69,-36,;8.02,-36.77,;6.69,-34.46,;6.69,-39.09,;6.69,-40.62,;7.91,-38.15,;9.06,-39.19,;9.06,-40.72,;10.5,-41.17,;10.39,-38.41,;10.39,-36.87,;11.86,-38.87,;13.3,-38.33,;13.3,-36.79,;14.63,-36.02,;15.97,-36.79,;17.3,-36.01,;17.3,-34.47,;15.95,-33.69,;14.63,-34.49,;14.63,-39.11,;14.63,-40.64,;15.86,-38.18,;17,-39.21,;18.33,-38.44,;18.33,-36.89,;19.8,-38.89,;21.25,-38.36,;21.25,-36.82,;22.59,-39.13,;22.59,-40.66,;23.81,-38.2,;24.96,-39.23,;24.96,-40.77,;26.29,-41.54,;26.29,-43.08,;27.62,-40.77,;26.29,-38.46,;26.29,-36.92,;27.62,-39.23,;28.95,-38.46,;28.95,-36.92,;30.28,-36.15,;30.28,-34.61,;31.61,-33.84,;31.61,-32.3,;30.28,-31.53,;32.94,-31.53,;30.28,-39.23,;30.28,-40.77,;31.61,-38.46,;32.94,-39.23,;32.94,-40.77,;34.27,-41.54,;35.61,-40.77,;36.93,-41.54,;36.93,-43.07,;35.6,-43.84,;34.27,-43.07,;34.27,-38.46,;35.61,-39.23,;34.27,-36.92,)|
BDBM50203808 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O |wU:4.4,72.76,81.84,36.37,12.13,100.103,58.61,wD:66.69,24.24,89.92,16.16,44.45,(-20.28,-19.15,;-20.26,-20.69,;-21.58,-21.47,;-18.91,-21.43,;-18.9,-22.99,;-20.24,-23.76,;-17.57,-23.76,;-17.57,-25.3,;-16.25,-22.99,;-15.77,-21.53,;-14.22,-21.54,;-13.74,-22.99,;-14.99,-23.9,;-14.99,-25.44,;-16.34,-26.21,;-13.67,-26.22,;-13.67,-27.76,;-15,-28.52,;-15,-30.06,;-13.68,-30.84,;-16.33,-30.83,;-12.34,-28.53,;-12.34,-30.07,;-10.99,-27.76,;-9.66,-28.53,;-9.66,-30.07,;-8.33,-30.84,;-8.33,-32.38,;-7.01,-33.15,;-5.66,-32.38,;-4.33,-33.15,;-5.67,-30.83,;-6.99,-30.07,;-8.32,-27.76,;-8.32,-26.22,;-6.99,-28.53,;-5.66,-27.77,;-5.66,-26.23,;-4.32,-25.46,;-2.99,-26.23,;-4.32,-23.92,;-4.32,-28.54,;-4.33,-30.08,;-2.99,-27.77,;-1.65,-28.54,;-1.66,-30.08,;-.33,-30.85,;.93,-29.86,;2.16,-30.85,;1.68,-32.32,;2.44,-33.63,;1.68,-34.96,;.14,-34.96,;-.62,-33.63,;.15,-32.31,;-.32,-27.77,;-.32,-26.23,;1.01,-28.54,;2.35,-27.77,;2.35,-26.23,;3.68,-25.47,;5.02,-26.24,;3.68,-23.93,;3.67,-28.55,;3.67,-30.09,;5.01,-27.78,;6.34,-28.55,;6.34,-30.09,;7.68,-30.86,;7.68,-27.78,;7.68,-26.24,;9.01,-28.55,;10.34,-27.78,;10.35,-26.24,;11.68,-28.56,;11.68,-30.1,;13.01,-27.79,;14.35,-28.55,;15.68,-27.78,;15.68,-26.24,;17.01,-28.55,;18.35,-27.78,;18.35,-26.24,;19.68,-25.48,;19.68,-23.94,;21.02,-26.25,;19.68,-28.56,;19.68,-30.1,;21.02,-27.79,;22.35,-28.56,;22.35,-30.1,;23.68,-30.87,;23.68,-32.41,;25.01,-33.18,;25.01,-34.72,;26.34,-35.49,;23.68,-35.49,;23.69,-27.79,;23.69,-26.25,;25.02,-28.56,;26.35,-27.79,;26.35,-26.25,;27.68,-25.49,;27.69,-23.95,;29.02,-23.18,;29.02,-21.64,;30.36,-20.87,;27.69,-20.87,;27.69,-28.57,;29.02,-27.8,;27.68,-30.11,)|
BDBM50203809 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,85.88,36.37,12.13,104.107,wD:66.69,24.24,93.96,16.16,44.45,(-5.72,-19.26,;-5.69,-20.8,;-7.02,-21.58,;-4.35,-21.54,;-4.34,-23.1,;-5.68,-23.87,;-3.01,-23.87,;-3.01,-25.41,;-1.68,-23.11,;-1.2,-21.65,;.34,-21.65,;.82,-23.1,;-.43,-24.02,;-.43,-25.56,;-1.77,-26.32,;.9,-26.33,;.89,-27.87,;-.44,-28.64,;-.44,-30.18,;.89,-30.95,;-1.78,-30.94,;2.22,-28.64,;2.22,-30.18,;3.56,-27.87,;4.89,-28.64,;4.89,-30.18,;6.23,-30.95,;6.22,-32.49,;7.55,-33.26,;8.89,-32.49,;10.22,-33.26,;8.88,-30.94,;7.56,-30.18,;6.23,-27.87,;6.23,-26.33,;7.56,-28.64,;8.89,-27.88,;8.89,-26.34,;10.23,-25.57,;11.56,-26.34,;10.23,-24.03,;10.23,-28.65,;10.23,-30.19,;11.56,-27.88,;12.9,-28.65,;12.9,-30.19,;14.22,-30.96,;15.48,-29.97,;16.71,-30.96,;16.24,-32.43,;17,-33.74,;16.24,-35.07,;14.7,-35.07,;13.94,-33.74,;14.71,-32.42,;14.23,-27.88,;14.23,-26.34,;15.57,-28.65,;16.9,-27.89,;16.9,-26.35,;18.23,-25.58,;19.57,-26.35,;18.23,-24.04,;18.23,-28.66,;18.23,-30.2,;19.57,-27.89,;20.9,-28.66,;20.89,-30.2,;22.23,-30.97,;22.24,-27.89,;22.24,-26.35,;23.57,-28.66,;24.9,-27.9,;24.9,-26.36,;26.24,-25.59,;26.24,-24.05,;24.9,-23.28,;27.57,-23.27,;26.23,-28.67,;26.23,-30.21,;27.57,-27.9,;28.9,-28.66,;30.23,-27.89,;30.24,-26.35,;31.56,-28.66,;32.9,-27.9,;32.9,-26.36,;34.24,-25.59,;34.24,-24.05,;35.57,-26.36,;34.23,-28.67,;34.23,-30.21,;35.57,-27.9,;36.9,-28.67,;36.9,-30.21,;38.24,-30.98,;38.24,-32.52,;39.56,-33.29,;39.56,-34.83,;40.89,-35.61,;38.23,-35.6,;38.24,-27.9,;38.24,-26.36,;39.57,-28.67,;40.9,-27.91,;40.9,-26.37,;42.24,-25.6,;43.57,-26.38,;44.91,-25.61,;44.91,-24.07,;43.56,-23.3,;42.24,-24.07,;42.24,-28.68,;43.57,-27.91,;42.24,-30.22,)|
BDBM50203810 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:55.58,4.4,69.72,84.88,12.13,36.38,103.107,wD:63.66,24.24,92.96,41.42,16.16,(-6.31,-18.18,;-6.29,-19.72,;-7.61,-20.51,;-4.94,-20.46,;-4.94,-22.02,;-6.27,-22.79,;-3.6,-22.79,;-3.6,-24.33,;-2.27,-22.02,;-1.79,-20.56,;-.25,-20.57,;.22,-22.03,;-1.03,-22.94,;-1.03,-24.48,;-2.37,-25.25,;.3,-25.25,;.3,-26.79,;-1.04,-27.56,;-1.04,-29.1,;.3,-29.87,;-2.37,-29.87,;1.63,-27.56,;1.63,-29.1,;2.97,-26.79,;4.3,-27.56,;4.3,-29.1,;5.63,-29.87,;5.62,-31.41,;6.95,-32.18,;8.29,-31.41,;9.62,-32.18,;8.29,-29.87,;6.96,-29.11,;5.63,-26.79,;5.64,-25.25,;6.97,-27.57,;8.3,-26.8,;8.3,-25.26,;9.63,-27.57,;9.63,-29.11,;10.97,-26.8,;12.3,-27.57,;12.3,-29.11,;13.63,-29.88,;14.88,-28.89,;16.12,-29.88,;15.64,-31.35,;16.4,-32.67,;15.64,-33.99,;14.1,-33.99,;13.34,-32.66,;14.11,-31.34,;13.64,-26.8,;13.64,-25.26,;14.97,-27.57,;16.3,-26.81,;16.3,-25.27,;17.64,-24.5,;18.97,-25.27,;17.64,-22.96,;17.64,-27.58,;17.63,-29.12,;18.97,-26.81,;20.3,-27.58,;20.3,-29.12,;21.63,-29.89,;21.64,-26.81,;21.64,-25.27,;22.97,-27.58,;24.31,-26.81,;24.31,-25.27,;25.64,-24.51,;26.97,-25.28,;28.31,-24.51,;28.31,-22.97,;26.97,-22.2,;25.64,-22.97,;25.64,-27.59,;25.64,-29.13,;26.97,-26.82,;28.31,-27.59,;29.64,-26.82,;29.64,-25.28,;30.97,-27.59,;32.31,-26.82,;32.31,-25.28,;33.64,-24.51,;33.65,-22.97,;34.98,-25.28,;33.64,-27.59,;33.64,-29.13,;34.97,-26.82,;36.31,-27.6,;36.31,-29.14,;37.64,-29.91,;37.64,-31.45,;38.97,-32.22,;38.97,-33.76,;40.3,-34.53,;37.63,-34.53,;37.64,-26.83,;37.64,-25.29,;38.98,-27.6,;40.31,-26.83,;40.31,-25.29,;41.65,-24.52,;42.97,-25.3,;44.31,-24.54,;44.31,-22.99,;42.97,-22.22,;41.64,-22.99,;41.64,-27.6,;42.98,-26.83,;41.64,-29.14,)|
BDBM50203811 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1CCCCC1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,87.91,36.37,12.13,106.110,wD:66.69,24.24,95.99,16.16,44.45,(-5.72,-19.26,;-5.69,-20.8,;-7.02,-21.58,;-4.35,-21.54,;-4.34,-23.1,;-5.68,-23.87,;-3.01,-23.87,;-3.01,-25.41,;-1.68,-23.11,;-1.2,-21.65,;.34,-21.65,;.82,-23.1,;-.43,-24.02,;-.43,-25.56,;-1.77,-26.32,;.9,-26.33,;.89,-27.87,;-.44,-28.64,;-.44,-30.18,;.89,-30.95,;-1.78,-30.94,;2.22,-28.64,;2.22,-30.18,;3.56,-27.87,;4.89,-28.64,;4.89,-30.18,;6.23,-30.95,;6.22,-32.49,;7.55,-33.26,;8.89,-32.49,;10.22,-33.26,;8.88,-30.94,;7.56,-30.18,;6.23,-27.87,;6.23,-26.33,;7.56,-28.64,;8.89,-27.88,;8.89,-26.34,;10.23,-25.57,;11.56,-26.34,;10.23,-24.03,;10.23,-28.65,;10.23,-30.19,;11.56,-27.88,;12.9,-28.65,;12.9,-30.19,;14.22,-30.96,;15.48,-29.97,;16.71,-30.96,;16.24,-32.43,;17,-33.74,;16.24,-35.07,;14.7,-35.07,;13.94,-33.74,;14.71,-32.42,;14.23,-27.88,;14.23,-26.34,;15.57,-28.65,;16.9,-27.89,;16.9,-26.35,;18.23,-25.58,;19.57,-26.35,;18.23,-24.04,;18.23,-28.66,;18.23,-30.2,;19.57,-27.89,;20.9,-28.66,;20.89,-30.2,;22.23,-30.97,;22.24,-27.89,;22.24,-26.35,;23.57,-28.66,;24.9,-27.9,;24.9,-26.36,;26.24,-25.59,;27.56,-26.37,;28.9,-25.61,;28.91,-24.06,;27.58,-23.28,;26.23,-24.05,;26.23,-28.67,;26.23,-30.21,;27.57,-27.9,;28.9,-28.66,;30.23,-27.89,;30.24,-26.35,;31.56,-28.66,;32.9,-27.9,;32.9,-26.36,;34.24,-25.59,;34.24,-24.05,;35.57,-26.36,;34.23,-28.67,;34.23,-30.21,;35.57,-27.9,;36.9,-28.67,;36.9,-30.21,;38.24,-30.98,;38.24,-32.52,;39.56,-33.29,;39.56,-34.83,;40.89,-35.61,;38.23,-35.6,;38.24,-27.9,;38.24,-26.36,;39.57,-28.67,;40.9,-27.91,;40.9,-26.37,;42.24,-25.6,;43.57,-26.38,;44.91,-25.61,;44.91,-24.07,;43.56,-23.3,;42.24,-24.07,;42.24,-28.68,;43.57,-27.91,;42.24,-30.22,)|
BDBM50203812 CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1
BDBM50203813 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,90.95,36.37,12.13,109.114,wD:66.69,24.24,98.103,16.16,44.45,(-6.38,1.31,;-6.36,-.23,;-7.68,-1.02,;-5.01,-.97,;-5.01,-2.53,;-6.34,-3.3,;-3.67,-3.3,;-3.67,-4.84,;-2.34,-2.53,;-1.86,-1.07,;-.32,-1.08,;.15,-2.54,;-1.1,-3.45,;-1.1,-4.99,;-2.44,-5.76,;.23,-5.76,;.23,-7.3,;-1.1,-8.07,;-1.11,-9.61,;.23,-10.38,;-2.44,-10.38,;1.56,-8.07,;1.56,-9.61,;2.9,-7.3,;4.23,-8.07,;4.23,-9.61,;5.56,-10.38,;5.55,-11.92,;6.89,-12.69,;8.22,-11.92,;9.56,-12.69,;8.22,-10.38,;6.9,-9.62,;5.57,-7.3,;5.57,-5.76,;6.9,-8.08,;8.23,-7.31,;8.23,-5.77,;9.57,-5,;10.9,-5.77,;9.57,-3.46,;9.57,-8.08,;9.56,-9.62,;10.9,-7.31,;12.23,-8.08,;12.23,-9.62,;13.56,-10.39,;14.81,-9.4,;16.05,-10.39,;15.57,-11.86,;16.33,-13.18,;15.57,-14.5,;14.03,-14.5,;13.27,-13.17,;14.04,-11.85,;13.57,-7.31,;13.57,-5.77,;14.9,-8.08,;16.23,-7.32,;16.24,-5.78,;17.57,-5.01,;18.9,-5.78,;17.57,-3.47,;17.57,-8.09,;17.57,-9.63,;18.9,-7.32,;20.23,-8.09,;20.23,-9.63,;21.57,-10.4,;21.57,-7.32,;21.57,-5.78,;22.9,-8.09,;24.24,-7.32,;24.24,-5.78,;25.57,-5.02,;27.05,-5.45,;27.92,-4.18,;26.98,-2.97,;27.27,-1.46,;26.1,-.46,;24.65,-.98,;24.37,-2.48,;25.53,-3.47,;25.57,-8.1,;25.57,-9.64,;26.9,-7.33,;28.24,-8.1,;29.57,-7.33,;29.57,-5.79,;30.9,-8.1,;32.24,-7.33,;32.24,-5.79,;33.58,-5.02,;33.58,-3.48,;34.91,-5.8,;33.57,-8.1,;33.57,-9.64,;34.91,-7.34,;36.24,-8.11,;36.24,-9.65,;37.57,-10.42,;37.57,-11.96,;38.9,-12.73,;38.9,-14.27,;40.23,-15.04,;37.57,-15.04,;37.57,-7.34,;37.58,-5.8,;38.91,-8.11,;40.24,-7.34,;40.24,-5.8,;41.58,-5.03,;42.91,-5.81,;44.24,-5.05,;44.24,-3.5,;42.9,-2.73,;41.57,-3.5,;41.57,-8.11,;42.91,-7.34,;41.57,-9.65,)|
BDBM50203814 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:58.61,4.4,72.75,88.92,36.37,12.13,107.111,wD:66.69,24.24,96.100,16.16,44.45,83.88,(-10.05,-20.79,;-10.03,-22.33,;-11.35,-23.13,;-8.68,-23.08,;-8.68,-24.64,;-10.01,-25.41,;-7.34,-25.41,;-7.34,-26.95,;-6.01,-24.64,;-5.53,-23.18,;-3.99,-23.18,;-3.52,-24.65,;-4.77,-25.55,;-4.77,-27.09,;-6.11,-27.86,;-3.44,-27.87,;-3.44,-29.41,;-4.77,-30.17,;-4.78,-31.71,;-3.44,-32.49,;-6.11,-32.48,;-2.11,-30.18,;-2.11,-31.72,;-.77,-29.41,;.56,-30.18,;.56,-31.72,;1.89,-32.49,;1.88,-34.03,;3.22,-34.8,;4.55,-34.03,;5.89,-34.8,;4.55,-32.48,;3.23,-31.72,;1.89,-29.41,;1.9,-27.87,;3.23,-30.18,;4.56,-29.41,;4.56,-27.87,;5.9,-27.11,;7.23,-27.88,;5.9,-25.57,;5.89,-30.19,;5.89,-31.73,;7.23,-29.42,;8.56,-30.19,;8.56,-31.73,;9.89,-32.5,;11.14,-31.51,;12.38,-32.5,;11.9,-33.96,;12.66,-35.28,;11.9,-36.61,;10.36,-36.61,;9.6,-35.28,;10.37,-33.96,;9.9,-29.42,;9.9,-27.88,;11.23,-30.19,;12.56,-29.42,;12.57,-27.88,;13.9,-27.11,;15.23,-27.89,;13.9,-25.57,;13.9,-30.19,;13.9,-31.73,;15.23,-29.43,;16.56,-30.2,;16.56,-31.74,;15.23,-32.51,;17.9,-29.43,;17.9,-27.89,;19.23,-30.2,;20.57,-29.43,;20.57,-27.89,;21.9,-27.12,;23.23,-27.9,;24.57,-27.13,;24.57,-25.59,;23.23,-24.82,;21.9,-25.59,;21.9,-30.2,;21.9,-31.74,;23.23,-29.43,;24.57,-30.21,;24.56,-31.75,;25.9,-29.44,;25.9,-27.9,;27.23,-30.21,;28.57,-29.44,;28.57,-27.9,;29.9,-27.13,;29.91,-25.59,;31.24,-27.9,;29.9,-30.21,;29.9,-31.75,;31.24,-29.44,;32.57,-30.21,;32.57,-31.75,;33.9,-32.53,;33.9,-34.07,;35.23,-34.84,;35.23,-36.38,;36.56,-37.15,;33.9,-37.15,;33.9,-29.45,;33.91,-27.91,;35.24,-30.22,;36.57,-29.45,;36.57,-27.91,;37.91,-27.14,;39.24,-27.92,;40.57,-27.15,;40.57,-25.61,;39.23,-24.84,;37.9,-25.61,;37.9,-30.22,;39.24,-29.45,;37.9,-31.76,)|
BDBM50203815 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:109.114,86.92,90.95,58.61,4.4,72.75,36.37,12.13,wD:98.103,66.69,24.24,16.16,44.45,(-11.16,-13.88,;-11.13,-15.42,;-12.46,-16.2,;-9.78,-16.16,;-9.78,-17.72,;-11.11,-18.49,;-8.44,-18.49,;-8.44,-20.03,;-7.11,-17.72,;-6.63,-16.26,;-5.09,-16.27,;-4.62,-17.72,;-5.87,-18.63,;-5.87,-20.17,;-7.21,-20.94,;-4.54,-20.95,;-4.54,-22.49,;-5.87,-23.25,;-5.87,-24.79,;-4.54,-25.57,;-7.21,-25.56,;-3.21,-23.26,;-3.21,-24.8,;-1.87,-22.49,;-.54,-23.26,;-.54,-24.8,;.79,-25.57,;.79,-27.11,;2.11,-27.88,;3.46,-27.11,;4.79,-27.88,;3.45,-25.56,;2.13,-24.8,;.8,-22.49,;.8,-20.95,;2.13,-23.26,;3.46,-22.5,;3.46,-20.96,;4.8,-20.19,;6.13,-20.96,;4.8,-18.65,;4.8,-23.27,;4.79,-24.81,;6.13,-22.5,;7.47,-23.27,;7.46,-24.81,;8.79,-25.58,;10.05,-24.59,;11.28,-25.58,;10.8,-27.05,;11.56,-28.36,;10.8,-29.69,;9.26,-29.69,;8.5,-28.35,;9.27,-27.04,;8.8,-22.5,;8.8,-20.96,;10.13,-23.27,;11.47,-22.5,;11.47,-20.96,;12.8,-20.2,;14.14,-20.97,;12.8,-18.66,;12.79,-23.28,;12.79,-24.82,;14.13,-22.51,;15.46,-23.28,;15.46,-24.82,;16.8,-25.59,;16.8,-22.51,;16.81,-20.97,;18.13,-23.28,;19.46,-22.51,;19.47,-20.97,;18.6,-19.69,;19.27,-18.31,;18.4,-17.03,;16.87,-17.14,;16.2,-18.55,;17.07,-19.81,;20.8,-23.29,;20.8,-24.83,;22.13,-22.52,;22.57,-21.04,;24.11,-21.01,;24.61,-22.46,;23.39,-23.38,;23.39,-24.92,;22.06,-25.69,;24.72,-25.7,;26.06,-24.93,;26.06,-23.39,;27.39,-22.62,;27.39,-21.08,;28.73,-23.39,;27.39,-25.7,;27.39,-27.24,;28.73,-24.93,;30.06,-25.7,;30.06,-27.24,;31.39,-28.01,;31.39,-29.55,;32.72,-30.33,;32.72,-31.87,;34.05,-32.64,;31.39,-32.63,;31.4,-24.93,;31.4,-23.39,;32.73,-25.71,;34.06,-24.94,;34.06,-23.4,;35.4,-22.63,;36.72,-23.41,;38.06,-22.64,;38.06,-21.1,;36.72,-20.33,;35.39,-21.1,;35.39,-25.71,;36.73,-24.94,;35.39,-27.25,)|
BDBM50203816 CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1cccnc1)C(N)=O |wU:4.4,72.75,87.91,36.37,12.13,106.110,58.61,wD:66.69,24.24,95.99,16.16,44.45,(-20.28,-19.15,;-20.26,-20.69,;-21.58,-21.47,;-18.91,-21.43,;-18.9,-22.99,;-20.24,-23.76,;-17.57,-23.76,;-17.57,-25.3,;-16.25,-22.99,;-15.77,-21.53,;-14.22,-21.54,;-13.74,-22.99,;-14.99,-23.9,;-14.99,-25.44,;-16.34,-26.21,;-13.67,-26.22,;-13.67,-27.76,;-15,-28.52,;-15,-30.06,;-13.68,-30.84,;-16.33,-30.83,;-12.34,-28.53,;-12.34,-30.07,;-10.99,-27.76,;-9.66,-28.53,;-9.66,-30.07,;-8.33,-30.84,;-8.33,-32.38,;-7.01,-33.15,;-5.66,-32.38,;-4.33,-33.15,;-5.67,-30.83,;-6.99,-30.07,;-8.32,-27.76,;-8.32,-26.22,;-6.99,-28.53,;-5.66,-27.77,;-5.66,-26.23,;-4.32,-25.46,;-2.99,-26.23,;-4.32,-23.92,;-4.32,-28.54,;-4.33,-30.08,;-2.99,-27.77,;-1.65,-28.54,;-1.66,-30.08,;-.33,-30.85,;.93,-29.86,;2.16,-30.85,;1.68,-32.32,;2.44,-33.63,;1.68,-34.96,;.14,-34.96,;-.62,-33.63,;.15,-32.31,;-.32,-27.77,;-.32,-26.23,;1.01,-28.54,;2.35,-27.77,;2.35,-26.23,;3.68,-25.47,;5.02,-26.24,;3.68,-23.93,;3.67,-28.55,;3.67,-30.09,;5.01,-27.78,;6.34,-28.55,;6.34,-30.09,;7.68,-30.86,;7.68,-27.78,;7.68,-26.24,;9.01,-28.55,;10.34,-27.78,;10.35,-26.24,;11.68,-25.48,;13.01,-26.24,;14.35,-25.48,;14.35,-23.93,;13.01,-23.16,;11.68,-23.94,;11.68,-28.56,;11.68,-30.1,;13.01,-27.79,;14.35,-28.55,;15.68,-27.78,;15.68,-26.24,;17.01,-28.55,;18.35,-27.78,;18.35,-26.24,;19.68,-25.48,;19.68,-23.94,;21.02,-26.25,;19.68,-28.56,;19.68,-30.1,;21.02,-27.79,;22.35,-28.56,;22.35,-30.1,;23.68,-30.87,;23.68,-32.41,;25.01,-33.18,;25.01,-34.72,;26.34,-35.49,;23.68,-35.49,;23.69,-27.79,;23.69,-26.25,;25.02,-28.56,;26.35,-27.79,;26.35,-26.25,;27.69,-25.48,;27.68,-23.95,;29.01,-23.18,;30.35,-23.95,;30.35,-25.49,;29.01,-26.26,;27.69,-28.57,;29.02,-27.8,;27.68,-30.11,)|
BDBM50216061 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(N)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,44.45,wD:33.34,(9.73,-45.37,;9.73,-46.91,;11.06,-47.69,;8.39,-47.69,;8.39,-49.23,;7.06,-49.99,;5.73,-49.22,;5.73,-47.67,;4.39,-49.99,;3.05,-49.23,;1.72,-49.99,;1.72,-51.54,;.39,-49.23,;.39,-47.69,;1.72,-46.91,;3.05,-47.68,;4.39,-46.91,;4.38,-45.37,;3.05,-44.6,;1.71,-45.37,;-.95,-50,;-2.28,-49.22,;-3.61,-49.99,;-2.28,-47.69,;-.95,-46.92,;-.95,-45.39,;-2.28,-44.62,;-2.28,-43.08,;-3.61,-45.39,;-3.61,-46.92,;9.73,-49.99,;9.73,-51.53,;11.06,-49.22,;12.4,-49.98,;12.4,-51.52,;13.73,-52.29,;13.73,-53.83,;15.07,-54.6,;15.07,-56.14,;13.74,-56.91,;16.4,-56.92,;13.73,-49.21,;13.73,-47.67,;15.06,-49.98,;16.4,-49.21,;16.4,-47.67,;17.73,-46.9,;19.13,-47.52,;20.16,-46.38,;19.39,-45.04,;19.87,-43.57,;18.83,-42.43,;17.32,-42.75,;16.85,-44.22,;17.89,-45.36,;17.73,-49.98,;19.06,-49.21,;17.73,-51.52,)|
BDBM50216062 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(CNCc2ccccc2)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,52.54,wD:41.43,(7.5,-15.93,;7.5,-17.47,;8.83,-18.25,;6.16,-18.25,;6.16,-19.79,;4.82,-20.55,;3.49,-19.78,;3.49,-18.23,;2.15,-20.55,;.81,-19.78,;-.52,-20.56,;-.52,-22.1,;-1.85,-19.79,;-1.85,-18.25,;-.52,-17.47,;.81,-18.24,;2.15,-17.47,;2.15,-15.92,;.81,-15.16,;-.53,-15.93,;-3.19,-20.55,;-4.52,-19.78,;-5.85,-20.54,;-4.52,-18.24,;-3.19,-17.47,;-3.18,-15.94,;-4.52,-15.17,;-4.52,-13.63,;-3.19,-12.86,;-1.85,-13.63,;-.52,-12.86,;.8,-13.63,;2.13,-12.86,;2.13,-11.33,;.79,-10.56,;-.53,-11.33,;-5.85,-15.94,;-5.85,-17.47,;7.5,-20.55,;7.5,-22.09,;8.82,-19.77,;10.16,-20.54,;10.16,-22.08,;11.5,-22.85,;11.5,-24.39,;12.83,-25.17,;12.84,-26.71,;11.51,-27.47,;14.17,-27.48,;11.5,-19.76,;11.5,-18.22,;12.83,-20.54,;14.16,-19.77,;14.16,-18.22,;15.49,-17.46,;16.9,-18.08,;17.93,-16.93,;17.16,-15.59,;17.64,-14.12,;16.6,-12.99,;15.09,-13.3,;14.61,-14.77,;15.65,-15.92,;15.49,-20.54,;16.82,-19.77,;15.49,-22.08,)|
BDBM50216063 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,44.45,wD:33.34,(10.78,-39.49,;10.78,-41.03,;12.11,-41.8,;9.44,-41.8,;9.44,-43.34,;8.11,-44.11,;6.77,-43.34,;6.77,-41.79,;5.44,-44.11,;4.1,-43.34,;2.76,-44.11,;2.76,-45.65,;1.43,-43.34,;1.43,-41.8,;2.76,-41.03,;4.09,-41.8,;5.43,-41.03,;5.43,-39.48,;4.1,-38.72,;2.76,-39.49,;.1,-44.11,;-1.23,-43.34,;-2.56,-44.11,;-1.23,-41.81,;.1,-41.04,;.1,-39.51,;-1.23,-38.74,;-1.23,-37.2,;-2.56,-39.51,;-2.56,-41.05,;10.78,-44.11,;10.78,-45.64,;12.11,-43.33,;13.44,-44.1,;13.44,-45.64,;14.78,-46.41,;14.78,-47.94,;16.11,-48.72,;16.12,-50.26,;14.79,-51.03,;17.45,-51.03,;14.78,-43.32,;14.78,-41.78,;16.11,-44.1,;17.45,-43.33,;17.45,-41.78,;18.77,-41.01,;20.18,-41.64,;21.21,-40.49,;20.44,-39.16,;20.92,-37.69,;19.88,-36.55,;18.37,-36.86,;17.89,-38.33,;18.93,-39.48,;18.77,-44.09,;20.1,-43.32,;18.77,-45.63,)|
BDBM50216064 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccc(N)c1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,44.45,wD:33.34,(6.58,4.14,;6.58,2.6,;7.91,1.82,;5.25,1.82,;5.25,.28,;3.91,-.48,;2.58,.29,;2.58,1.84,;1.24,-.48,;-.09,.28,;-1.43,-.48,;-1.43,-2.03,;-2.76,.28,;-2.76,1.82,;-1.43,2.6,;-.1,1.83,;1.24,2.6,;1.23,4.14,;-.1,4.91,;-1.44,4.14,;-4.09,-.49,;-5.43,.29,;-6.76,-.48,;-5.42,1.82,;-4.1,2.59,;-4.1,4.12,;-5.43,4.89,;-6.76,4.12,;-8.09,4.88,;-6.76,2.59,;6.58,-.48,;6.58,-2.02,;7.91,.29,;9.25,-.47,;9.25,-2.01,;10.59,-2.78,;10.59,-4.32,;11.92,-5.09,;11.92,-6.63,;10.59,-7.4,;13.26,-7.41,;10.59,.31,;10.59,1.85,;11.92,-.47,;13.25,.3,;13.25,1.85,;14.58,2.61,;15.98,1.99,;17.01,3.13,;16.24,4.47,;16.72,5.94,;15.68,7.08,;14.17,6.76,;13.7,5.29,;14.74,4.15,;14.58,-.47,;15.91,.3,;14.58,-2.01,)|
BDBM50216065 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(O)c(O)c(O)c1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,46.47,wD:35.36,(5.92,2.15,;5.92,.61,;7.24,-.16,;4.58,-.16,;4.58,-1.7,;3.24,-2.47,;1.91,-1.7,;1.91,-.15,;.58,-2.47,;-.76,-1.7,;-2.1,-2.47,;-2.1,-4.01,;-3.43,-1.7,;-3.43,-.16,;-2.1,.61,;-.77,-.16,;.57,.61,;.57,2.16,;-.77,2.92,;-2.11,2.15,;-4.76,-2.47,;-6.09,-1.7,;-7.42,-2.47,;-6.09,-.17,;-4.76,.6,;-4.76,2.13,;-3.43,2.9,;-6.09,2.9,;-6.09,4.44,;-7.42,2.13,;-8.75,2.89,;-7.42,.59,;5.92,-2.47,;5.92,-4,;7.25,-1.69,;8.58,-2.46,;8.58,-4,;9.92,-4.77,;9.92,-6.3,;11.25,-7.08,;11.25,-8.62,;9.93,-9.39,;12.59,-9.39,;9.92,-1.68,;9.92,-.14,;11.25,-2.46,;12.58,-1.69,;12.58,-.14,;13.91,.63,;15.31,.01,;16.34,1.15,;15.58,2.49,;16.05,3.95,;15.01,5.09,;13.51,4.78,;13.03,3.31,;14.07,2.16,;13.91,-2.45,;15.24,-1.68,;13.91,-3.99,)|
BDBM50216066 COc1ccc(cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:11.11,26.27,45.46,wD:34.35,(-4.77,-35.15,;-6.1,-35.92,;-6.1,-37.45,;-4.77,-38.22,;-4.77,-39.76,;-6.1,-40.52,;-7.43,-39.76,;-7.43,-38.23,;-6.1,-42.05,;-7.43,-42.82,;-4.77,-42.83,;-3.44,-42.05,;-3.44,-40.51,;-2.11,-39.74,;-.78,-40.51,;.56,-39.74,;.56,-38.2,;-.77,-37.43,;-2.11,-38.2,;-2.11,-42.82,;-2.11,-44.37,;-.77,-42.06,;.57,-42.82,;1.9,-42.05,;1.9,-40.5,;3.24,-42.82,;4.57,-42.05,;4.57,-40.51,;5.91,-39.74,;5.91,-38.2,;7.24,-40.51,;5.91,-42.82,;5.91,-44.36,;7.24,-42.04,;8.57,-42.81,;8.57,-44.35,;9.91,-45.12,;9.91,-46.66,;11.24,-47.43,;11.25,-48.97,;9.92,-49.74,;12.58,-49.74,;9.91,-42.03,;9.91,-40.49,;11.24,-42.81,;12.58,-42.04,;12.58,-40.49,;13.9,-39.73,;15.31,-40.35,;16.34,-39.2,;15.57,-37.87,;16.05,-36.4,;15.01,-35.26,;13.5,-35.58,;13.02,-37.05,;14.06,-38.19,;13.9,-42.81,;15.23,-42.04,;13.9,-44.34,)|
BDBM50216067 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,43.44,wD:32.33,(7.35,-10.51,;7.35,-12.05,;8.68,-12.82,;6.01,-12.82,;6.01,-14.36,;4.68,-15.13,;3.35,-14.36,;3.35,-12.81,;2.01,-15.13,;.67,-14.36,;-.66,-15.13,;-.66,-16.68,;-1.99,-14.36,;-1.99,-12.82,;-.66,-12.05,;.67,-12.82,;2,-12.05,;2,-10.51,;.67,-9.74,;-.67,-10.51,;-3.33,-15.14,;-4.66,-14.36,;-5.99,-15.13,;-4.66,-12.83,;-3.33,-12.07,;-3.32,-10.53,;-4.65,-9.76,;-5.99,-10.54,;-5.98,-12.07,;7.35,-15.13,;7.35,-16.67,;8.68,-14.35,;10.02,-15.12,;10.02,-16.66,;11.35,-17.43,;11.35,-18.97,;12.69,-19.74,;12.69,-21.28,;11.36,-22.05,;14.02,-22.05,;11.35,-14.34,;11.35,-12.8,;12.68,-15.12,;14.02,-14.35,;14.02,-12.8,;15.35,-12.04,;16.75,-12.66,;17.78,-11.51,;17.01,-10.18,;17.49,-8.71,;16.45,-7.57,;14.94,-7.89,;14.47,-9.36,;15.51,-10.5,;15.35,-15.12,;16.68,-14.35,;15.35,-16.65,)|
BDBM50216068 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(CN)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,45.46,wD:34.35,(10.43,-29.78,;10.43,-31.32,;11.76,-32.1,;9.09,-32.1,;9.09,-33.64,;7.76,-34.4,;6.42,-33.63,;6.42,-32.08,;5.09,-34.4,;3.75,-33.64,;2.42,-34.4,;2.42,-35.95,;1.08,-33.64,;1.08,-32.1,;2.41,-31.32,;3.74,-32.09,;5.08,-31.32,;5.08,-29.78,;3.75,-29.01,;2.41,-29.78,;-.25,-34.41,;-1.58,-33.63,;-2.91,-34.4,;-1.58,-32.1,;-.25,-31.33,;-.25,-29.8,;-1.58,-29.03,;-1.58,-27.49,;-.25,-26.72,;-2.91,-29.8,;-2.91,-31.33,;10.43,-34.4,;10.43,-35.94,;11.76,-33.63,;13.09,-34.39,;13.09,-35.93,;14.43,-36.7,;14.43,-38.24,;15.76,-39.01,;15.77,-40.55,;14.44,-41.32,;17.1,-41.33,;14.43,-33.61,;14.43,-32.07,;15.76,-34.39,;17.09,-33.62,;17.09,-32.07,;18.42,-31.31,;19.83,-31.93,;20.86,-30.78,;20.09,-29.45,;20.57,-27.98,;19.53,-26.84,;18.02,-27.16,;17.54,-28.63,;18.58,-29.77,;18.42,-34.39,;19.75,-33.62,;18.42,-35.92,)|
BDBM50216069 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(CN=C(N)N)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,48.49,wD:37.38,(9.09,-16.29,;9.09,-17.84,;10.42,-18.61,;7.76,-18.61,;7.76,-20.15,;6.42,-20.92,;5.09,-20.14,;5.09,-18.6,;3.75,-20.91,;2.42,-20.15,;1.08,-20.92,;1.08,-22.46,;-.25,-20.15,;-.25,-18.61,;1.08,-17.84,;2.41,-18.6,;3.75,-17.83,;3.75,-16.29,;2.41,-15.53,;1.07,-16.3,;-1.58,-20.92,;-2.91,-20.15,;-4.24,-20.91,;-2.91,-18.61,;-1.58,-17.84,;-1.58,-16.31,;-2.91,-15.54,;-2.91,-14,;-1.58,-13.24,;-.25,-14,;1.08,-13.24,;-.25,-15.54,;-4.25,-16.31,;-4.24,-17.85,;9.09,-20.91,;9.09,-22.45,;10.43,-20.14,;11.76,-20.9,;11.76,-22.44,;13.1,-23.21,;13.1,-24.75,;14.43,-25.53,;14.43,-27.07,;13.1,-27.83,;15.77,-27.84,;13.1,-20.13,;13.1,-18.59,;14.43,-20.9,;15.76,-20.13,;15.76,-18.59,;17.09,-17.82,;18.49,-18.44,;19.52,-17.3,;18.76,-15.96,;19.23,-14.49,;18.19,-13.36,;16.69,-13.67,;16.21,-15.14,;17.25,-16.29,;17.09,-20.9,;18.42,-20.13,;17.09,-22.44,)|
BDBM50216070 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,44.45,wD:33.34,(8.68,-8.82,;8.68,-10.36,;10.01,-11.13,;7.35,-11.13,;7.35,-12.67,;6.01,-13.44,;4.68,-12.67,;4.68,-11.12,;3.34,-13.44,;2.01,-12.67,;.67,-13.44,;.67,-14.99,;-.66,-12.67,;-.66,-11.13,;.67,-10.36,;2,-11.13,;3.34,-10.36,;3.34,-8.82,;2,-8.05,;.66,-8.82,;-1.99,-13.45,;-3.32,-12.67,;-4.65,-13.44,;-3.32,-11.14,;-1.99,-10.38,;-1.99,-8.84,;-3.32,-8.07,;-4.65,-8.85,;-4.65,-10.38,;-5.98,-11.15,;8.68,-13.44,;8.68,-14.98,;10.01,-12.66,;11.35,-13.43,;11.35,-14.97,;12.69,-15.74,;12.69,-17.28,;14.02,-18.05,;14.02,-19.59,;12.69,-20.36,;15.36,-20.36,;12.69,-12.65,;12.69,-11.11,;14.02,-13.43,;15.35,-12.66,;15.35,-11.11,;16.68,-10.35,;18.08,-10.97,;19.11,-9.82,;18.35,-8.49,;18.82,-7.02,;17.78,-5.88,;16.28,-6.2,;15.8,-7.67,;16.84,-8.81,;16.68,-13.43,;18.01,-12.66,;16.68,-14.96,)|
BDBM50216071 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccc(O)c1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,44.45,wD:33.34,(7.83,4.08,;7.83,2.54,;9.16,1.76,;6.49,1.76,;6.49,.22,;5.16,-.54,;3.82,.23,;3.82,1.77,;2.49,-.54,;1.15,.22,;-.18,-.55,;-.18,-2.09,;-1.51,.22,;-1.51,1.76,;-.19,2.54,;1.15,1.77,;2.48,2.54,;2.48,4.08,;1.15,4.85,;-.19,4.08,;-2.85,-.55,;-4.18,.22,;-5.51,-.54,;-4.18,1.75,;-2.85,2.52,;-2.84,4.05,;-4.17,4.82,;-5.51,4.05,;-6.84,4.81,;-5.5,2.52,;7.83,-.54,;7.83,-2.08,;9.16,.23,;10.5,-.53,;10.5,-2.07,;11.83,-2.84,;11.83,-4.38,;13.16,-5.16,;13.17,-6.7,;11.84,-7.46,;14.5,-7.47,;11.83,.24,;11.83,1.78,;13.16,-.53,;14.5,.24,;14.5,1.78,;15.83,2.55,;17.23,1.93,;18.26,3.07,;17.49,4.41,;17.97,5.88,;16.93,7.02,;15.42,6.7,;14.95,5.23,;15.99,4.09,;15.83,-.53,;17.15,.24,;15.83,-2.07,)|
BDBM50216072 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1OC(=O)c1ccccc1O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,53.55,wD:42.44,(10.59,-21.53,;10.59,-23.07,;11.92,-23.84,;9.25,-23.84,;9.25,-25.39,;7.91,-26.15,;6.58,-25.37,;6.58,-23.82,;5.24,-26.14,;3.9,-25.38,;2.57,-26.15,;2.57,-27.7,;1.24,-25.39,;1.24,-23.84,;2.57,-23.07,;3.9,-23.84,;5.24,-23.07,;5.24,-21.52,;3.9,-20.76,;2.56,-21.53,;-.1,-26.15,;-1.43,-25.38,;-2.76,-26.14,;-1.43,-23.84,;-.09,-23.08,;-.09,-21.54,;-1.42,-20.77,;-2.76,-21.55,;-2.75,-23.08,;-4.08,-23.85,;-5.42,-23.08,;-6.75,-23.86,;-5.42,-21.55,;-4.09,-20.78,;-4.09,-19.24,;-5.43,-18.48,;-6.76,-19.26,;-6.75,-20.79,;-8.08,-21.56,;10.59,-26.15,;10.59,-27.69,;11.91,-25.37,;13.25,-26.14,;13.25,-27.68,;14.59,-28.45,;14.59,-29.99,;15.92,-30.76,;15.93,-32.3,;14.6,-33.07,;17.26,-33.08,;14.59,-25.36,;14.59,-23.82,;15.92,-26.14,;17.25,-25.37,;17.25,-23.82,;18.58,-23.05,;19.99,-23.68,;21.02,-22.53,;20.25,-21.19,;20.73,-19.72,;19.69,-18.58,;18.18,-18.9,;17.7,-20.37,;18.74,-21.52,;18.58,-26.14,;19.91,-25.37,;18.58,-27.68,)|
BDBM50216073 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,43.44,wD:32.33,(8.11,-8.18,;8.11,-9.73,;9.44,-10.5,;6.77,-10.5,;6.77,-12.04,;5.44,-12.81,;4.1,-12.03,;4.1,-10.49,;2.77,-12.8,;1.43,-12.04,;.1,-12.81,;.1,-14.35,;-1.23,-12.04,;-1.23,-10.5,;.09,-9.73,;1.43,-10.49,;2.76,-9.72,;2.76,-8.18,;1.43,-7.42,;.09,-8.19,;-2.57,-12.81,;-3.9,-12.04,;-5.23,-12.8,;-3.9,-10.5,;-2.57,-9.73,;-2.57,-8.2,;-3.9,-7.43,;-5.23,-8.2,;-5.23,-9.74,;8.11,-12.8,;8.11,-14.34,;9.44,-12.03,;10.78,-12.8,;10.78,-14.33,;12.11,-15.1,;12.11,-16.64,;13.44,-17.42,;13.45,-18.96,;12.12,-19.72,;14.78,-19.73,;12.11,-12.02,;12.11,-10.48,;13.44,-12.79,;14.78,-12.03,;14.78,-10.48,;16.11,-9.71,;17.51,-10.33,;18.54,-9.19,;17.77,-7.85,;18.25,-6.38,;17.21,-5.25,;15.7,-5.56,;15.23,-7.03,;16.26,-8.18,;16.11,-12.79,;17.43,-12.02,;16.11,-14.33,)|
BDBM50216074 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccncc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,43.44,wD:32.33,(6.72,4.32,;6.72,2.78,;8.05,2.01,;5.39,2.01,;5.39,.47,;4.05,-.3,;2.72,.47,;2.72,2.02,;1.38,-.29,;.04,.47,;-1.29,-.3,;-1.29,-1.84,;-2.62,.47,;-2.62,2.01,;-1.29,2.78,;.04,2.01,;1.38,2.79,;1.37,4.33,;.04,5.09,;-1.3,4.32,;-3.95,-.3,;-5.29,.47,;-6.62,-.29,;-5.29,2.01,;-3.96,2.77,;-3.96,4.31,;-5.29,5.08,;-6.62,4.3,;-6.62,2.77,;6.72,-.3,;6.72,-1.83,;8.05,.48,;9.39,-.29,;9.39,-1.82,;10.73,-2.59,;10.73,-4.13,;12.06,-4.91,;12.06,-6.45,;10.73,-7.21,;13.39,-7.22,;10.73,.49,;10.73,2.03,;12.05,-.29,;13.39,.48,;13.39,2.03,;14.72,2.8,;16.12,2.18,;17.15,3.32,;16.38,4.66,;16.86,6.13,;15.82,7.26,;14.31,6.95,;13.84,5.48,;14.88,4.33,;14.72,-.28,;16.05,.49,;14.72,-1.82,)|
BDBM50216075 CC(C)CC(NC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(cc1)[N+]([O-])=O)C(=O)NC(CCC\[NH+]=C(/N)[NH-])C(=O)NC(Cc1c[nH]c2ccccc12)C(N)=O
BDBM50216076 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(CN(Cc2ccccn2)Cc2ccccn2)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,59.62,wD:48.51,(7.91,-1.59,;7.91,-3.13,;9.24,-3.91,;6.58,-3.91,;6.58,-5.45,;5.24,-6.21,;3.91,-5.44,;3.91,-3.89,;2.57,-6.21,;1.23,-5.44,;-.1,-6.22,;-.1,-7.76,;-1.43,-5.45,;-1.43,-3.91,;-.1,-3.13,;1.23,-3.9,;2.57,-3.13,;2.57,-1.59,;1.23,-.82,;-.11,-1.59,;-2.77,-6.21,;-4.1,-5.44,;-5.43,-6.21,;-4.1,-3.9,;-2.77,-3.13,;-2.77,-1.6,;-4.1,-.83,;-4.1,.71,;-2.77,1.48,;-2.77,3.02,;-4.1,3.79,;-4.1,5.32,;-5.43,6.09,;-6.76,5.32,;-6.76,3.78,;-5.43,3.01,;-1.44,.71,;-.11,1.48,;-.11,3.01,;1.21,3.78,;2.55,3.01,;2.55,1.48,;1.22,.71,;-5.44,-1.6,;-5.43,-3.13,;7.91,-6.22,;7.91,-7.76,;9.24,-5.44,;10.58,-6.2,;10.58,-7.74,;11.92,-8.51,;11.92,-10.05,;13.25,-10.83,;13.25,-12.37,;11.92,-13.14,;14.59,-13.14,;11.92,-5.42,;11.92,-3.88,;13.24,-6.2,;14.58,-5.43,;14.58,-3.88,;15.91,-3.12,;17.31,-3.74,;18.34,-2.59,;17.58,-1.26,;18.06,.21,;17.02,1.35,;15.51,1.04,;15.03,-.43,;16.07,-1.58,;15.91,-6.2,;17.24,-5.43,;15.91,-7.74,)|
BDBM50216077 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(cc1)N=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,47.48,wD:36.37,(8.33,-31.6,;8.33,-33.14,;9.65,-33.91,;6.99,-33.91,;6.99,-35.45,;5.66,-36.22,;4.32,-35.45,;4.32,-33.9,;2.99,-36.22,;1.65,-35.46,;.31,-36.22,;.31,-37.77,;-1.02,-35.46,;-1.02,-33.92,;.31,-33.14,;1.64,-33.91,;2.98,-33.14,;2.98,-31.6,;1.64,-30.83,;.31,-31.6,;-2.35,-36.23,;-3.68,-35.45,;-5.01,-36.22,;-3.68,-33.92,;-2.35,-33.15,;-2.35,-31.62,;-3.68,-30.85,;-5.02,-31.62,;-5.01,-33.15,;-3.68,-29.31,;-2.35,-28.54,;-2.35,-27.01,;-1.02,-29.31,;8.33,-36.22,;8.33,-37.76,;9.66,-35.45,;10.99,-36.21,;10.99,-37.75,;12.33,-38.52,;12.33,-40.06,;13.66,-40.83,;13.67,-42.37,;12.34,-43.14,;15,-43.14,;12.33,-35.43,;12.33,-33.89,;13.66,-36.21,;14.99,-35.44,;14.99,-33.89,;16.32,-33.13,;17.72,-33.75,;18.76,-32.6,;17.99,-31.27,;18.46,-29.8,;17.43,-28.66,;15.92,-28.98,;15.44,-30.45,;16.48,-31.59,;16.32,-36.21,;17.65,-35.44,;16.32,-37.74,)|
BDBM50216078 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(Cl)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,44.45,wD:33.34,(8.92,-39.59,;8.92,-41.13,;10.25,-41.91,;7.59,-41.91,;7.59,-43.45,;6.25,-44.21,;4.92,-43.44,;4.92,-41.89,;3.58,-44.21,;2.25,-43.45,;.91,-44.21,;.91,-45.76,;-.42,-43.45,;-.42,-41.91,;.91,-41.13,;2.24,-41.9,;3.58,-41.13,;3.57,-39.59,;2.24,-38.82,;.9,-39.59,;-1.75,-44.22,;-3.09,-43.44,;-4.42,-44.21,;-3.09,-41.91,;-1.75,-41.15,;-1.75,-39.62,;-3.08,-38.84,;-3.08,-37.31,;-4.42,-39.62,;-4.41,-41.15,;8.92,-44.21,;8.92,-45.75,;10.25,-43.44,;11.59,-44.2,;11.59,-45.74,;12.93,-46.51,;12.93,-48.05,;14.26,-48.82,;14.26,-50.36,;12.93,-51.13,;15.6,-51.14,;12.93,-43.43,;12.93,-41.88,;14.26,-44.2,;15.59,-43.43,;15.59,-41.89,;16.92,-41.12,;18.32,-41.74,;19.35,-40.6,;18.59,-39.26,;19.06,-37.79,;18.02,-36.65,;16.52,-36.97,;16.04,-38.44,;17.08,-39.58,;16.92,-44.2,;18.25,-43.43,;16.92,-45.74,)|
BDBM50216079 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccn1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,43.44,wD:32.33,(8.46,-23.31,;8.46,-24.85,;9.79,-25.63,;7.12,-25.63,;7.12,-27.17,;5.79,-27.93,;4.45,-27.16,;4.45,-25.61,;3.12,-27.93,;1.78,-27.17,;.45,-27.93,;.45,-29.48,;-.88,-27.17,;-.88,-25.63,;.44,-24.85,;1.78,-25.62,;3.11,-24.85,;3.11,-23.31,;1.78,-22.54,;.44,-23.31,;-2.22,-27.94,;-3.55,-27.16,;-4.88,-27.93,;-3.55,-25.63,;-2.22,-24.86,;-2.22,-23.33,;-3.55,-22.56,;-4.88,-23.33,;-4.88,-24.86,;8.46,-27.93,;8.46,-29.47,;9.79,-27.16,;11.13,-27.92,;11.13,-29.46,;12.46,-30.23,;12.46,-31.77,;13.79,-32.54,;13.8,-34.08,;12.47,-34.85,;15.13,-34.86,;12.46,-27.14,;12.46,-25.6,;13.79,-27.92,;15.13,-27.15,;15.13,-25.6,;16.45,-24.84,;17.86,-25.46,;18.89,-24.32,;18.12,-22.98,;18.6,-21.51,;17.56,-20.37,;16.05,-20.69,;15.58,-22.16,;16.61,-23.3,;16.45,-27.92,;17.78,-27.15,;16.45,-29.46,)|
BDBM50216080 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(CNC(C)=O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,48.49,wD:37.38,(8.21,-9.67,;8.21,-11.21,;9.54,-11.99,;6.87,-11.99,;6.87,-13.53,;5.54,-14.29,;4.2,-13.52,;4.2,-11.98,;2.87,-14.29,;1.53,-13.53,;.2,-14.3,;.2,-15.84,;-1.13,-13.53,;-1.13,-11.99,;.19,-11.21,;1.53,-11.98,;2.86,-11.21,;2.86,-9.67,;1.53,-8.9,;.19,-9.67,;-2.47,-14.3,;-3.8,-13.53,;-5.13,-14.29,;-3.8,-12,;-2.47,-11.23,;-2.46,-9.7,;-3.79,-8.93,;-3.8,-7.39,;-2.47,-6.62,;-1.14,-7.39,;.19,-6.62,;-1.14,-8.92,;-5.13,-9.7,;-5.12,-11.23,;8.21,-14.29,;8.21,-15.83,;9.54,-13.52,;10.88,-14.28,;10.88,-15.82,;12.21,-16.59,;12.21,-18.13,;13.54,-18.91,;13.55,-20.45,;12.22,-21.21,;14.88,-21.22,;12.21,-13.51,;12.21,-11.97,;13.54,-14.28,;14.88,-13.51,;14.88,-11.97,;16.21,-11.2,;17.61,-11.82,;18.64,-10.68,;17.87,-9.34,;18.35,-7.87,;17.31,-6.73,;15.8,-7.05,;15.33,-8.52,;16.36,-9.66,;16.21,-14.28,;17.53,-13.51,;16.21,-15.82,)|
BDBM50216081 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(CNCc2ccccn2)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,52.54,wD:41.43,(6.89,.87,;6.89,-.67,;8.21,-1.44,;5.55,-1.44,;5.55,-2.98,;4.21,-3.75,;2.88,-2.98,;2.88,-1.43,;1.55,-3.75,;.21,-2.98,;-1.13,-3.75,;-1.13,-5.3,;-2.46,-2.98,;-2.46,-1.44,;-1.13,-.67,;.2,-1.44,;1.54,-.67,;1.54,.88,;.2,1.64,;-1.14,.87,;-3.79,-3.75,;-5.12,-2.98,;-6.46,-3.74,;-5.12,-1.44,;-3.79,-.67,;-3.79,.86,;-5.12,1.63,;-5.12,3.17,;-3.79,3.94,;-2.46,3.17,;-1.13,3.94,;-1.14,5.46,;.18,6.23,;1.52,5.47,;1.52,3.93,;.19,3.16,;-6.46,.86,;-6.45,-.68,;6.89,-3.75,;6.89,-5.29,;8.22,-2.97,;9.55,-3.74,;9.55,-5.28,;10.89,-6.05,;10.89,-7.59,;12.22,-8.36,;12.23,-9.9,;10.9,-10.67,;13.56,-10.67,;10.89,-2.96,;10.89,-1.42,;12.22,-3.74,;13.55,-2.97,;13.55,-1.42,;14.88,-.65,;16.29,-1.28,;17.32,-.13,;16.55,1.21,;17.03,2.68,;15.99,3.81,;14.48,3.5,;14,2.03,;15.04,.88,;14.88,-3.73,;16.21,-2.97,;14.88,-5.27,)|
BDBM50216082 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnc[nH]1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,42.43,wD:31.32,(8.11,-42.03,;8.11,-43.57,;9.44,-44.35,;6.78,-44.35,;6.78,-45.89,;5.44,-46.65,;4.11,-45.88,;4.11,-44.34,;2.77,-46.65,;1.44,-45.89,;.1,-46.65,;.1,-48.2,;-1.23,-45.89,;-1.23,-44.35,;.1,-43.57,;1.43,-44.34,;2.77,-43.57,;2.76,-42.03,;1.43,-41.26,;.09,-42.03,;-2.56,-46.66,;-3.9,-45.89,;-5.23,-46.65,;-3.89,-44.34,;-2.65,-43.44,;-3.12,-41.98,;-4.66,-41.98,;-5.13,-43.44,;8.11,-46.65,;8.11,-48.19,;9.44,-45.88,;10.78,-46.64,;10.78,-48.18,;12.12,-48.95,;12.12,-50.49,;13.45,-51.26,;13.45,-52.8,;12.12,-53.57,;14.78,-53.58,;12.12,-45.87,;12.12,-44.33,;13.45,-46.64,;14.78,-45.87,;14.78,-44.33,;16.11,-43.56,;17.51,-44.18,;18.54,-43.04,;17.77,-41.7,;18.25,-40.23,;17.21,-39.1,;15.7,-39.41,;15.23,-40.88,;16.27,-42.03,;16.11,-46.64,;17.44,-45.87,;16.11,-48.18,)|
BDBM50216083 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc[nH]1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,42.43,wD:31.32,(6.66,3.54,;6.66,2,;7.99,1.23,;5.32,1.23,;5.32,-.31,;3.99,-1.08,;2.66,-.31,;2.66,1.24,;1.32,-1.08,;-.02,-.31,;-1.35,-1.08,;-1.35,-2.62,;-2.68,-.31,;-2.68,1.23,;-1.35,2,;-.02,1.23,;1.31,2,;1.31,3.54,;-.02,4.31,;-1.36,3.54,;-4.02,-1.08,;-5.35,-.31,;-6.68,-1.08,;-5.34,1.23,;-4.1,2.13,;-4.57,3.59,;-6.11,3.6,;-6.58,2.14,;6.66,-1.08,;6.66,-2.62,;7.99,-.3,;9.33,-1.07,;9.33,-2.61,;10.66,-3.38,;10.66,-4.92,;12,-5.69,;12,-7.23,;10.67,-8,;13.33,-8,;10.66,-.29,;10.66,1.25,;11.99,-1.07,;13.33,-.3,;13.33,1.25,;14.66,2.01,;16.06,1.39,;17.09,2.54,;16.32,3.87,;16.8,5.34,;15.76,6.48,;14.25,6.16,;13.78,4.69,;14.82,3.55,;14.66,-1.06,;15.99,-.3,;14.66,-2.6,)|
BDBM50216084 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(CO)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,45.46,wD:34.35,(6.53,-25.13,;6.53,-26.67,;7.86,-27.44,;5.2,-27.44,;5.2,-28.98,;3.86,-29.75,;2.53,-28.98,;2.53,-27.43,;1.2,-29.75,;-.14,-28.98,;-1.48,-29.75,;-1.48,-31.29,;-2.81,-28.98,;-2.81,-27.44,;-1.48,-26.67,;-.15,-27.44,;1.19,-26.67,;1.19,-25.12,;-.15,-24.36,;-1.49,-25.13,;-4.14,-29.75,;-5.47,-28.98,;-6.8,-29.75,;-5.47,-27.45,;-4.14,-26.68,;-4.14,-25.15,;-5.47,-24.38,;-5.47,-22.84,;-4.14,-22.08,;-6.8,-25.16,;-6.8,-26.69,;6.54,-29.75,;6.54,-31.29,;7.87,-28.97,;9.2,-29.74,;9.2,-31.28,;10.54,-32.05,;10.54,-33.59,;11.87,-34.36,;11.87,-35.9,;10.54,-36.67,;13.21,-36.67,;10.54,-28.96,;10.54,-27.42,;11.87,-29.74,;13.2,-28.97,;13.2,-27.42,;14.53,-26.66,;15.93,-27.28,;16.96,-26.13,;16.2,-24.8,;16.67,-23.33,;15.63,-22.19,;14.13,-22.51,;13.65,-23.97,;14.69,-25.12,;14.53,-29.73,;15.86,-28.97,;14.53,-31.27,)|
BDBM50216085 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,44.45,wD:33.34,(8.26,-8.02,;8.26,-9.56,;9.59,-10.33,;6.93,-10.33,;6.93,-11.87,;5.59,-12.64,;4.26,-11.87,;4.26,-10.32,;2.93,-12.64,;1.59,-11.88,;.25,-12.64,;.25,-14.19,;-1.08,-11.88,;-1.08,-10.34,;.25,-9.56,;1.58,-10.33,;2.92,-9.56,;2.92,-8.02,;1.58,-7.25,;.24,-8.02,;-2.41,-12.65,;-3.74,-11.87,;-5.07,-12.64,;-3.74,-10.34,;-2.41,-9.57,;-2.41,-8.04,;-3.74,-7.27,;-5.08,-8.04,;-5.07,-9.57,;-6.4,-10.34,;8.26,-12.64,;8.26,-14.18,;9.6,-11.87,;10.93,-12.63,;10.93,-14.17,;12.27,-14.94,;12.27,-16.48,;13.6,-17.25,;13.6,-18.79,;12.27,-19.56,;14.94,-19.56,;12.27,-11.85,;12.27,-10.31,;13.6,-12.63,;14.93,-11.86,;14.93,-10.31,;16.26,-9.55,;17.66,-10.17,;18.69,-9.02,;17.93,-7.69,;18.4,-6.22,;17.36,-5.08,;15.86,-5.4,;15.38,-6.87,;16.42,-8.01,;16.26,-12.63,;17.59,-11.86,;16.26,-14.16,)|
BDBM50216086 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1c(F)c(F)c(F)c(F)c1F)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:12.20,4.4,48.49,wD:37.38,(11.42,-13.89,;11.42,-15.43,;12.75,-16.21,;10.08,-16.21,;10.08,-17.75,;8.75,-18.51,;7.42,-17.74,;7.42,-16.19,;6.08,-18.51,;4.74,-17.75,;3.41,-18.51,;3.41,-20.06,;2.08,-17.75,;2.08,-16.21,;3.41,-15.43,;4.74,-16.2,;6.08,-15.43,;6.07,-13.89,;4.74,-13.12,;3.4,-13.89,;.74,-18.52,;-.59,-17.74,;-.59,-16.21,;-1.91,-18.51,;-1.91,-20.04,;-.58,-20.8,;-3.23,-20.81,;-3.23,-22.34,;-4.57,-20.04,;-5.9,-20.81,;-4.57,-18.5,;-5.9,-17.73,;-3.24,-17.74,;-3.24,-16.2,;11.42,-18.51,;11.42,-20.05,;12.75,-17.74,;14.09,-18.5,;14.09,-20.04,;15.42,-20.81,;15.42,-22.35,;16.76,-23.12,;16.76,-24.66,;15.43,-25.43,;18.09,-25.44,;15.42,-17.72,;15.42,-16.18,;16.75,-18.5,;18.09,-17.73,;18.09,-16.18,;19.42,-15.42,;20.82,-16.04,;21.85,-14.9,;21.08,-13.56,;21.56,-12.09,;20.52,-10.95,;19.01,-11.27,;18.54,-12.74,;19.58,-13.88,;19.42,-18.5,;20.75,-17.73,;19.42,-20.04,)|
BDBM50320795 OCc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50320796 OC(=O)c1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50320797 Nc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50320798 NCc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50320799 NCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50320800 NCCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50320801 NCCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccccc2)c1C#N)-c1ccccc1O
BDBM50320802 NCCCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50320803 NCCNC(=O)c1ccccc1-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50320804 NCCNC(=O)c1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50320805 NCCNC(=O)c1ccc(cc1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50320806 COc1ccccc1-c1cc(-c2cccc(N)c2)c(C#N)c(NC(=O)c2cccs2)n1
BDBM50320807 NCCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccccc2)c1C#N)-c1ccccc1N
BDBM50320808 NCCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1cc(Cl)ccc1O
BDBM50320809 COc1ccc(O)c(c1)-c1cc(-c2cccc(NC(=O)CCN)c2)c(C#N)c(NC(=O)c2cccs2)n1
BDBM50320810 NCCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccc(F)cc1O
BDBM50320811 NCCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccc(Cl)cc1O
BDBM50320812 NCCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccc(Br)cc1O
BDBM50320813 Cc1ccc(c(O)c1)-c1cc(-c2cccc(NC(=O)CCN)c2)c(C#N)c(NC(=O)c2cccs2)n1
BDBM50320814 COc1ccc(c(O)c1)-c1cc(-c2cccc(NC(=O)CCN)c2)c(C#N)c(NC(=O)c2ccccc2)n1
BDBM50320815 NCCNC(=O)c1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccccc1O
BDBM50320816 COc1ccccc1C(=O)Nc1nc(cc(-c2cccc(c2)C(=O)NCCN)c1C#N)-c1ccccc1O
BDBM50320817 COc1ccc(cc1)C(=O)Nc1nc(cc(-c2cccc(c2)C(=O)NCCN)c1C#N)-c1ccccc1O
BDBM50320818 CC(C)(CN)NC(=O)c1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccccc1O
BDBM50320819 COc1ccccc1C(=O)Nc1nc(cc(-c2cccc(c2)C(=O)NC(C)(C)CN)c1C#N)-c1ccccc1O
BDBM50320820 COc1ccc(cc1)C(=O)Nc1nc(cc(-c2cccc(c2)C(=O)NC(C)(C)CN)c1C#N)-c1ccccc1O
BDBM50320821 NCCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50320822 NCCNC(=O)c1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50320823 CC(C)(CN)CNC(=O)c1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50320824 Cc1c(nc(NC(=O)c2ccco2)c(C#N)c1-c1cccc(NC(=O)CCN)c1)-c1ccccc1O
BDBM50322289 Oc1cc(F)ccc1-c1cc(-c2cccc(NC(=O)CC3CCCCN3)c2)c(C#N)c(NC(=O)c2ccco2)n1
BDBM50322290 CN1CCC[C@H]1CC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O |r|
BDBM50322291 CN(C)CCNC(=O)c1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322292 NCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322293 CNCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322294 Oc1cc(F)ccc1-c1cc(-c2cccc(NC(=O)[C@H]3CCCN3)c2)c(C#N)c(NC(=O)c2ccco2)n1 |r|
BDBM50322295 CN(C)CC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322296 CCNC(CC)C(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322297 Oc1cc(F)ccc1-c1cc(-c2cccc(NC(=O)CN3CCCCC3)c2)c(C#N)c(NC(=O)c2ccco2)n1
BDBM50322298 CN(C)CCN(C)c1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322299 Oc1cc(F)ccc1-c1cc(-c2cccc(c2)N2CCNCC2)c(C#N)c(NC(=O)c2ccco2)n1
BDBM50322300 Oc1cc(F)ccc1-c1cc(-c2cccc(c2)N2CCCNCC2)c(C#N)c(NC(=O)c2ccco2)n1
BDBM50322301 CN1CCN(CC1)c1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322302 CCN1CCN(CC1)c1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322303 Oc1cc(F)ccc1-c1cc(-c2cccc(CN3CCNCC3)c2)c(C#N)c(NC(=O)c2ccco2)n1
BDBM50322304 Oc1cc(F)ccc1-c1cc(-c2cccc(CN3CCCNCC3)c2)c(C#N)c(NC(=O)c2ccco2)n1
BDBM50322305 CN1CCN(Cc2cccc(c2)-c2cc(nc(NC(=O)c3ccco3)c2C#N)-c2ccc(F)cc2O)CC1
BDBM50322306 CCN1CCN(Cc2cccc(c2)-c2cc(nc(NC(=O)c3ccco3)c2C#N)-c2ccc(F)cc2O)CC1
BDBM50322307 CNCCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322308 CN(C)CCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322309 Oc1cc(F)ccc1-c1cc(-c2cccc(NC(=O)C[C@@H]3CCCN3)c2)c(C#N)c(NC(=O)c2ccco2)n1 |r|
BDBM50322310 Oc1cc(F)ccc1-c1cc(-c2cccc(NC(=O)C[C@H]3CCCN3)c2)c(C#N)c(NC(=O)c2ccco2)n1 |r|
BDBM50322311 CC(CC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O)N(C)C
BDBM50322312 CCN(CC)C(C)CC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322313 CCNC(CC)CC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322314 CCC(CC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O)N(CC)CC
BDBM50322315 CN(C)CC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2cccs2)c1C#N)-c1ccccc1O
BDBM50322316 CCN(C)CCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322317 CCN(CC)CCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322318 CCNC(C)CC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50322319 CC(C)NC(C)CC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
BDBM50336911 [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O |r|
BDBM50336912 [#7]\[#6](-[#7])=[#7]/[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)C12[#6]-[#6]-3-[#6]-[#6](-[#6]-[#6](-[#6]-3)-[#6]1)-[#6]2)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#7])=O |r,TLB:9:11:14:18.17.16,9:11:18:14.15.16,20:11:18:14.15.16,THB:20:15:18:12.11.19,19:11:14:18.17.16,19:17:14:12.11.20|
BDBM50336913 [#6]-[#7](-[#6])-c1cccc2c(cccc12)S(=O)(=O)[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#7])=O |r|
BDBM50392403 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392404 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(=O)N[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392401 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392402 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=S)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392478 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50392479 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50392480 CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50392481 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50392482 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50392483 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,wU:59.62,37.50,23.26,wD:51.58,29.34,12.20,4.4,72.75,83.86,(21.58,-37.66,;21.58,-36.13,;22.9,-35.35,;20.24,-35.35,;20.24,-33.81,;18.92,-33.04,;17.58,-33.81,;17.58,-35.35,;16.24,-33.04,;14.92,-33.81,;13.58,-33.04,;13.58,-31.5,;12.25,-33.81,;12.25,-35.35,;13.58,-36.13,;14.92,-35.35,;16.25,-36.12,;16.25,-37.66,;14.92,-38.44,;13.58,-37.66,;10.91,-33.04,;9.59,-33.81,;9.59,-35.35,;8.25,-33.04,;8.25,-31.5,;9.59,-30.74,;6.91,-33.81,;5.58,-33.04,;5.58,-31.5,;4.25,-33.81,;4.25,-35.35,;5.58,-36.12,;6.91,-35.35,;5.58,-37.66,;2.91,-33.04,;1.58,-33.81,;1.58,-35.35,;.24,-33.04,;.24,-31.5,;1.58,-30.74,;2.98,-31.36,;4.01,-30.22,;3.25,-28.88,;3.72,-27.42,;2.7,-26.27,;1.19,-26.6,;.71,-28.06,;1.74,-29.2,;-1.08,-33.81,;-2.42,-33.04,;-2.42,-31.5,;-3.75,-33.81,;-3.75,-35.35,;-2.42,-36.12,;-1.08,-35.35,;-2.42,-37.66,;-5.08,-33.04,;-6.42,-33.81,;-6.42,-35.35,;-7.75,-33.04,;-9.09,-33.81,;-7.75,-31.5,;-6.42,-30.74,;-5.08,-31.5,;-3.75,-30.74,;-3.75,-29.2,;-2.43,-28.43,;-5.08,-28.43,;-6.42,-29.2,;21.58,-33.04,;21.58,-31.5,;22.9,-33.81,;24.25,-33.04,;24.25,-31.49,;25.59,-30.72,;25.59,-29.17,;26.93,-28.4,;26.94,-26.85,;28.28,-26.08,;25.6,-26.08,;25.58,-33.81,;25.58,-35.35,;26.91,-33.04,;28.24,-33.81,;28.24,-35.35,;29.58,-36.13,;30.91,-35.35,;32.25,-36.12,;32.25,-37.66,;30.91,-38.44,;29.58,-37.66,;29.58,-33.04,;30.91,-33.82,;29.58,-31.5,)|
BDBM50392484 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50392485 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392486 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:76.79|
BDBM50392487 CNC(NC)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,wU:72.75,50.63,36.39,9.9,wD:64.71,42.47,25.33,13.17,85.88,(24.46,-25.66,;24.45,-27.2,;25.79,-27.98,;27.13,-27.21,;28.47,-27.98,;25.79,-29.53,;24.45,-30.3,;24.45,-31.85,;23.11,-32.62,;23.1,-34.17,;21.76,-34.94,;20.44,-34.17,;20.44,-32.63,;19.1,-34.94,;19.1,-36.48,;20.44,-37.25,;20.44,-38.79,;21.76,-36.48,;17.77,-34.17,;16.44,-34.94,;16.44,-36.48,;15.1,-34.17,;13.78,-34.94,;12.44,-34.17,;12.44,-32.63,;11.11,-34.94,;11.11,-36.48,;12.44,-37.25,;13.78,-36.48,;15.11,-37.25,;15.11,-38.79,;13.78,-39.56,;12.44,-38.78,;9.77,-34.17,;8.45,-34.94,;8.45,-36.48,;7.11,-34.17,;7.11,-32.63,;8.45,-31.87,;5.77,-34.94,;4.44,-34.17,;4.44,-32.63,;3.11,-34.94,;3.11,-36.48,;4.44,-37.25,;5.77,-36.48,;4.44,-38.79,;1.78,-34.17,;.44,-34.94,;.44,-36.48,;-.9,-34.17,;-.9,-32.63,;.44,-31.86,;1.85,-32.49,;2.87,-31.34,;2.11,-30.01,;2.58,-28.55,;1.56,-27.4,;.05,-27.73,;-.43,-29.19,;.6,-30.32,;-2.22,-34.94,;-3.56,-34.17,;-3.56,-32.63,;-4.89,-34.94,;-4.89,-36.48,;-3.56,-37.25,;-2.22,-36.48,;-3.56,-38.79,;-6.22,-34.17,;-7.56,-34.94,;-7.56,-36.48,;-8.89,-34.17,;-10.22,-34.94,;-8.89,-32.63,;-7.56,-31.86,;-6.22,-32.63,;-4.89,-31.86,;-4.89,-30.33,;-3.56,-29.55,;-6.22,-29.55,;-7.56,-30.32,;24.44,-34.94,;24.44,-36.48,;25.77,-34.17,;27.1,-34.94,;27.1,-36.48,;28.43,-37.25,;29.77,-36.48,;31.11,-37.25,;31.11,-38.79,;29.77,-39.56,;28.43,-38.78,;28.43,-34.17,;29.77,-34.94,;28.43,-32.63,)|
BDBM50392488 CCNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:5.5|
BDBM50392489 CCCNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:6.6|
BDBM50392490 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,wU:59.62,37.50,23.26,72.75,wD:51.58,29.34,12.20,4.4,84.87,(21,-27.74,;21,-26.2,;22.32,-25.43,;19.66,-25.43,;19.66,-23.89,;18.33,-23.12,;17,-23.89,;17,-25.43,;15.66,-23.12,;14.34,-23.89,;13,-23.12,;13,-21.58,;11.67,-23.89,;11.67,-25.43,;13,-26.2,;14.34,-25.43,;15.67,-26.2,;15.67,-27.74,;14.34,-28.51,;13,-27.73,;10.33,-23.12,;9.01,-23.89,;9.01,-25.43,;7.67,-23.12,;7.67,-21.58,;9.01,-20.82,;6.33,-23.89,;5,-23.12,;5,-21.58,;3.67,-23.89,;3.67,-25.43,;5,-26.2,;6.33,-25.43,;5,-27.74,;2.34,-23.12,;1,-23.89,;1,-25.43,;-.34,-23.12,;-.34,-21.58,;1,-20.82,;2.41,-21.44,;3.43,-20.29,;2.67,-18.96,;3.14,-17.5,;2.12,-16.35,;.61,-16.68,;.13,-18.14,;1.16,-19.28,;-1.66,-23.89,;-3,-23.12,;-3,-21.58,;-4.33,-23.89,;-4.33,-25.43,;-3,-26.2,;-1.66,-25.43,;-3,-27.74,;-5.66,-23.12,;-7,-23.89,;-7,-25.43,;-8.33,-23.12,;-9.66,-23.89,;-8.33,-21.58,;-7,-20.82,;-5.66,-21.58,;-4.33,-20.81,;-4.33,-19.28,;-3,-18.5,;-5.66,-18.51,;-7,-19.28,;21,-23.12,;21,-21.58,;22.32,-23.89,;23.66,-23.12,;23.67,-21.57,;25.01,-20.8,;25.01,-19.25,;26.35,-18.48,;26.35,-16.93,;27.7,-16.16,;27.7,-14.61,;29.03,-16.93,;25,-23.89,;25,-25.43,;26.33,-23.12,;27.66,-23.89,;27.66,-25.43,;28.99,-26.2,;30.33,-25.43,;31.67,-26.2,;31.67,-27.74,;30.33,-28.51,;28.99,-27.73,;28.99,-23.12,;30.33,-23.89,;28.99,-21.58,)|
BDBM50392491 CNC(N)=NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392492 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,wU:59.62,37.50,23.26,72.75,wD:51.58,29.34,12.20,4.4,82.85,(21.35,-5.83,;21.35,-4.29,;22.67,-3.52,;20.01,-3.52,;20.01,-1.98,;18.68,-1.21,;17.35,-1.98,;17.35,-3.52,;16.01,-1.21,;14.68,-1.98,;13.34,-1.21,;13.34,.33,;12.01,-1.98,;12.01,-3.52,;13.34,-4.29,;14.68,-3.52,;16.02,-4.29,;16.02,-5.83,;14.68,-6.6,;13.34,-5.83,;10.67,-1.21,;9.35,-1.98,;9.35,-3.52,;8,-1.21,;8,.33,;9.35,1.1,;6.67,-1.98,;5.34,-1.21,;5.34,.33,;4,-1.98,;4,-3.52,;5.34,-4.29,;6.67,-3.52,;5.34,-5.83,;2.67,-1.21,;1.34,-1.98,;1.34,-3.52,;-.01,-1.21,;-.01,.33,;1.34,1.1,;2.74,.48,;3.77,1.62,;3,2.96,;3.48,4.42,;2.46,5.57,;.94,5.24,;.47,3.78,;1.5,2.64,;-1.33,-1.98,;-2.67,-1.21,;-2.67,.33,;-4,-1.98,;-4,-3.52,;-2.67,-4.29,;-1.33,-3.52,;-2.67,-5.83,;-5.33,-1.21,;-6.67,-1.98,;-6.67,-3.52,;-8.01,-1.21,;-9.34,-1.98,;-8.01,.33,;-6.67,1.1,;-5.33,.33,;-4,1.1,;-4,2.64,;-2.67,3.41,;-5.33,3.41,;-6.67,2.64,;21.35,-1.21,;21.35,.33,;22.67,-1.98,;24.02,-1.21,;24.02,.34,;25.36,1.12,;25.36,2.66,;26.7,3.44,;26.71,4.99,;28.04,2.66,;25.35,-1.98,;25.35,-3.52,;26.68,-1.21,;28.02,-1.98,;28.02,-3.52,;29.35,-4.29,;30.69,-3.52,;32.03,-4.29,;32.03,-5.83,;30.68,-6.6,;29.35,-5.83,;29.35,-1.21,;30.68,-1.98,;29.35,.33,)|
BDBM50392493 CNC(N)=NCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392408 CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)NC)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:70.71|
BDBM50392409 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392410 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392494 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50392495 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCN)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50392496 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CN)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50392497 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CNC(=O)CN)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50392498 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CNC(=O)CN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,wU:59.62,37.50,23.26,72.75,wD:51.58,29.34,12.20,4.4,85.88,(21.01,-40.02,;21.01,-38.48,;22.33,-37.71,;19.67,-37.71,;19.67,-36.17,;18.34,-35.4,;17.01,-36.17,;17.01,-37.71,;15.67,-35.4,;14.35,-36.17,;13.01,-35.4,;13.01,-33.86,;11.68,-36.17,;11.68,-37.71,;13.01,-38.48,;14.35,-37.71,;15.68,-38.48,;15.68,-40.02,;14.35,-40.79,;13.01,-40.02,;10.34,-35.4,;9.02,-36.17,;9.02,-37.71,;7.68,-35.4,;7.68,-33.86,;9.02,-33.1,;6.34,-36.17,;5.01,-35.4,;5.01,-33.86,;3.68,-36.17,;3.68,-37.71,;5.01,-38.48,;6.34,-37.71,;5.01,-40.02,;2.35,-35.4,;1.01,-36.17,;1.01,-37.71,;-.33,-35.4,;-.33,-33.86,;1.01,-33.1,;2.42,-33.72,;3.44,-32.57,;2.68,-31.24,;3.15,-29.78,;2.13,-28.63,;.62,-28.96,;.14,-30.42,;1.17,-31.56,;-1.65,-36.17,;-2.99,-35.4,;-2.99,-33.86,;-4.32,-36.17,;-4.32,-37.71,;-2.99,-38.48,;-1.65,-37.71,;-2.99,-40.02,;-5.65,-35.4,;-6.99,-36.17,;-6.99,-37.71,;-8.32,-35.4,;-9.66,-36.17,;-8.32,-33.86,;-6.99,-33.1,;-5.65,-33.86,;-4.32,-33.1,;-4.32,-31.56,;-2.99,-30.78,;-5.65,-30.79,;-6.99,-31.56,;21.01,-35.4,;21.01,-33.86,;22.33,-36.17,;23.67,-35.4,;23.68,-33.85,;25.02,-33.08,;25.02,-31.53,;26.36,-30.76,;23.68,-30.76,;23.68,-29.21,;22.34,-28.43,;22.34,-26.88,;21,-29.2,;25.01,-36.17,;25.01,-37.71,;26.34,-35.4,;27.67,-36.17,;27.67,-37.71,;29,-38.48,;30.34,-37.71,;31.68,-38.48,;31.68,-40.02,;30.34,-40.79,;29,-40.02,;29,-35.4,;30.34,-36.17,;29,-33.86,)|
BDBM50392411 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccncc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392412 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392413 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392414 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392405 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392406 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50392407 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442960 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccncc1)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442961 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442962 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442963 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442964 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442965 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442966 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442967 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442968 CC(C)C[C@H](NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,wU:59.62,37.50,23.26,72.75,wD:51.58,29.34,12.20,4.4,83.86,(40.93,-34.78,;40.93,-33.25,;42.27,-32.48,;39.59,-32.48,;39.59,-30.94,;38.26,-30.17,;36.93,-30.95,;36.93,-32.48,;35.6,-30.18,;34.27,-30.95,;32.94,-30.18,;32.94,-28.64,;31.6,-30.95,;31.6,-32.49,;32.94,-33.25,;34.27,-32.49,;35.6,-33.25,;35.61,-34.79,;34.27,-35.56,;32.94,-34.8,;30.27,-30.18,;28.93,-30.95,;28.93,-32.49,;27.6,-30.19,;27.6,-28.64,;28.93,-27.88,;26.27,-30.96,;24.94,-30.19,;24.94,-28.65,;23.6,-30.96,;23.6,-32.5,;24.94,-33.27,;26.27,-32.5,;24.94,-34.8,;22.28,-30.2,;20.94,-30.96,;20.94,-32.5,;19.61,-30.19,;19.61,-28.66,;20.94,-27.88,;22.34,-28.51,;23.37,-27.36,;22.6,-26.03,;23.08,-24.56,;22.04,-23.42,;20.53,-23.75,;20.06,-25.21,;21.09,-26.35,;18.27,-30.97,;16.94,-30.2,;16.94,-28.66,;15.6,-30.97,;15.6,-32.51,;16.94,-33.28,;18.27,-32.51,;16.94,-34.81,;14.28,-30.2,;12.94,-30.97,;12.94,-32.51,;11.61,-30.2,;10.27,-30.97,;11.61,-28.67,;12.94,-27.9,;14.27,-28.66,;15.61,-27.89,;15.6,-26.35,;16.93,-25.58,;14.27,-25.58,;12.93,-26.35,;40.93,-30.17,;40.93,-28.63,;42.27,-30.94,;43.6,-30.16,;43.6,-28.62,;44.93,-27.85,;44.93,-26.32,;46.26,-25.54,;46.26,-24.01,;44.92,-23.23,;47.59,-23.24,;44.93,-30.93,;44.93,-32.47,;46.26,-30.16,;47.59,-30.93,;47.59,-32.47,;48.93,-33.24,;50.26,-32.46,;51.6,-33.23,;51.6,-34.77,;50.27,-35.54,;48.94,-34.77,;48.93,-30.16,;50.26,-30.93,;48.93,-28.62,)|
BDBM50442969 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](C)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442970 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442971 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442972 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccncc1)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442973 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1cccnc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442974 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442975 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](N)Cc1cccnc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442976 CC[C@H](C)[C@H](NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)NC)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:62.63|
BDBM50442977 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1cccnc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442978 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442979 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1cccnc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442980 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442981 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CO)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM50442982 CNC(N)=NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,w:4.4|
BDBM107310 CNC[C@H](O)\C=C(/CC(C)C)C(C)=O |r|
BDBM47092 CNC[C@@H](O)\C=C(/CC(C)C)C(C)=O |r|
BDBM50045503 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045504 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045506 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CCc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045509 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C1CC1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045507 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045508 CCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)NC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045510 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045511 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045512 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50045513 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50045514 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045515 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045497 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC(O)CN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045498 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045516 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045517 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045518 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045499 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045500 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045519 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045520 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(C)(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045521 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045502 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045501 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50045505 CC[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)NC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50082051 CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)C(O)=O |r|
BDBM50082064 CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)C(O)=O |r|
BDBM50082065 CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1cn(nn1)[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)C(O)=O |r|
BDBM50082067 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCNC(C)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50082069 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCNC(C)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50082070 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCNC(C)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50082071 CCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50082072 CCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50082073 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50082074 CC(C)C[C@@H](C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)n1cc(CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(C)=O)nn1 |r|
BDBM50082075 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50082077 CC(C)C[C@@H](C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)n1cc(Cn2cc(nn2)[C@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(C)=O)nn1 |r|
BDBM50082078 CC(C)C[C@H](NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50082079 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCNC(C)=O)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50082066 CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1cn(nn1)[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)C(O)=O |r|
BDBM50082068 CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCNC(C)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50082076 CC(C)C[C@H](NC(=O)Cn1cc(nn1)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|
BDBM50191288 Cl.[#7]\[#6](-[#7])=[#7]\[#7]=[#6]\c1ccc(Cl)c(Cl)c1
BDBM50196437 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCN(C1)C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196439 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1cccc(F)c1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196440 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1cccc(F)c1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196442 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196443 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1cccc(F)c1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196444 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196462 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CSCN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196463 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)N(C)C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196464 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CN(C)C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196481 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196482 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196417 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](C)N(C)C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196419 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1cccc(F)c1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196420 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196421 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196422 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1cccc(F)c1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196423 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1cccc(F)c1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196424 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196425 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196426 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196427 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196428 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196429 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196430 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196433 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CCNC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196434 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)c1ccccc1NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196431 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1cccc(F)c1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196432 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196418 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196435 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196436 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)C1CN(C1)C(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196438 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1F)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196483 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50196441 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508230 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50508232 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50508233 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCCCC1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508234 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508236 CCC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)NC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508238 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50508240 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50508241 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508242 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508218 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508221 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C1CC1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508222 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508223 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508224 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508225 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508226 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NCc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508227 CCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)NC)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50508228 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50508229 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CCc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50508219 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CCc1ccncc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50508220 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccncc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508235 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50508237 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccoc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50508239 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50508231 CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CCc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM50565180 NC(=N)NCCC[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](C(N)=O)c1ccccc1 |r|
BDBM50565194 NC1=NC=C(CN1)c1ccc(Cl)c(Cl)c1 |c:3,t:1|
BDBM50583777 [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#6]-[#6]-[#6]-[#7]-[#6](-[#7])=[#7])-[#7]-[#6](=O)\[#6]=[#6](\c1ccccc1)-c1ccccc1)-[#6](-[#7])=O |r|
BDBM50583766 [#7]-[#6](=[#7])-[#7]-[#6]-[#6]-[#6]-[#6@@H](-[#7]-[#6](=O)\[#6]=[#6](\c1ccccc1)-c1ccccc1)-[#6](=O)-[#7]-[#6@H](-[#6]-c1ccccc1)-[#6](-[#7])=O |r|
BDBM50583773 [#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#6]-[#6]-[#6]-[#7]-[#6](-[#7])=[#7])-[#7]-[#6](=O)\[#6]=[#6](\c1ccccc1)-c1ccccc1 |r|