Compound Name

SMILES String

N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

N[C@@H](CCN(CCNCCc1ccc(Cl)cc1)C[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)n1cnc2c(N)ncnc12)C(O)=O |r|

CN(C)Cc1ccc(cc1)-c1cc(N(C)C2CCCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C1CCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CN(C)Cc1ccc(cc1)-c1cc(NC2CCCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(cc(NC3CCCC3)c2C)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

CN(C)Cc1ccc(cc1)-c1cc(cc(n1)C1=CCCCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:18|

CN(C)Cc1ccc(cc1)-c1cc(cc(n1)N1CCCCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)Nc1cc(cc(n1)-c1ccc(CN(C)C)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(CCN2CCOCC2)c1

CN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(C)c1

CN(C1CCCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(C)c1

CN(C1CCNCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CN(C)Cc1ccc(cc1)-c1cc(N(C)C2CCOCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C1CCCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CN(C)Cc1ccc(cc1)-c1cc(N(C)C2CCCCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C1CCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1

CN(C1CCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(CCN2CCOCC2)c1

CN(C1CCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(C)c1

CN([C@@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:2.1,5.8,(-1.33,2.69,;,1.93,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;2.67,5,;1.33,4.23,;5.33,5,;6.67,4.23,;8,5,;6.67,2.69,;,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;8,-4.23,;9.34,-1.93,;9.34,-.38,;10.67,.38,;8,.38,;6.67,-.38,;5.33,.38,;1.33,-.38,;2.67,.38,;-2.67,-2.69,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-6.67,-5,;-8,-4.23,;-8,-2.69,;-9.34,-1.93,;-10.67,-2.69,;-10.67,-4.23,;-9.34,-5,;-4,-5,;-2.67,-4.23,)|

CN([C@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:5.8,wD:2.1,(-1.33,2.69,;,1.93,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;2.67,5,;1.33,4.23,;5.33,5,;6.67,4.23,;8,5,;6.67,2.69,;,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;8,-4.23,;9.34,-1.93,;9.34,-.38,;10.67,.38,;8,.38,;6.67,-.38,;5.33,.38,;1.33,-.38,;2.67,.38,;-2.67,-2.69,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-6.67,-5,;-8,-4.23,;-8,-2.69,;-9.34,-1.93,;-10.67,-2.69,;-10.67,-4.23,;-9.34,-5,;-4,-5,;-2.67,-4.23,)|

CN([C@@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(C)c1 |r,wU:2.1,5.8,(-2.67,-4.93,;-2.67,-3.39,;-4,-2.62,;-4,-1.08,;-5.33,-.31,;-6.67,-1.08,;-6.67,-2.62,;-5.33,-3.39,;-8,-.31,;-9.34,-1.08,;-10.67,-.31,;-9.34,-2.62,;-1.33,-2.62,;-1.33,-1.08,;,-.31,;1.33,-1.08,;1.33,-2.62,;2.67,-3.39,;2.67,-4.93,;4,-2.62,;5.33,-3.39,;6.67,-2.62,;8,-3.39,;8,-4.93,;9.34,-2.62,;9.34,-1.08,;10.67,-.31,;8,-.31,;6.67,-1.08,;5.33,-.31,;,-3.39,;,-4.93,;,1.23,;1.25,2.13,;.77,3.6,;-.77,3.6,;-1.54,4.93,;-1.25,2.13,)|

CN([C@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(C)c1 |r,wU:5.8,wD:2.1,(-2.67,-4.93,;-2.67,-3.39,;-4,-2.62,;-4,-1.08,;-5.33,-.31,;-6.67,-1.08,;-6.67,-2.62,;-5.33,-3.39,;-8,-.31,;-9.34,-1.08,;-10.67,-.31,;-9.34,-2.62,;-1.33,-2.62,;-1.33,-1.08,;,-.31,;1.33,-1.08,;1.33,-2.62,;2.67,-3.39,;2.67,-4.93,;4,-2.62,;5.33,-3.39,;6.67,-2.62,;8,-3.39,;8,-4.93,;9.34,-2.62,;9.34,-1.08,;10.67,-.31,;8,-.31,;6.67,-1.08,;5.33,-.31,;,-3.39,;,-4.93,;,1.23,;1.25,2.13,;.77,3.6,;-.77,3.6,;-1.54,4.93,;-1.25,2.13,)|

CN(C1CCNCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1

CN(C1CCNCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(CCN2CCOCC2)c1

CN(C1CCNCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(C)c1

CN(C)Cc1ccc(cc1)-c1cc(N(C)C2CCNCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1

CN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CO)nc1

CN(C)Cc1ccc(cn1)-c1cc(N(C)C2CCOCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C1CCCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1

CN(C)Cc1ccc(cn1)-c1cc(N(C)C2CCCCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C)Cc1ccc(cn1)-c1cc(N(C)C2CCCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CN([C@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(CCN2CCOCC2)c1 |r,wU:5.8,wD:2.1,(-2.67,-6.44,;-2.67,-4.9,;-4,-4.13,;-4,-2.59,;-5.33,-1.82,;-6.67,-2.59,;-6.67,-4.13,;-5.33,-4.9,;-8,-1.82,;-9.34,-2.59,;-10.67,-1.82,;-9.34,-4.13,;-1.33,-4.13,;-1.33,-2.59,;,-1.82,;1.33,-2.59,;1.33,-4.13,;2.67,-4.9,;2.67,-6.44,;4,-4.13,;5.33,-4.9,;6.67,-4.13,;8,-4.9,;8,-6.44,;9.34,-4.13,;9.34,-2.59,;10.67,-1.82,;8,-1.82,;6.67,-2.59,;5.33,-1.82,;,-4.9,;,-6.44,;,-.28,;1.25,.62,;.77,2.09,;-.77,2.09,;-1.86,3.18,;-3.35,2.78,;-4.44,3.87,;-4.04,5.35,;-5.13,6.44,;-6.61,6.04,;-7.01,4.56,;-5.92,3.47,;-1.25,.62,)|

CN([C@@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(CCN2CCOCC2)c1 |r,wU:2.1,5.8,(-2.67,-6.44,;-2.67,-4.9,;-4,-4.13,;-4,-2.59,;-5.33,-1.82,;-6.67,-2.59,;-6.67,-4.13,;-5.33,-4.9,;-8,-1.82,;-9.34,-2.59,;-10.67,-1.82,;-9.34,-4.13,;-1.33,-4.13,;-1.33,-2.59,;,-1.82,;1.33,-2.59,;1.33,-4.13,;2.67,-4.9,;2.67,-6.44,;4,-4.13,;5.33,-4.9,;6.67,-4.13,;8,-4.9,;8,-6.44,;9.34,-4.13,;9.34,-2.59,;10.67,-1.82,;8,-1.82,;6.67,-2.59,;5.33,-1.82,;,-4.9,;,-6.44,;,-.28,;1.25,.62,;.77,2.09,;-.77,2.09,;-1.86,3.18,;-3.35,2.78,;-4.44,3.87,;-4.04,5.35,;-5.13,6.44,;-6.61,6.04,;-7.01,4.56,;-5.92,3.47,;-1.25,.62,)|

CN(C)Cc1ccc(cc1)-c1cc(N(C)[C@H]2CC[C@@H](CC2)NC(C)=O)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:15.15,wD:18.22,(-10,5.01,;-8.67,4.24,;-8.67,2.69,;-7.34,5.01,;-6,4.24,;-6,2.69,;-4.67,1.93,;-3.33,2.69,;-3.33,4.24,;-4.67,5.01,;-2,1.93,;-2,.38,;-.67,-.38,;-.67,-1.93,;-2,-2.69,;.67,-2.69,;2,-1.93,;3.33,-2.69,;3.33,-4.24,;2,-5.01,;.67,-4.24,;4.67,-5.01,;6,-4.24,;7.34,-5.01,;6,-2.69,;.67,.38,;2,-.38,;.67,1.93,;-.67,2.69,;2,2.69,;2,4.24,;3.33,1.93,;4.67,2.69,;6,1.93,;7.34,2.69,;7.34,4.24,;8.67,1.93,;8.67,.38,;10,-.38,;7.34,-.38,;6,.38,;4.67,-.38,)|

CN(C)Cc1ccc(cc1)-c1cc(N(C)[C@@H]2CC[C@@H](CC2)NC(C)=O)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wD:15.15,18.22,(-10,5.01,;-8.67,4.24,;-8.67,2.69,;-7.34,5.01,;-6,4.24,;-6,2.69,;-4.67,1.93,;-3.33,2.69,;-3.33,4.24,;-4.67,5.01,;-2,1.93,;-2,.38,;-.67,-.38,;-.67,-1.93,;-2,-2.69,;.67,-2.69,;2,-1.93,;3.33,-2.69,;3.33,-4.24,;2,-5.01,;.67,-4.24,;4.67,-5.01,;6,-4.24,;7.34,-5.01,;6,-2.69,;.67,.38,;2,-.38,;.67,1.93,;-.67,2.69,;2,2.69,;2,4.24,;3.33,1.93,;4.67,2.69,;6,1.93,;7.34,2.69,;7.34,4.24,;8.67,1.93,;8.67,.38,;10,-.38,;7.34,-.38,;6,.38,;4.67,-.38,)|

CN(C)Cc1ccc(cn1)-c1cc(N(C)C2CCNCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN([C@@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:2.1,5.5,(-1.33,2.69,;,1.93,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;5.33,5,;2.67,5,;1.33,4.23,;,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;8,-4.23,;9.34,-1.93,;9.34,-.38,;10.67,.38,;8,.38,;6.67,-.38,;5.33,.38,;1.33,-.38,;2.67,.38,;-2.67,-2.69,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-6.67,-5,;-8,-4.23,;-8,-2.69,;-9.34,-1.94,;-10.67,-2.69,;-10.67,-4.23,;-9.34,-5,;-4,-5,;-2.67,-4.23,)|

CN([C@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:5.5,wD:2.1,(-1.33,2.69,;,1.93,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;5.33,5,;2.67,5,;1.33,4.23,;,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;8,-4.23,;9.34,-1.93,;9.34,-.38,;10.67,.38,;8,.38,;6.67,-.38,;5.33,.38,;1.33,-.38,;2.67,.38,;-2.67,-2.69,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-6.67,-5,;-8,-4.23,;-8,-2.69,;-9.34,-1.94,;-10.67,-2.69,;-10.67,-4.23,;-9.34,-5,;-4,-5,;-2.67,-4.23,)|

CN([C@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(C)c1 |r,wU:5.5,wD:2.1,(-4,-4.93,;-4,-3.39,;-5.33,-2.62,;-5.33,-1.08,;-6.67,-.31,;-8,-1.08,;-9.34,-.31,;-8,-2.62,;-6.67,-3.39,;-2.67,-2.62,;-2.67,-1.08,;-1.33,-.31,;,-1.08,;,-2.62,;1.33,-3.39,;1.33,-4.93,;2.67,-2.62,;4,-3.39,;5.33,-2.62,;6.67,-3.39,;6.67,-4.93,;8,-2.62,;8,-1.08,;9.34,-.31,;6.67,-.31,;5.33,-1.08,;4,-.31,;-1.33,-3.39,;-1.33,-4.93,;-1.33,1.23,;-.09,2.13,;-.56,3.6,;-2.1,3.6,;-2.87,4.93,;-2.58,2.13,)|

CN([C@@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(C)c1 |r,wU:2.1,5.5,(-4,-4.93,;-4,-3.39,;-5.33,-2.62,;-5.33,-1.08,;-6.67,-.31,;-8,-1.08,;-9.34,-.31,;-8,-2.62,;-6.67,-3.39,;-2.67,-2.62,;-2.67,-1.08,;-1.33,-.31,;,-1.08,;,-2.62,;1.33,-3.39,;1.33,-4.93,;2.67,-2.62,;4,-3.39,;5.33,-2.62,;6.67,-3.39,;6.67,-4.93,;8,-2.62,;8,-1.08,;9.34,-.31,;6.67,-.31,;5.33,-1.08,;4,-.31,;-1.33,-3.39,;-1.33,-4.93,;-1.33,1.23,;-.09,2.13,;-.56,3.6,;-2.1,3.6,;-2.87,4.93,;-2.58,2.13,)|

CN(C)Cc1ccc(cc1)-c1cc(N(C)[C@@H]2CC[C@H](N)CC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:15.15,18.19,(-10,-5,;-8.67,-4.23,;-8.67,-2.69,;-7.34,-5,;-6,-4.23,;-6,-2.69,;-4.67,-1.93,;-3.33,-2.69,;-3.33,-4.23,;-4.67,-5,;-2,-1.93,;-2,-.38,;-.67,.38,;-.67,1.93,;-2,2.69,;.67,2.69,;2,1.93,;3.33,2.69,;3.33,4.23,;4.67,5,;2,5,;.67,4.23,;.67,-.38,;2,.38,;.67,-1.93,;-.67,-2.69,;2,-2.69,;2,-4.23,;3.33,-1.93,;4.67,-2.69,;6,-1.93,;7.34,-2.69,;7.34,-4.23,;8.67,-1.93,;8.67,-.38,;10,.38,;7.34,.38,;6,-.38,;4.67,.38,)|

CN([C@@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(CCN2CCOCC2)c1 |r,wU:2.1,5.5,(-4,-6.44,;-4,-4.9,;-5.33,-4.13,;-5.33,-2.59,;-6.67,-1.82,;-8,-2.59,;-9.34,-1.82,;-8,-4.13,;-6.67,-4.9,;-2.67,-4.13,;-2.67,-2.59,;-1.33,-1.82,;,-2.59,;,-4.13,;1.33,-4.9,;1.33,-6.44,;2.67,-4.13,;4,-4.9,;5.33,-4.13,;6.67,-4.9,;6.67,-6.44,;8,-4.13,;8,-2.59,;9.34,-1.82,;6.67,-1.82,;5.33,-2.59,;4,-1.82,;-1.33,-4.9,;-1.33,-6.44,;-1.33,-.28,;-.09,.62,;-.56,2.09,;-2.1,2.09,;-3.19,3.18,;-4.68,2.78,;-5.77,3.87,;-5.37,5.35,;-6.46,6.44,;-7.95,6.04,;-8.35,4.56,;-7.26,3.47,;-2.58,.62,)|

CN([C@@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1 |r,wU:2.1,5.5,(-1.33,2.69,;,1.93,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;5.33,5,;2.67,5,;1.33,4.23,;,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;8,-4.23,;9.34,-1.93,;9.34,-.38,;10.67,.38,;8,.38,;6.67,-.38,;5.33,.38,;1.33,-.38,;2.67,.38,;-2.67,-2.69,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-6.67,-5,;-8,-4.23,;-8,-2.69,;-9.34,-1.94,;-10.67,-2.69,;-10.67,-4.23,;-9.34,-5,;-4,-5,;-2.67,-4.23,)|

CN([C@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1 |r,wU:5.5,wD:2.1,(-1.33,2.69,;,1.93,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;5.33,5,;2.67,5,;1.33,4.23,;,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;8,-4.23,;9.34,-1.93,;9.34,-.38,;10.67,.38,;8,.38,;6.67,-.38,;5.33,.38,;1.33,-.38,;2.67,.38,;-2.67,-2.69,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-6.67,-5,;-8,-4.23,;-8,-2.69,;-9.34,-1.92,;-10.67,-2.69,;-10.67,-4.23,;-9.34,-5,;-4,-5,;-2.67,-4.23,)|

CN([C@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(CCN2CCOCC2)c1 |r,wU:5.5,wD:2.1,(-4,-6.44,;-4,-4.9,;-5.33,-4.13,;-5.33,-2.59,;-6.67,-1.82,;-8,-2.59,;-9.34,-1.82,;-8,-4.13,;-6.67,-4.9,;-2.67,-4.13,;-2.67,-2.59,;-1.33,-1.82,;,-2.59,;,-4.13,;1.33,-4.9,;1.33,-6.44,;2.67,-4.13,;4,-4.9,;5.33,-4.13,;6.67,-4.9,;6.67,-6.44,;8,-4.13,;8,-2.59,;9.34,-1.82,;6.67,-1.82,;5.33,-2.59,;4,-1.82,;-1.33,-4.9,;-1.33,-6.44,;-1.33,-.28,;-.09,.62,;-.56,2.09,;-2.1,2.09,;-3.19,3.18,;-4.68,2.78,;-5.77,3.87,;-5.37,5.35,;-6.46,6.44,;-7.95,6.04,;-8.35,4.56,;-7.26,3.47,;-2.58,.62,)|

CN(C)Cc1ccc(cn1)-c1cc(N(C)[C@@H]2CC[C@H](N)CC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:15.15,18.19,(-10,-5,;-8.67,-4.23,;-8.67,-2.69,;-7.34,-5,;-6,-4.23,;-4.67,-5,;-3.33,-4.23,;-3.33,-2.69,;-4.67,-1.93,;-6,-2.69,;-2,-1.93,;-2,-.38,;-.67,.38,;-.67,1.93,;-2,2.69,;.67,2.69,;2,1.93,;3.33,2.69,;3.33,4.23,;4.67,5,;2,5,;.67,4.23,;.67,-.38,;2,.38,;.67,-1.93,;-.67,-2.69,;2,-2.69,;2,-4.23,;3.33,-1.93,;4.67,-2.69,;6,-1.93,;7.34,-2.69,;7.34,-4.23,;8.67,-1.93,;8.67,-.38,;10,.38,;7.34,.38,;6,-.38,;4.67,.38,)|

CN(C)Cc1ccc(cn1)-c1cc(N(C)[C@H]2CC[C@H](N)CC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:18.19,wD:15.15,(-10,-5,;-8.67,-4.23,;-8.67,-2.69,;-7.34,-5,;-6,-4.23,;-4.67,-5,;-3.33,-4.23,;-3.33,-2.69,;-4.67,-1.93,;-6,-2.69,;-2,-1.93,;-2,-.38,;-.67,.38,;-.67,1.93,;-2,2.69,;.67,2.69,;2,1.93,;3.33,2.69,;3.33,4.23,;4.67,5,;2,5,;.67,4.23,;.67,-.38,;2,.38,;.67,-1.93,;-.67,-2.69,;2,-2.69,;2,-4.23,;3.33,-1.93,;4.67,-2.69,;6,-1.93,;7.34,-2.69,;7.34,-4.23,;8.67,-1.93,;8.67,-.38,;10,.38,;7.34,.38,;6,-.38,;4.67,.38,)|

CN([C@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1 |r,wU:5.8,wD:2.1,(-1.33,2.69,;,1.92,;1.33,2.69,;2.67,1.92,;4,2.69,;4,4.23,;2.67,5,;1.33,4.23,;5.33,5,;6.67,4.24,;8,5.01,;6.67,2.7,;,.38,;-1.33,-.39,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.7,;2.67,-4.24,;4,-1.93,;5.33,-2.7,;6.67,-1.93,;8,-2.7,;8,-4.24,;9.34,-1.93,;9.34,-.39,;10.67,.38,;8,.38,;6.67,-.39,;5.33,.38,;1.33,-.39,;2.67,.38,;-2.67,-2.7,;-4,-1.93,;-5.33,-2.7,;-5.33,-4.24,;-6.67,-5.01,;-8,-4.24,;-8,-2.7,;-9.34,-1.94,;-10.67,-2.7,;-10.67,-4.24,;-9.34,-5,;-4,-5.01,;-2.67,-4.24,)|

CN(C)Cc1ccc(cn1)-c1cc(N(C)[C@@H]2CC[C@@H](CC2)NC(C)=O)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wD:15.15,18.22,(-10,5.01,;-8.67,4.24,;-8.67,2.69,;-7.34,5.01,;-6,4.24,;-4.67,5.01,;-3.33,4.24,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-2,1.93,;-2,.38,;-.67,-.38,;-.67,-1.93,;-2,-2.69,;.67,-2.69,;2,-1.93,;3.33,-2.69,;3.33,-4.24,;2,-5.01,;.67,-4.24,;4.67,-5.01,;6,-4.24,;7.34,-5.01,;6,-2.69,;.67,.38,;2,-.38,;.67,1.93,;-.67,2.69,;2,2.69,;2,4.24,;3.33,1.93,;4.67,2.69,;6,1.93,;7.34,2.69,;7.34,4.24,;8.67,1.93,;8.67,.38,;10,-.38,;7.34,-.38,;6,.38,;4.67,-.38,)|

CN([C@@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CO)nc1 |r,wD:2.1,5.8,(-2.67,-2.69,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;1.33,-5,;,-4.23,;4,-5,;5.33,-4.23,;6.67,-5,;5.33,-2.69,;-1.33,-.38,;-2.67,.38,;-2.67,1.93,;-1.33,2.69,;,1.93,;1.33,2.69,;1.33,4.23,;2.67,1.93,;4,2.69,;5.33,1.93,;6.67,2.69,;6.67,4.23,;8,1.93,;8,.38,;9.34,-.38,;6.67,-.38,;5.33,.38,;4,-.38,;,.38,;1.33,-.38,;-4,2.69,;-5.33,1.93,;-6.67,2.69,;-6.67,4.23,;-8,5,;-9.34,4.23,;-5.33,5,;-4,4.23,)|

CN([C@@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1 |r,wU:2.1,5.8,(-1.33,2.69,;,1.93,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;2.67,5,;1.33,4.23,;5.33,5,;6.67,4.23,;8,5,;6.67,2.69,;,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;8,-4.23,;9.34,-1.93,;9.34,-.38,;10.67,.38,;8,.38,;6.67,-.38,;5.33,.38,;1.33,-.38,;2.67,.38,;-2.67,-2.69,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-6.67,-5,;-8,-4.23,;-8,-2.69,;-9.34,-1.92,;-10.67,-2.69,;-10.67,-4.23,;-9.34,-5,;-4,-5,;-2.67,-4.23,)|

CCCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CC(C)CN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

Cc1cc(C)c(CNC(=O)c2cc(cc(N(CC3CC3)C3CCOCC3)c2C)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

CCCCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

Cc1cc(C)c(CNC(=O)c2cc(cc(N(CC3CCC3)C3CCOCC3)c2C)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN(C)C)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(C)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2C[C@H]3C[C@@H]2CO3)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2C[C@@H]3C[C@H]2CO3)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC[C@H](O)C2)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC[C@@H](O)C2)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC[C@H](F)C2)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCNCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC[C@@H](F)C2)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCC[C@H](O)C2)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCC[C@@H](O)C2)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCC(O)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCC(F)C2)cc1 |w:38.41|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCC(F)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCC(F)(F)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC(O)C2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC(F)C2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCNCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCN(C)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNC)cc1

CCNCc1ccc(cc1)-c1cc(N(CC)C2CCOCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNC(C)C)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNCC2CC2)cc1

CCN(CC)Cc1ccc(cc1)-c1cc(N(CC)C2CCOCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNC[C@@H](O)CO)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNC[C@H](O)CO)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN(C)CC2CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNCCO)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNCCCO)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN(CCO)CCO)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNCCN)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNCCCN)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNCC(F)F)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNCC(F)(F)F)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC3(COC3)C2)cc1

CN(C)Cc1ccc(cc1)-c1cc(N(C)[C@H]2CC[C@H](N)CC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:15.15,wD:18.19,(9.34,6.16,;8,5.39,;6.67,6.16,;8,3.85,;6.67,3.08,;6.67,1.54,;5.33,.77,;4,1.54,;4,3.08,;5.33,3.85,;2.67,.77,;2.67,-.77,;1.33,-1.54,;1.33,-3.08,;,-3.85,;2.67,-3.85,;4,-3.08,;5.33,-3.85,;5.33,-5.39,;6.67,-6.16,;4,-6.16,;2.67,-5.39,;,-.77,;-1.33,-1.54,;,.77,;1.33,1.54,;-1.33,1.54,;-1.33,3.08,;-2.67,.77,;-4,1.54,;-5.33,.77,;-5.33,-.77,;-4,-1.54,;-6.67,-1.54,;-8,-.77,;-9.34,-1.54,;-8,.77,;-6.67,1.54,;-6.67,3.08,)|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(C)c1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN(C)C)nc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(C)CC2)nc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(C)cc1

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CCN(C1CCS(=O)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(C[N+]2([O-])CCOCC2)cc1

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CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(C)CC1

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CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCNCC1

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CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)c(Br)c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)c(F)c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cn(C)cn1 |r,wU:3.2,wD:6.9,(-2,5.32,;-3.33,4.55,;-3.33,3.01,;-4.67,2.24,;-4.67,.7,;-6,-.07,;-7.34,.7,;-7.34,2.24,;-6,3.01,;-8.67,-.07,;-10,.7,;-8.67,-1.61,;-2,2.24,;-2,.7,;-.67,-.07,;.67,.7,;.67,2.24,;2,3.01,;2,4.55,;3.33,2.24,;4.67,3.01,;6,2.24,;7.34,3.01,;7.34,4.55,;8.67,2.24,;8.67,.7,;10,-.07,;7.34,-.07,;6,.7,;4.67,-.07,;-.67,3.01,;-.67,4.55,;-.67,-1.61,;.58,-2.52,;.1,-3.98,;.87,-5.32,;-1.44,-3.98,;-1.91,-2.52,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(cc1)C(=O)N1CCC1 |r,wU:3.2,wD:6.9,(2.28,8,;1.51,6.67,;2.28,5.33,;3.82,5.33,;4.59,6.67,;6.13,6.67,;6.9,5.33,;6.13,4,;4.59,4,;8.44,5.33,;9.21,4,;9.21,6.67,;1.51,4,;-.03,4,;-.8,2.67,;-.03,1.33,;1.51,1.33,;2.28,,;3.82,,;1.51,-1.33,;2.28,-2.67,;1.51,-4,;2.28,-5.33,;3.82,-5.33,;1.51,-6.67,;-.03,-6.67,;-.8,-8,;-.8,-5.33,;-.03,-4,;-.8,-2.67,;2.28,2.67,;3.82,2.67,;-2.34,2.67,;-3.11,4,;-4.65,4,;-5.42,2.67,;-4.65,1.33,;-3.11,1.33,;-6.96,2.67,;-7.73,1.33,;-7.73,4,;-7.33,5.49,;-8.82,5.89,;-9.21,4.4,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(cc1)C(=O)NCCCO |r,wU:3.2,wD:6.9,(,-4.24,;,-2.7,;-1.33,-1.93,;-2.67,-2.7,;-2.67,-4.23,;-4,-5.01,;-5.33,-4.23,;-5.33,-2.7,;-4,-1.93,;-6.67,-5,;-8,-4.23,;-6.67,-6.54,;-1.33,-.39,;,.38,;,1.92,;-1.33,2.69,;-2.67,1.92,;-4,2.69,;-4,4.23,;-5.33,1.92,;-6.67,2.69,;-8,1.92,;-8,.38,;-6.67,-.39,;-9.34,-.39,;-10.67,.38,;-12,-.39,;-10.67,1.92,;-9.34,2.69,;-9.34,4.23,;-2.67,.38,;-4,-.38,;1.33,2.69,;1.33,4.23,;2.67,5,;4,4.23,;4,2.69,;2.67,1.92,;5.33,5,;5.33,6.54,;6.67,4.23,;8,5,;9.34,4.23,;10.67,5,;12,4.23,)|

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(N(CC)C2CCOCC2)c1C)-c1ccc(nc1)N1CCN(C)CC1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(N(CC)C2CCOCC2)c1C)-c1ccc(nc1)N1CCNCC1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1ccc(nc1)N1CCNCC1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1ccc(nc1)N1CCN(C)CC1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1ccc(nc1)N1CCN(CC1)C1CCN(C)CC1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(N(CC)C2CCOCC2)c1C)-c1ccc(nc1)N1CCN(CC1)C1CCN(C)CC1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1ccc(CN2CCOCC2)nc1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(N(CC)C2CCOCC2)c1C)-c1ccc(CN2CCOCC2)nc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCC(CC1)N(C)C

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1ccc(nc1)N1CCC(CC1)N(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(N(CC)C2CCOCC2)c1C)-c1ccc(nc1)N1CCC(CC1)N(C)C

NC(CCN(CCNCCc1ccc(Cl)cc1)CC1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O |r|

CC(C)n1ncc2c(cc(C)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CNc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

CN(C1CCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1=CC(C)(C)NC(C)(C)C1 |t:30|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-5.33,4.24,;-5.33,2.69,;-4,1.93,;-4,.38,;-2.67,-.38,;-2.67,-1.93,;-4,-2.69,;-5.33,-1.93,;-5.33,-.38,;-4,-4.24,;-2.67,-5.01,;-5.33,-5.01,;-2.67,2.69,;-2.67,4.24,;-1.33,5.01,;-1.33,6.55,;,4.24,;,2.69,;1.33,1.93,;2.67,2.69,;1.33,.38,;2.67,-.38,;2.67,-1.93,;4,-2.69,;5.33,-1.93,;4,-4.24,;2.67,-5.01,;2.67,-6.55,;1.33,-4.24,;1.33,-2.69,;,-1.93,;-1.33,1.93,;-1.33,.38,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)n(C)c2=O)c1C |r,wU:3.2,wD:6.9,(-5.33,4.23,;-5.33,2.69,;-4,1.93,;-4,.38,;-2.67,-.38,;-2.67,-1.93,;-4,-2.69,;-5.33,-1.93,;-5.33,-.38,;-4,-4.23,;-2.67,-5,;-5.33,-5,;-2.67,2.69,;-2.67,4.23,;-1.33,5,;-1.33,6.54,;,4.23,;,2.69,;1.33,1.93,;2.67,2.69,;1.33,.38,;2.67,-.38,;2.67,-1.93,;4,-2.69,;5.33,-1.93,;4,-4.23,;2.67,-5,;2.67,-6.54,;1.33,-4.23,;,-5,;1.33,-2.69,;,-1.93,;-1.33,1.93,;-1.33,.38,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)N(C)Cc2c(C)cc(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-5.33,.77,;-5.33,-.77,;-4,-1.54,;-4,-3.08,;-2.67,-3.85,;-2.67,-5.39,;-4,-6.16,;-5.33,-5.39,;-5.33,-3.85,;-4,-7.7,;-2.67,-8.47,;-5.33,-8.47,;-2.67,-.77,;-1.33,-1.54,;,-.77,;1.33,-1.54,;,.77,;-1.33,1.54,;-1.33,3.08,;-2.67,3.85,;,3.85,;1.33,3.08,;,5.39,;1.33,6.16,;1.33,7.7,;,8.47,;2.67,8.47,;4,7.7,;5.33,8.47,;4,6.16,;2.67,5.39,;2.67,3.85,;-2.67,.77,;-4,1.54,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C#C |r,wU:3.2,wD:6.9,(-5.33,3.47,;-5.33,1.93,;-4,1.15,;-4,-.38,;-2.67,-1.15,;-2.67,-2.69,;-4,-3.47,;-5.33,-2.69,;-5.33,-1.15,;-4,-5,;-2.67,-5.78,;-5.33,-5.78,;-2.67,1.93,;-2.67,3.47,;-1.33,4.23,;,3.47,;,1.93,;1.33,1.15,;2.67,1.93,;1.33,-.38,;2.67,-1.15,;2.67,-2.69,;4,-3.47,;5.33,-2.69,;4,-5,;2.67,-5.78,;2.67,-7.31,;1.33,-5,;1.33,-3.47,;,-2.69,;-1.33,1.15,;-1.33,-.38,;-1.33,5.78,;-1.33,7.31,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C1CCC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-6.67,.32,;-5.33,-.45,;-4,.32,;-2.67,-.45,;-1.33,.32,;,-.45,;,-1.99,;-1.33,-2.76,;-2.67,-1.99,;1.33,-2.76,;2.67,-1.99,;1.33,-4.3,;.24,-5.39,;1.33,-6.48,;2.42,-5.39,;-4,1.86,;-5.33,2.63,;-5.33,4.17,;-6.67,4.94,;-4,4.94,;-2.67,4.17,;-1.33,4.94,;-1.33,6.48,;,4.17,;1.33,4.94,;2.67,4.17,;4,4.94,;4,6.48,;5.33,4.17,;5.33,2.63,;6.67,1.86,;4,1.86,;2.67,2.63,;1.33,1.86,;-2.67,2.63,;-1.33,1.86,)|

CCN([C@H]1CC[C@@H](CC1)N1CCC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-5.33,1.47,;-5.33,-.07,;-4,-.84,;-4,-2.38,;-2.67,-3.15,;-2.67,-4.69,;-4,-5.46,;-5.33,-4.69,;-5.33,-3.15,;-4,-7,;-5.09,-8.08,;-4,-9.17,;-2.91,-8.08,;-2.67,-.07,;-1.33,-.84,;,-.07,;1.33,-.84,;,1.47,;-1.33,2.24,;-1.33,3.78,;-2.67,4.55,;,4.55,;,6.09,;1.33,6.86,;1.33,8.4,;,9.17,;2.67,9.17,;4,8.4,;5.33,9.17,;4,6.86,;2.67,6.09,;2.67,4.55,;-2.67,1.47,;-4,2.24,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C(F)(F)F |r,wU:3.2,wD:6.9,(-5.33,.77,;-5.33,-.77,;-4,-1.54,;-4,-3.08,;-2.67,-3.85,;-2.67,-5.39,;-4,-6.16,;-5.33,-5.39,;-5.33,-3.85,;-4,-7.7,;-2.67,-8.47,;-5.33,-8.47,;-2.67,-.77,;-1.33,-1.54,;,-.77,;,.77,;-1.33,1.54,;-1.33,3.08,;-2.67,3.85,;,3.85,;,5.39,;1.33,6.16,;1.33,7.7,;,8.47,;2.67,8.47,;4,7.7,;5.33,8.47,;4,6.16,;2.67,5.39,;2.67,3.85,;-2.67,.77,;-4,1.54,;1.33,-1.54,;2.67,-2.31,;2.1,-.21,;.56,-2.87,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cncc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-5.33,.77,;-5.33,-.77,;-4,-1.54,;-4,-3.08,;-2.67,-3.85,;-2.67,-5.39,;-4,-6.16,;-5.33,-5.39,;-5.33,-3.85,;-4,-7.7,;-2.67,-8.47,;-5.33,-8.47,;-2.67,-.77,;-1.33,-1.54,;,-.77,;,.77,;-1.33,1.54,;-1.33,3.08,;-2.67,3.85,;,3.85,;,5.39,;1.33,6.16,;1.33,7.7,;,8.47,;2.67,8.47,;4,7.7,;5.33,8.47,;4,6.16,;2.67,5.39,;2.67,3.85,;-2.67,.77,;-4,1.54,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(OC)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-5.33,.77,;-5.33,-.77,;-4,-1.54,;-4,-3.08,;-2.67,-3.85,;-2.67,-5.39,;-4,-6.16,;-5.33,-5.39,;-5.33,-3.85,;-4,-7.7,;-2.67,-8.47,;-5.33,-8.47,;-2.67,-.77,;-1.33,-1.54,;,-.77,;1.33,-1.54,;1.33,-3.08,;,.77,;-1.33,1.54,;-1.33,3.08,;-2.67,3.85,;,3.85,;,5.39,;1.33,6.16,;1.33,7.7,;,8.47,;2.67,8.47,;4,7.7,;5.33,8.47,;4,6.16,;2.67,5.39,;2.67,3.85,;-2.67,.77,;-4,1.54,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)S(=O)(=O)CC |r,wU:3.2,wD:6.9,(-5.33,3.08,;-5.33,1.54,;-4,.77,;-4,-.77,;-2.67,-1.54,;-2.67,-3.08,;-4,-3.85,;-5.33,-3.08,;-5.33,-1.54,;-4,-5.39,;-2.67,-6.16,;-5.33,-6.16,;-2.67,1.54,;-2.67,3.08,;-1.33,3.85,;,3.08,;,1.54,;1.33,.77,;2.67,1.54,;1.33,-.77,;2.67,-1.54,;2.67,-3.08,;4,-3.85,;5.33,-3.08,;4,-5.39,;2.67,-6.16,;2.67,-7.7,;1.33,-5.39,;1.33,-3.85,;,-3.08,;-1.33,.77,;-1.33,-.77,;-1.33,5.39,;.21,5.39,;-2.87,5.39,;-1.33,6.93,;,7.7,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C(C)C |r,wU:3.2,wD:6.9,(-5.33,3.85,;-5.33,2.31,;-4,1.54,;-4,,;-2.67,-.77,;-2.67,-2.31,;-4,-3.08,;-5.33,-2.31,;-5.33,-.77,;-4,-4.62,;-2.67,-5.39,;-5.33,-5.39,;-2.67,2.31,;-2.67,3.85,;-1.33,4.62,;,3.85,;,2.31,;1.33,1.54,;2.67,2.31,;1.33,,;2.67,-.77,;2.67,-2.31,;4,-3.08,;5.33,-2.31,;4,-4.62,;2.67,-5.39,;2.67,-6.93,;1.33,-4.62,;1.33,-3.08,;,-2.31,;-1.33,1.54,;-1.33,,;-1.33,6.16,;-2.67,6.93,;,6.93,)|

CC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(CC)[nH]c2=O)c1C

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C#CC1CC1 |r,wU:3.2,wD:6.9,(-2,5.67,;-3.33,4.9,;-3.33,3.36,;-4.67,2.59,;-4.67,1.05,;-6,.28,;-7.34,1.05,;-7.34,2.59,;-6,3.36,;-8.67,.28,;-10,1.05,;-8.67,-1.26,;-2,2.59,;-2,1.05,;-.67,.28,;.67,1.05,;.67,2.59,;2,3.36,;2,4.9,;3.33,2.59,;4.67,3.36,;6,2.59,;7.34,3.36,;7.34,4.9,;8.67,2.59,;8.67,1.05,;10,.28,;7.34,.28,;6,1.05,;4.67,.28,;-.67,3.36,;-.67,4.9,;-.67,-1.26,;-.67,-2.8,;-.67,-4.34,;-1.44,-5.67,;.1,-5.67,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1CC |r,wU:3.2,wD:6.9,(-5.33,.77,;-5.33,-.77,;-4,-1.54,;-4,-3.08,;-2.67,-3.85,;-2.67,-5.39,;-4,-6.16,;-5.33,-5.39,;-5.33,-3.85,;-4,-7.7,;-2.67,-8.47,;-5.33,-8.47,;-2.67,-.77,;-1.33,-1.54,;,-.77,;1.33,-1.54,;,.77,;-1.33,1.54,;-1.33,3.08,;-2.67,3.85,;,3.85,;,5.39,;1.33,6.16,;1.33,7.7,;,8.47,;2.67,8.47,;4,7.7,;5.33,8.47,;4,6.16,;2.67,5.39,;2.67,3.85,;-2.67,.77,;-4,1.54,;-4,3.08,)|

CCN([C@@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1CC |r,wD:3.2,6.9,(-5.33,.77,;-5.33,-.77,;-4,-1.54,;-4,-3.08,;-2.67,-3.85,;-2.67,-5.39,;-4,-6.16,;-5.33,-5.39,;-5.33,-3.85,;-4,-7.7,;-2.67,-8.47,;-5.33,-8.47,;-2.67,-.77,;-1.33,-1.54,;,-.77,;1.33,-1.54,;,.77,;-1.33,1.54,;-1.33,3.08,;-2.67,3.85,;,3.85,;,5.39,;1.33,6.16,;1.33,7.7,;,8.47,;2.67,8.47,;4,7.7,;5.33,8.47,;4,6.16,;2.67,5.39,;2.67,3.85,;-2.67,.77,;-4,1.54,;-4,3.08,)|

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CCN(CCCOC)c1cccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

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CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C#CC(C)(C)C |r,wU:3.2,wD:6.9,(-5.33,.77,;-5.33,-.77,;-4,-1.54,;-4,-3.08,;-2.67,-3.85,;-2.67,-5.39,;-4,-6.16,;-5.33,-5.39,;-5.33,-3.85,;-4,-7.7,;-2.67,-8.47,;-5.33,-8.47,;-2.67,-.77,;-1.33,-1.54,;,-.77,;,.77,;-1.33,1.54,;-1.33,3.08,;-2.67,3.85,;,3.85,;,5.39,;1.33,6.16,;1.33,7.7,;,8.47,;2.67,8.47,;4,7.7,;5.33,8.47,;4,6.16,;2.67,5.39,;2.67,3.85,;-2.67,.77,;-4,1.54,;1.33,-1.54,;2.67,-2.31,;4,-3.08,;5.33,-3.85,;4.77,-1.75,;3.23,-4.41,)|

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CCN([C@H]1CC[C@@H](CC1)N(C)C1COC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-2.67,-3.15,;-1.33,-3.92,;,-3.15,;1.33,-3.92,;2.67,-3.15,;4,-3.92,;4,-5.46,;2.67,-6.23,;1.33,-5.46,;5.33,-6.23,;6.67,-5.46,;5.33,-7.77,;4.25,-8.85,;5.33,-9.94,;6.42,-8.85,;,-1.61,;1.33,-.84,;1.33,.7,;2.67,1.47,;,1.47,;-1.33,.7,;-2.67,1.47,;-4,.7,;-2.67,3.01,;-4,3.78,;-4,5.32,;-5.33,6.09,;-6.67,5.32,;-5.33,7.63,;-4,8.4,;-4,9.94,;-2.67,7.63,;-2.67,6.09,;-1.33,5.32,;-1.33,-.84,;-2.67,-1.61,)|

CCN(C1CCC(C)(C)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

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CCN(C1CCN(CC1)C(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

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CCN(C1CN(C)C1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

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CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)cc(N(CC)C2CCN(C)CC2)c1C

N[C@@H](CCN(CCNCCc1ccc(Cl)cc1)CC1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O |r|

CCN(C1CCOCC1)c1scc(C(=O)NCc2c(C)[nH]c(C)cc2=O)c1C

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CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C#CC1CCN(C)CC1

CC(C)n1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)[nH]c(C)cc1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)[nH]c(C)cc1=O

CCC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)[nH]c(C)cc1=O

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(CCN(C)C)cc3CCNn3c2=O)c1C |r,wU:3.2,wD:6.9,(-8.52,,;-7.19,-.77,;-5.85,,;-5.85,1.54,;-7.19,2.31,;-7.19,3.85,;-5.85,4.62,;-4.52,3.85,;-4.52,2.31,;-5.85,6.16,;-4.52,6.93,;-7.19,6.93,;-4.52,-.77,;-4.52,-2.31,;-3.19,-3.08,;-3.19,-4.62,;-1.85,-2.31,;-1.85,-.77,;-.52,,;-.52,1.54,;.82,-.77,;2.15,,;3.48,-.77,;3.48,-2.31,;2.15,-3.08,;2.15,-4.62,;.82,-5.39,;.82,-6.93,;-.52,-4.62,;4.82,-3.08,;6.15,-2.31,;7.61,-2.79,;8.52,-1.54,;7.61,-.29,;6.15,-.77,;4.82,,;4.82,1.54,;-3.19,,;-3.19,1.54,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc3cc[nH]n3c2=O)c1C |r,wU:6.9,wD:3.2,(-2.82,1.54,;-1.48,.77,;-.15,1.54,;-.15,3.08,;1.18,3.85,;1.18,5.39,;-.15,6.16,;-1.48,5.39,;-1.48,3.85,;-.15,7.7,;1.18,8.47,;-1.48,8.47,;1.18,.77,;2.52,1.54,;3.85,.77,;5.19,1.54,;3.85,-.77,;2.52,-1.54,;2.52,-3.08,;3.85,-3.85,;1.18,-3.85,;1.18,-5.39,;-.15,-6.16,;-.15,-7.7,;1.18,-8.47,;-1.48,-8.47,;-2.82,-7.7,;-4.28,-8.18,;-5.19,-6.93,;-4.28,-5.68,;-2.82,-6.16,;-1.48,-5.39,;-1.48,-3.85,;1.18,-.77,;-.15,-1.54,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)nc3cc[nH]n3c2=O)c1C |r,wU:6.9,wD:3.2,(-2.82,1.54,;-1.48,.77,;-.15,1.54,;-.15,3.08,;1.18,3.85,;1.18,5.39,;-.15,6.16,;-1.48,5.39,;-1.48,3.85,;-.15,7.7,;1.18,8.47,;-1.48,8.47,;1.18,.77,;2.52,1.54,;3.85,.77,;5.19,1.54,;3.85,-.77,;2.52,-1.54,;2.52,-3.08,;3.85,-3.85,;1.18,-3.85,;1.18,-5.39,;-.15,-6.16,;-.15,-7.7,;1.18,-8.47,;-1.48,-8.47,;-2.82,-7.7,;-4.28,-8.18,;-5.19,-6.93,;-4.28,-5.68,;-2.82,-6.16,;-1.48,-5.39,;-1.48,-3.85,;1.18,-.77,;-.15,-1.54,)|

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CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)[nH][nH]c2=O)c1C)-c1ccc(OCCOC)cc1 |r,wU:6.9,wD:3.2,(-7.48,-.77,;-7.48,.77,;-6.15,1.54,;-6.15,3.08,;-4.82,3.85,;-4.82,5.39,;-6.15,6.16,;-7.48,5.39,;-7.48,3.85,;-6.15,7.7,;-4.82,8.47,;-7.48,8.47,;-4.82,.77,;-3.48,1.54,;-2.15,.77,;-2.15,-.77,;-3.48,-1.54,;-3.48,-3.08,;-2.15,-3.85,;-4.82,-3.85,;-4.82,-5.39,;-6.15,-6.16,;-6.15,-7.7,;-4.82,-8.47,;-7.61,-8.18,;-8.52,-6.93,;-7.61,-5.68,;-8.38,-4.35,;-4.82,-.77,;-6.15,-1.54,;-.82,1.54,;.52,.77,;1.85,1.54,;1.85,3.08,;3.19,3.85,;4.52,3.08,;5.85,3.85,;7.19,3.08,;8.52,3.85,;.52,3.85,;-.82,3.08,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2cn(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-7.19,-1.15,;-5.85,-1.93,;-4.52,-1.15,;-4.52,.38,;-5.85,1.15,;-5.85,2.69,;-4.52,3.47,;-3.19,2.69,;-3.19,1.15,;-4.52,5,;-3.19,5.78,;-5.85,5.78,;-3.19,-1.93,;-3.19,-3.47,;-1.85,-4.23,;-1.85,-5.78,;-.52,-3.47,;-.52,-1.93,;.82,-1.15,;.82,.38,;2.15,-1.93,;3.48,-1.15,;4.82,-1.93,;4.82,-3.47,;6.28,-3.94,;7.05,-5.27,;7.19,-2.69,;6.28,-1.45,;7.05,-.12,;-1.85,-1.15,;-1.85,.38,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(SC)n(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-7.19,-1.15,;-5.85,-1.93,;-4.52,-1.15,;-4.52,.38,;-5.85,1.15,;-5.85,2.69,;-4.52,3.47,;-3.19,2.69,;-3.19,1.15,;-4.52,5,;-3.19,5.78,;-5.85,5.78,;-3.19,-1.93,;-3.19,-3.47,;-1.85,-4.23,;-1.85,-5.78,;-.52,-3.47,;-.52,-1.93,;.82,-1.15,;.82,.38,;2.15,-1.93,;3.48,-1.15,;4.82,-1.93,;4.82,-3.47,;3.73,-4.55,;2.24,-4.16,;6.28,-3.94,;7.05,-5.27,;7.19,-2.69,;6.28,-1.45,;7.05,-.12,;-1.85,-1.15,;-1.85,.38,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH][nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-7.19,-1.15,;-5.85,-1.93,;-4.52,-1.15,;-4.52,.38,;-5.85,1.15,;-5.85,2.69,;-4.52,3.47,;-3.19,2.69,;-3.19,1.15,;-4.52,5,;-3.19,5.78,;-5.85,5.78,;-3.19,-1.93,;-3.19,-3.47,;-1.85,-4.23,;-1.85,-5.78,;-.52,-3.47,;-.52,-1.93,;.82,-1.15,;.82,.38,;2.15,-1.93,;3.48,-1.15,;4.82,-1.93,;4.82,-3.47,;3.48,-4.23,;6.28,-3.94,;7.19,-2.69,;6.28,-1.45,;7.05,-.12,;-1.85,-1.15,;-1.85,.38,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]nc2OC)c1C |r,wU:3.2,wD:6.9,(-7.19,-1.15,;-5.85,-1.93,;-4.52,-1.15,;-4.52,.38,;-5.85,1.15,;-5.85,2.69,;-4.52,3.47,;-3.19,2.69,;-3.19,1.15,;-4.52,5,;-3.19,5.78,;-5.85,5.78,;-3.19,-1.93,;-3.19,-3.47,;-1.85,-4.23,;-1.85,-5.78,;-.52,-3.47,;-.52,-1.93,;.82,-1.15,;.82,.38,;2.15,-1.93,;3.48,-1.15,;4.82,-1.93,;6.28,-1.45,;7.05,-.12,;7.19,-2.69,;6.28,-3.94,;4.82,-3.47,;3.73,-4.55,;2.24,-4.16,;-1.85,-1.15,;-1.85,.38,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-7.93,-1.15,;-6.6,-1.93,;-5.26,-1.15,;-5.26,.38,;-6.6,1.15,;-6.6,2.69,;-5.26,3.47,;-3.93,2.69,;-3.93,1.15,;-5.26,5,;-3.93,5.78,;-6.6,5.78,;-3.93,-1.93,;-3.93,-3.47,;-2.6,-4.23,;-2.6,-5.78,;-1.26,-3.47,;-1.26,-1.93,;.07,-1.15,;.07,.38,;1.41,-1.93,;2.74,-1.15,;4.07,-1.93,;5.54,-1.45,;6.31,-.12,;6.44,-2.69,;7.93,-2.3,;5.54,-3.94,;4.07,-3.47,;2.74,-4.23,;-2.6,-1.15,;-2.6,.38,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C |r,wU:6.9,wD:3.2,(-3.41,1.54,;-2.07,.77,;-.74,1.54,;-.74,3.08,;.59,3.85,;.59,5.39,;-.74,6.16,;-2.07,5.39,;-2.07,3.85,;-.74,7.7,;.59,8.47,;-2.07,8.47,;.59,.77,;1.93,1.54,;3.26,.77,;4.6,1.54,;3.26,-.77,;1.93,-1.54,;1.93,-3.08,;3.26,-3.85,;.59,-3.85,;.59,-5.39,;-.74,-6.16,;-.74,-7.7,;.59,-8.47,;-2.2,-8.18,;-3.11,-6.93,;-4.6,-6.53,;-2.2,-5.68,;-2.97,-4.35,;.59,-.77,;-.74,-1.54,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C)-c1ccc(OCCOC)cc1 |r,wU:6.9,wD:3.2,(-6.74,1.54,;-5.41,.77,;-4.07,1.54,;-4.07,3.08,;-2.74,3.85,;-2.74,5.39,;-4.07,6.16,;-5.41,5.39,;-5.41,3.85,;-4.07,7.7,;-2.74,8.47,;-5.41,8.47,;-2.74,.77,;-1.41,1.54,;-.07,.77,;-.07,-.77,;-1.41,-1.54,;-1.41,-3.08,;-.07,-3.85,;-2.74,-3.85,;-2.74,-5.39,;-4.07,-6.16,;-4.07,-7.7,;-2.74,-8.47,;-5.54,-8.18,;-6.44,-6.93,;-7.93,-6.53,;-5.54,-5.68,;-6.31,-4.35,;-2.74,-.77,;-4.07,-1.54,;1.26,1.54,;2.6,.77,;3.93,1.54,;3.93,3.08,;5.26,3.85,;6.6,3.08,;7.93,3.85,;7.93,5.39,;6.6,6.16,;2.6,3.85,;1.26,3.08,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(CC)c2=O)c1C |r,wU:6.9,wD:3.2,(-2.86,1.54,;-1.53,.77,;-.19,1.54,;-.19,3.08,;1.14,3.85,;1.14,5.39,;-.19,6.16,;-1.53,5.39,;-1.53,3.85,;-.19,7.7,;1.14,8.47,;-1.53,8.47,;1.14,.77,;2.47,1.54,;3.81,.77,;5.14,1.54,;3.81,-.77,;2.47,-1.54,;2.47,-3.08,;3.81,-3.85,;1.14,-3.85,;1.14,-5.39,;-.19,-6.16,;-.19,-7.7,;1.14,-8.47,;-1.66,-8.18,;-2.56,-6.93,;-4.05,-6.53,;-5.14,-7.62,;-1.66,-5.68,;-2.43,-4.35,;1.14,-.77,;-.19,-1.54,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C(C)C)c2=O)c1C |r,wU:6.9,wD:3.2,(-2.86,1.54,;-1.53,.77,;-.19,1.54,;-.19,3.08,;1.14,3.85,;1.14,5.39,;-.19,6.16,;-1.53,5.39,;-1.53,3.85,;-.19,7.7,;1.14,8.47,;-1.53,8.47,;1.14,.77,;2.47,1.54,;3.81,.77,;5.14,1.54,;3.81,-.77,;2.47,-1.54,;2.47,-3.08,;3.81,-3.85,;1.14,-3.85,;1.14,-5.39,;-.19,-6.16,;-.19,-7.7,;1.14,-8.47,;-1.66,-8.18,;-2.56,-6.93,;-4.05,-6.53,;-4.45,-5.04,;-5.14,-7.62,;-1.66,-5.68,;-2.43,-4.35,;1.14,-.77,;-.19,-1.54,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(CC)[nH]n(C)c2=O)c1C |r,wU:6.9,wD:3.2,(-3.41,1.7,;-2.07,.93,;-.74,1.7,;-.74,3.24,;.59,4.01,;.59,5.55,;-.74,6.32,;-2.07,5.55,;-2.07,4.01,;-.74,7.86,;.59,8.63,;-2.07,8.63,;.59,.93,;1.93,1.7,;3.26,.93,;4.6,1.7,;3.26,-.61,;1.93,-1.38,;1.93,-2.92,;3.26,-3.69,;.59,-3.69,;.59,-5.23,;-.74,-6,;-.74,-7.54,;.35,-8.63,;1.84,-8.23,;-2.2,-8.02,;-3.11,-6.77,;-4.6,-6.37,;-2.2,-5.52,;-2.97,-4.19,;.59,-.61,;-.74,-1.38,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c([nH]n(C)c2=O)C(C)C)c1C |r,wU:6.9,wD:3.2,(-3.41,2.44,;-2.07,1.67,;-.74,2.44,;-.74,3.98,;.59,4.75,;.59,6.29,;-.74,7.06,;-2.07,6.29,;-2.07,4.75,;-.74,8.6,;.59,9.37,;-2.07,9.37,;.59,1.67,;1.93,2.44,;3.26,1.67,;4.6,2.44,;3.26,.13,;1.93,-.64,;1.93,-2.18,;3.26,-2.95,;.59,-2.95,;.59,-4.49,;-.74,-5.26,;-.74,-6.8,;-2.2,-7.27,;-3.11,-6.03,;-4.6,-5.63,;-2.2,-4.78,;-2.97,-3.45,;.35,-7.89,;1.84,-7.49,;-.05,-9.37,;.59,.13,;-.74,-.64,)|

CCCCc1[nH]n(C)c(=O)c1CNC(=O)c1cc(Cl)cc(N(CC)[C@H]2CC[C@@H](CC2)N(C)C)c1C |r,wU:27.31,wD:24.24,(4.41,-8.58,;2.93,-8.97,;1.84,-7.89,;.35,-8.28,;-.74,-7.2,;-2.2,-7.67,;-3.11,-6.43,;-4.6,-6.03,;-2.2,-5.18,;-2.97,-3.85,;-.74,-5.66,;.59,-4.89,;.59,-3.35,;1.93,-2.58,;3.26,-3.35,;1.93,-1.04,;3.26,-.27,;3.26,1.27,;4.6,2.04,;1.93,2.04,;.59,1.27,;-.74,2.04,;-2.07,1.27,;-3.41,2.04,;-.74,3.58,;.59,4.35,;.59,5.89,;-.74,6.66,;-2.07,5.89,;-2.07,4.35,;-.74,8.2,;.59,8.97,;-2.07,8.97,;.59,-.27,;-.74,-1.04,)|

CCN([C@@H]1COC[C@H]1O)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C |r|

CCN([C@@H]1COC[C@H]1OC)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C |r|

CCO[C@@H]1COC[C@H]1N(CC)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C |r|

CCN([C@@H]1COC[C@H]1OCCOC)c1cc(Cl)cc(C(=O)NCc2c(C)nn(C)c2OC)c1C |r|

CCN([C@@H]1COC[C@H]1OCCOC)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C)-c1ccc(nc1)N1CCNCC1

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn3c(C)cc(C)nc23)c1C |r,wU:6.9,wD:3.2,(-3.7,2.97,;-2.36,2.2,;-1.03,2.97,;-1.03,4.51,;.3,5.28,;.3,6.82,;-1.03,7.59,;-2.36,6.82,;-2.36,5.28,;-1.03,9.13,;.3,9.9,;-2.36,9.9,;.3,2.2,;1.64,2.97,;2.97,2.2,;4.3,2.97,;2.97,.66,;1.64,-.11,;1.64,-1.65,;2.97,-2.42,;.3,-2.42,;.3,-3.96,;-1.03,-4.73,;-2.5,-4.26,;-2.89,-2.77,;-1.81,-1.68,;-3.4,-5.5,;-2.5,-6.75,;-2.82,-8.25,;-4.3,-8.65,;-1.67,-9.28,;-.21,-8.81,;.88,-9.9,;.11,-7.3,;-1.03,-6.27,;.3,.66,;-1.03,-.11,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c3nc(C)cc(C)n3[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(-3.7,2.97,;-2.36,2.2,;-1.03,2.97,;-1.03,4.51,;.3,5.28,;.3,6.82,;-1.03,7.59,;-2.36,6.82,;-2.36,5.28,;-1.03,9.13,;.3,9.9,;-2.36,9.9,;.3,2.2,;1.64,2.97,;2.97,2.2,;4.3,2.97,;2.97,.66,;1.64,-.11,;1.64,-1.65,;2.97,-2.42,;.3,-2.42,;.3,-3.96,;-1.03,-4.73,;-1.03,-6.27,;.11,-7.3,;-.21,-8.81,;.88,-9.9,;-1.67,-9.28,;-2.82,-8.25,;-4.3,-8.65,;-2.5,-6.75,;-3.4,-5.5,;-2.5,-4.26,;-3.27,-2.92,;.3,.66,;-1.03,-.11,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn3cccnc23)c1C |r,wU:6.9,wD:3.2,(-4,2.66,;-2.67,1.89,;-1.33,2.66,;-1.33,4.2,;,4.97,;,6.51,;-1.33,7.28,;-2.67,6.51,;-2.67,4.97,;-1.33,8.82,;,9.59,;-2.67,9.59,;,1.89,;1.33,2.66,;2.67,1.89,;4,2.66,;2.67,.35,;1.33,-.42,;1.33,-1.96,;2.67,-2.73,;,-2.73,;,-4.27,;-1.33,-5.04,;-2.8,-4.56,;-3.2,-3.08,;-2.11,-1.99,;-3.7,-5.81,;-2.8,-7.05,;-3.12,-8.56,;-1.97,-9.59,;-.51,-9.12,;-.19,-7.61,;-1.33,-6.58,;,.35,;-1.33,-.42,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c3ncccn3[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(-4,2.66,;-2.67,1.89,;-1.33,2.66,;-1.33,4.2,;,4.97,;,6.51,;-1.33,7.28,;-2.67,6.51,;-2.67,4.97,;-1.33,8.82,;,9.59,;-2.67,9.59,;,1.89,;1.33,2.66,;2.67,1.89,;4,2.66,;2.67,.35,;1.33,-.42,;1.33,-1.96,;2.67,-2.73,;,-2.73,;,-4.27,;-1.33,-5.04,;-1.33,-6.58,;-.19,-7.61,;-.51,-9.12,;-1.97,-9.59,;-3.12,-8.56,;-2.8,-7.05,;-3.7,-5.81,;-2.8,-4.56,;-3.57,-3.23,;,.35,;-1.33,-.42,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(-4,2.66,;-2.67,1.89,;-1.33,2.66,;-1.33,4.2,;,4.97,;,6.51,;-1.33,7.28,;-2.67,6.51,;-2.67,4.97,;-1.33,8.82,;,9.59,;-2.67,9.59,;,1.89,;1.33,2.66,;2.67,1.89,;4,2.66,;2.67,.35,;1.33,-.42,;1.33,-1.96,;2.67,-2.73,;,-2.73,;,-4.27,;-1.33,-5.04,;-1.33,-6.58,;,-7.35,;-2.8,-7.05,;-3.12,-8.56,;-1.97,-9.59,;-3.7,-5.81,;-2.8,-4.56,;-3.57,-3.23,;,.35,;-1.33,-.42,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(OC)nn(C)c2C)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:6.9,wD:3.2,(-7.66,2.06,;-6.33,1.29,;-4.99,2.06,;-4.99,3.6,;-3.66,4.37,;-3.66,5.91,;-4.99,6.68,;-6.33,5.91,;-6.33,4.37,;-4.99,8.22,;-3.66,8.99,;-6.33,8.99,;-3.66,1.29,;-2.33,2.06,;-.99,1.29,;-.99,-.25,;-2.33,-1.02,;-2.33,-2.56,;-.99,-3.33,;-3.66,-3.33,;-3.66,-4.87,;-4.99,-5.64,;-6.46,-5.16,;-6.86,-3.68,;-8.34,-3.28,;-7.36,-6.41,;-6.46,-7.66,;-7.23,-8.99,;-4.99,-7.18,;-3.75,-8.09,;-3.66,-.25,;-4.99,-1.02,;.34,2.06,;1.68,1.29,;3.01,2.06,;3.01,3.6,;4.34,4.37,;5.68,3.6,;5.68,2.06,;7.01,1.29,;8.34,2.06,;8.34,3.6,;7.01,4.37,;1.68,4.37,;.34,3.6,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:6.9,wD:3.2,(-8,2.06,;-6.67,1.29,;-5.33,2.06,;-5.33,3.6,;-4,4.37,;-4,5.91,;-5.33,6.68,;-6.67,5.91,;-6.67,4.37,;-5.33,8.22,;-4,8.99,;-6.67,8.99,;-4,1.29,;-2.67,2.06,;-1.33,1.29,;-1.33,-.25,;-2.67,-1.02,;-2.67,-2.56,;-1.33,-3.33,;-4,-3.33,;-4,-4.87,;-5.33,-5.64,;-5.33,-7.18,;-4,-7.95,;-6.8,-7.66,;-7.57,-8.99,;-7.7,-6.41,;-6.8,-5.16,;-7.57,-3.83,;-4,-.25,;-5.33,-1.02,;,2.06,;1.33,1.29,;2.67,2.06,;2.67,3.6,;4,4.37,;5.33,3.6,;5.33,2.06,;6.67,1.29,;8,2.06,;8,3.6,;6.67,4.37,;1.33,4.37,;,3.6,)|

CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(-2.67,2.06,;-1.33,1.29,;,2.06,;,3.6,;1.33,4.37,;1.33,5.91,;,6.68,;-1.33,5.91,;-1.33,4.37,;,8.22,;1.33,8.99,;-1.33,8.99,;-2.67,8.22,;-4,8.99,;-5.33,8.22,;1.33,1.29,;2.67,2.06,;4,1.29,;5.33,2.06,;4,-.25,;2.67,-1.02,;2.67,-2.56,;4,-3.33,;1.33,-3.33,;1.33,-4.87,;,-5.64,;,-7.18,;1.33,-7.95,;-1.46,-7.66,;-2.23,-8.99,;-2.37,-6.41,;-1.46,-5.16,;-2.23,-3.83,;1.33,-.25,;,-1.02,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1ccc(OC)cc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(,-.25,;,1.29,;1.33,2.06,;1.33,3.6,;2.67,4.37,;2.67,5.91,;1.33,6.68,;,5.91,;,4.37,;1.33,8.22,;2.67,8.99,;,8.99,;-1.33,8.22,;-1.33,6.68,;-2.67,5.91,;-4,6.68,;-5.33,5.91,;-6.67,6.68,;-4,8.22,;-2.67,8.99,;2.67,1.29,;4,2.06,;5.33,1.29,;6.67,2.06,;5.33,-.25,;4,-1.02,;4,-2.56,;5.33,-3.33,;2.67,-3.33,;2.67,-4.87,;1.33,-5.64,;1.33,-7.18,;2.67,-7.95,;-.13,-7.66,;-.9,-8.99,;-1.04,-6.41,;-.13,-5.16,;-.9,-3.83,;2.67,-.25,;1.33,-1.02,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(,-.25,;,1.29,;1.33,2.06,;1.33,3.6,;2.67,4.37,;2.67,5.91,;1.33,6.68,;,5.91,;,4.37,;1.33,8.22,;2.67,8.99,;,8.99,;-1.33,8.22,;-1.33,6.68,;-2.67,5.91,;-4,6.68,;-4,8.22,;-5.33,8.99,;-6.67,8.22,;-2.67,8.99,;2.67,1.29,;4,2.06,;5.33,1.29,;6.67,2.06,;5.33,-.25,;4,-1.02,;4,-2.56,;5.33,-3.33,;2.67,-3.33,;2.67,-4.87,;1.33,-5.64,;1.33,-7.18,;2.67,-7.95,;-.13,-7.66,;-.9,-8.99,;-1.04,-6.41,;-.13,-5.16,;-.9,-3.83,;2.67,-.25,;1.33,-1.02,)|

CCCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(OCCOC)cc1 |r,wU:7.10,wD:4.3,(-9.34,1.29,;-8,2.06,;-6.67,1.29,;-5.33,2.06,;-5.33,3.6,;-4,4.37,;-4,5.91,;-5.33,6.68,;-6.67,5.91,;-6.67,4.37,;-5.33,8.22,;-4,8.99,;-6.67,8.99,;-4,1.29,;-2.67,2.06,;-1.33,1.29,;-1.33,-.25,;-2.67,-1.02,;-2.67,-2.56,;-1.33,-3.33,;-4,-3.33,;-4,-4.87,;-5.33,-5.64,;-5.33,-7.18,;-4,-7.95,;-6.8,-7.66,;-7.57,-8.99,;-7.7,-6.41,;-6.8,-5.16,;-7.57,-3.83,;-4,-.25,;-5.33,-1.02,;,2.06,;1.33,1.29,;2.67,2.06,;2.67,3.6,;4,4.37,;5.33,3.6,;6.67,4.37,;8,3.6,;9.34,4.37,;1.33,4.37,;,3.6,)|

CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(OCCOC)cc1 |r,wU:3.2,wD:6.9,(-6.1,1.01,;-4.61,1.41,;-3.52,.32,;-3.92,-1.17,;-2.83,-2.26,;-3.23,-3.75,;-4.72,-4.14,;-5.8,-3.06,;-5.41,-1.57,;-5.11,-5.63,;-6.6,-6.03,;-4.02,-6.72,;-2.54,-6.32,;-1.45,-7.41,;-1.85,-8.9,;-2.03,.72,;-1.63,2.2,;-.15,2.6,;.94,1.51,;.54,.03,;1.63,-1.06,;3.12,-.66,;1.23,-2.55,;2.32,-3.64,;1.93,-5.13,;2.83,-6.37,;4.37,-6.37,;1.93,-7.62,;2.7,-8.95,;.46,-7.14,;.46,-5.6,;-.87,-4.83,;-.94,-.37,;-1.34,-1.86,;.25,4.09,;1.74,4.49,;2.14,5.98,;1.05,7.07,;1.45,8.55,;2.94,8.95,;4.02,7.86,;5.51,8.26,;6.6,7.17,;-.44,6.67,;-.84,5.18,)|

CCCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:4.3,wD:7.10,(-6.15,-1.42,;-5.75,.07,;-4.26,.46,;-3.17,-.62,;-3.57,-2.11,;-2.48,-3.2,;-2.88,-4.69,;-4.37,-5.09,;-5.46,-4,;-5.06,-2.51,;-4.77,-6.57,;-6.26,-6.97,;-3.68,-7.66,;-1.69,-.23,;-1.29,1.26,;.2,1.66,;1.29,.57,;.89,-.92,;1.98,-2.01,;3.47,-1.61,;1.58,-3.49,;2.67,-4.58,;2.27,-6.07,;3.18,-7.32,;4.72,-7.32,;2.27,-8.56,;3.04,-9.89,;.81,-8.09,;.81,-6.55,;-.53,-5.78,;-.6,-1.32,;-1,-2.8,;.6,3.15,;2.09,3.55,;2.48,5.03,;1.39,6.12,;1.79,7.61,;3.28,8.01,;4.37,6.92,;5.86,7.32,;6.26,8.81,;5.17,9.89,;3.68,9.5,;-.09,5.72,;-.49,4.24,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C |r,wU:6.9,wD:3.2,(,.37,;,1.91,;1.33,2.68,;1.33,4.22,;2.67,4.99,;2.67,6.53,;1.33,7.3,;,6.53,;,4.99,;1.33,8.84,;2.67,9.61,;,9.61,;-1.33,8.84,;-1.33,7.3,;-2.67,6.53,;-4,7.3,;-4,8.84,;-5.33,9.61,;-6.67,8.84,;-2.67,9.61,;2.67,1.91,;4,2.68,;5.33,1.91,;6.67,2.68,;5.33,.37,;4,-.4,;4,-1.94,;5.33,-2.71,;2.67,-2.71,;2.67,-4.25,;1.33,-5.02,;1.33,-6.56,;2.67,-7.33,;-.13,-7.03,;-.53,-8.52,;.56,-9.61,;-1.04,-5.79,;-.13,-4.54,;-.53,-3.06,;-2.02,-2.66,;2.67,.37,;1.33,-.4,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(,.37,;,1.91,;1.33,2.68,;1.33,4.22,;2.67,4.99,;2.67,6.53,;1.33,7.3,;,6.53,;,4.99,;1.33,8.84,;2.67,9.61,;,9.61,;-1.33,8.84,;-1.33,7.3,;-2.67,6.53,;-4,7.3,;-4,8.84,;-5.33,9.61,;-6.67,8.84,;-2.67,9.61,;2.67,1.91,;4,2.68,;5.33,1.91,;6.67,2.68,;5.33,.37,;4,-.4,;4,-1.94,;5.33,-2.71,;2.67,-2.71,;2.67,-4.25,;1.33,-5.02,;1.33,-6.56,;2.67,-7.33,;-.13,-7.03,;-.53,-8.52,;.56,-9.61,;-1.04,-5.79,;-.13,-4.54,;-.9,-3.21,;2.67,.37,;1.33,-.4,)|

CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C |r,wU:6.9,wD:3.2,(-1.33,.37,;-1.33,1.91,;,2.68,;,4.22,;1.33,4.99,;1.33,6.53,;,7.3,;-1.33,6.53,;-1.33,4.99,;,8.84,;1.33,9.61,;-1.33,9.61,;-2.67,8.84,;-4,9.61,;-5.33,8.84,;1.33,1.91,;2.67,2.68,;4,1.91,;5.33,2.68,;4,.37,;2.67,-.4,;2.67,-1.94,;4,-2.71,;1.33,-2.71,;1.33,-4.25,;,-5.02,;,-6.56,;1.33,-7.33,;-1.46,-7.03,;-1.86,-8.52,;-.77,-9.61,;-2.37,-5.79,;-1.46,-4.54,;-1.86,-3.06,;-.77,-1.97,;1.33,.37,;,-.4,)|

CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(-1.33,.37,;-1.33,1.91,;,2.68,;,4.22,;1.33,4.99,;1.33,6.53,;,7.3,;-1.33,6.53,;-1.33,4.99,;,8.84,;1.33,9.61,;-1.33,9.61,;-2.67,8.84,;-4,9.61,;-5.33,8.84,;1.33,1.91,;2.67,2.68,;4,1.91,;5.33,2.68,;4,.37,;2.67,-.4,;2.67,-1.94,;4,-2.71,;1.33,-2.71,;1.33,-4.25,;,-5.02,;,-6.56,;1.33,-7.33,;-1.46,-7.03,;-1.86,-8.52,;-.77,-9.61,;-2.37,-5.79,;-1.46,-4.54,;-2.23,-3.21,;1.33,.37,;,-.4,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C |r,wU:6.9,wD:3.2,(-3.66,-.25,;-2.33,-1.02,;-.99,-.25,;-.99,1.29,;.34,2.06,;.34,3.6,;-.99,4.37,;-2.33,3.6,;-2.33,2.06,;-.99,5.91,;-2.33,6.68,;.34,6.68,;.34,8.22,;-.99,8.99,;-.99,10.53,;.34,11.3,;1.68,10.53,;1.68,8.99,;.34,-1.02,;1.68,-.25,;3.01,-1.02,;4.34,-.25,;3.01,-2.56,;1.68,-3.33,;1.68,-4.87,;3.01,-5.64,;.34,-5.64,;.34,-7.18,;-.99,-7.95,;-.99,-9.49,;.34,-10.26,;-2.46,-9.97,;-3.23,-11.3,;-3.36,-8.72,;-2.46,-7.47,;-2.86,-5.99,;-4.34,-5.59,;.34,-2.56,;-.99,-3.33,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(-4,-.25,;-2.67,-1.02,;-1.33,-.25,;-1.33,1.29,;,2.06,;,3.6,;-1.33,4.37,;-2.67,3.6,;-2.67,2.06,;-1.33,5.91,;-2.67,6.68,;,6.68,;,8.22,;-1.33,8.99,;-1.33,10.53,;,11.3,;1.33,10.53,;1.33,8.99,;,-1.02,;1.33,-.25,;2.67,-1.02,;4,-.25,;2.67,-2.56,;1.33,-3.33,;1.33,-4.87,;2.67,-5.64,;,-5.64,;,-7.18,;-1.33,-7.95,;-1.33,-9.49,;,-10.26,;-2.8,-9.97,;-3.57,-11.3,;-3.7,-8.72,;-2.8,-7.47,;-3.57,-6.14,;,-2.56,;-1.33,-3.33,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OCCOC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C |r,wU:6.9,wD:3.2,(-6,-.25,;-4.67,-1.02,;-3.33,-.25,;-3.33,1.29,;-2,2.06,;-2,3.6,;-3.33,4.37,;-4.67,3.6,;-4.67,2.06,;-3.33,5.91,;-4.67,6.68,;-2,6.68,;-2,8.22,;-3.33,8.99,;-3.33,10.53,;-2,11.3,;-.67,10.53,;.67,11.3,;2,10.53,;3.33,11.3,;4.67,10.53,;6,11.3,;-.67,8.99,;-2,-1.02,;-.67,-.25,;.67,-1.02,;2,-.25,;.67,-2.56,;-.67,-3.33,;-.67,-4.87,;.67,-5.64,;-2,-5.64,;-2,-7.18,;-3.33,-7.95,;-3.33,-9.49,;-2,-10.26,;-4.8,-9.97,;-5.57,-11.3,;-5.7,-8.72,;-4.8,-7.47,;-5.2,-5.99,;-4.11,-4.9,;-2,-2.56,;-3.33,-3.33,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OCCOC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(-6,-.25,;-4.67,-1.02,;-3.33,-.25,;-3.33,1.29,;-2,2.06,;-2,3.6,;-3.33,4.37,;-4.67,3.6,;-4.67,2.06,;-3.33,5.91,;-4.67,6.68,;-2,6.68,;-2,8.22,;-3.33,8.99,;-3.33,10.53,;-2,11.3,;-.67,10.53,;.67,11.3,;2,10.53,;3.33,11.3,;4.67,10.53,;6,11.3,;-.67,8.99,;-2,-1.02,;-.67,-.25,;.67,-1.02,;2,-.25,;.67,-2.56,;-.67,-3.33,;-.67,-4.87,;.67,-5.64,;-2,-5.64,;-2,-7.18,;-3.33,-7.95,;-3.33,-9.49,;-2,-10.26,;-4.8,-9.97,;-5.57,-11.3,;-5.7,-8.72,;-4.8,-7.47,;-5.57,-6.14,;-2,-2.56,;-3.33,-3.33,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1ccc(OC)cc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C |r,wU:6.9,wD:3.2,(-.67,.37,;-.67,1.91,;.67,2.68,;.67,4.22,;2,4.99,;2,6.53,;.67,7.3,;-.67,6.53,;-.67,4.99,;.67,8.84,;2,9.61,;-.67,9.61,;-2,8.84,;-2,7.3,;-3.33,6.53,;-4.67,7.3,;-6,6.53,;-6,4.99,;-4.67,8.84,;-3.33,9.61,;2,1.91,;3.33,2.68,;4.67,1.91,;6,2.68,;4.67,.37,;3.33,-.4,;3.33,-1.94,;4.67,-2.71,;2,-2.71,;2,-4.25,;.67,-5.02,;.67,-6.56,;2,-7.33,;-.8,-7.03,;-1.2,-8.52,;-.11,-9.61,;-1.7,-5.79,;-.8,-4.54,;-1.2,-3.06,;-.11,-1.97,;2,.37,;.67,-.4,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1ccc(OC)cc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(-.67,.37,;-.67,1.91,;.67,2.68,;.67,4.22,;2,4.99,;2,6.53,;.67,7.3,;-.67,6.53,;-.67,4.99,;.67,8.84,;2,9.61,;-.67,9.61,;-2,8.84,;-2,7.3,;-3.33,6.53,;-4.67,7.3,;-6,6.53,;-6,4.99,;-4.67,8.84,;-3.33,9.61,;2,1.91,;3.33,2.68,;4.67,1.91,;6,2.68,;4.67,.37,;3.33,-.4,;3.33,-1.94,;4.67,-2.71,;2,-2.71,;2,-4.25,;.67,-5.02,;.67,-6.56,;2,-7.33,;-.8,-7.03,;-1.2,-8.52,;-.11,-9.61,;-1.7,-5.79,;-.8,-4.54,;-1.57,-3.21,;2,.37,;.67,-.4,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C(C)c1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C |r,wU:6.9,wD:3.2,(-4,-.25,;-2.67,-1.02,;-1.33,-.25,;-1.33,1.29,;,2.06,;,3.6,;-1.33,4.37,;-2.67,3.6,;-2.67,2.06,;-1.33,5.91,;-2.67,6.68,;,6.68,;1.33,5.91,;,8.22,;-1.33,8.99,;-1.33,10.53,;,11.3,;1.33,10.53,;1.33,8.99,;,-1.02,;1.33,-.25,;2.67,-1.02,;4,-.25,;2.67,-2.56,;1.33,-3.33,;1.33,-4.87,;2.67,-5.64,;,-5.64,;,-7.18,;-1.33,-7.95,;-1.33,-9.49,;,-10.26,;-2.8,-9.97,;-3.57,-11.3,;-3.7,-8.72,;-2.8,-7.47,;-3.2,-5.99,;-2.11,-4.9,;,-2.56,;-1.33,-3.33,)|

CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C

CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C

CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C

CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C

CCN(C1CCN(CCc2cccc(OC)c2)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C

CCN(C1CCN(CCc2cccc(OC)c2)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCCC2)c1C |r,wU:3.2,wD:6.9,(-.67,7.17,;.67,6.4,;.67,4.86,;-.67,4.09,;-.67,2.55,;-2,1.78,;-3.33,2.55,;-3.33,4.09,;-2,4.86,;-4.67,1.78,;-4.67,.24,;-6,2.55,;2,4.09,;3.33,4.86,;4.67,4.09,;6,4.86,;4.67,2.55,;3.33,1.78,;3.33,.24,;4.67,-.53,;2,-.53,;2,-2.07,;.67,-2.84,;-.8,-2.37,;-1.2,-.88,;-.11,.21,;-1.7,-3.61,;-.8,-4.86,;-1.57,-6.19,;.67,-4.38,;2,-5.15,;2,-6.69,;3.47,-7.17,;4.37,-5.92,;3.47,-4.68,;2,2.55,;.67,1.78,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(N3CCCC3)n(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-.67,7.17,;.67,6.4,;.67,4.86,;-.67,4.09,;-.67,2.55,;-2,1.78,;-3.33,2.55,;-3.33,4.09,;-2,4.86,;-4.67,1.78,;-4.67,.24,;-6,2.55,;2,4.09,;3.33,4.86,;4.67,4.09,;6,4.86,;4.67,2.55,;3.33,1.78,;3.33,.24,;4.67,-.53,;2,-.53,;2,-2.07,;.67,-2.84,;.67,-4.38,;2,-5.15,;2,-6.69,;3.47,-7.17,;4.37,-5.92,;3.47,-4.68,;-.8,-4.86,;-1.57,-6.19,;-1.7,-3.61,;-.8,-2.37,;-1.57,-1.03,;2,2.55,;.67,1.78,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCOCC2)c1C |r,wU:3.2,wD:6.9,(-.67,7.61,;.67,6.84,;.67,5.3,;-.67,4.53,;-.67,2.99,;-2,2.22,;-3.33,2.99,;-3.33,4.53,;-2,5.3,;-4.67,2.22,;-4.67,.68,;-6,2.99,;2,4.53,;3.33,5.3,;4.67,4.53,;6,5.3,;4.67,2.99,;3.33,2.22,;3.33,.68,;4.67,-.09,;2,-.09,;2,-1.63,;.67,-2.4,;-.8,-1.93,;-1.2,-.44,;-2.68,-.04,;-1.7,-3.17,;-.8,-4.42,;-1.57,-5.75,;.67,-3.94,;1.76,-5.03,;1.36,-6.52,;2.45,-7.61,;3.93,-7.21,;4.33,-5.72,;3.24,-4.63,;2,2.99,;.67,2.22,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCCCC2)c1C |r,wU:3.2,wD:6.9,(-1.33,2.99,;,2.22,;1.33,2.99,;1.33,4.53,;,5.3,;,6.84,;1.33,7.61,;2.67,6.84,;2.67,5.3,;1.33,9.15,;2.67,9.92,;,9.92,;-1.33,9.15,;-1.33,7.61,;-2.67,6.84,;-4,7.61,;-4,9.15,;-5.33,9.92,;-6.67,9.15,;-2.67,9.92,;2.67,2.22,;4,2.99,;5.33,2.22,;6.67,2.99,;5.33,.68,;4,-.09,;4,-1.63,;5.33,-2.4,;2.67,-2.4,;2.67,-3.94,;1.33,-4.71,;-.13,-4.24,;-.53,-2.75,;-2.02,-2.35,;-1.04,-5.48,;-.13,-6.73,;-.9,-8.06,;1.33,-6.25,;2.42,-7.34,;2.02,-8.83,;3.11,-9.92,;4.6,-9.52,;5,-8.03,;3.91,-6.94,;2.67,.68,;1.33,-.09,)|

CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(N3CCCCC3)n(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-1.33,2.99,;,2.22,;1.33,2.99,;1.33,4.53,;,5.3,;,6.84,;1.33,7.61,;2.67,6.84,;2.67,5.3,;1.33,9.15,;2.67,9.92,;,9.92,;-1.33,9.15,;-1.33,7.61,;-2.67,6.84,;-4,7.61,;-4,9.15,;-5.33,9.92,;-6.67,9.15,;-2.67,9.92,;2.67,2.22,;4,2.99,;5.33,2.22,;6.67,2.99,;5.33,.68,;4,-.09,;4,-1.63,;5.33,-2.4,;2.67,-2.4,;2.67,-3.94,;1.33,-4.71,;1.33,-6.25,;2.42,-7.34,;2.02,-8.83,;3.11,-9.92,;4.6,-9.52,;5,-8.03,;3.91,-6.94,;-.13,-6.73,;-.9,-8.06,;-1.04,-5.48,;-.13,-4.24,;-.9,-2.9,;2.67,.68,;1.33,-.09,)|

CCOc1n[nH]c(C)c1CNC(=O)c1cc(Cl)cc(N(CC)[C@H]2CC[C@@H](CC2)N(C)C)c1C |r,wU:25.29,wD:22.22,(-4.54,-2.31,;-4.14,-3.8,;-2.66,-4.2,;-2.26,-5.68,;-3.16,-6.93,;-2.26,-8.18,;-.79,-7.7,;.54,-8.47,;-.79,-6.16,;.54,-5.39,;.54,-3.85,;1.87,-3.08,;3.21,-3.85,;1.87,-1.54,;3.21,-.77,;3.21,.77,;4.54,1.54,;1.87,1.54,;.54,.77,;-.79,1.54,;-2.13,.77,;-2.13,-.77,;-.79,3.08,;.54,3.85,;.54,5.39,;-.79,6.16,;-2.13,5.39,;-2.13,3.85,;-.79,7.7,;.54,8.47,;-2.13,8.47,;.54,-.77,;-.79,-1.54,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)n(C)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(-2.82,.13,;-2.82,1.67,;-1.48,2.44,;-1.48,3.98,;-.15,4.75,;-.15,6.29,;-1.48,7.06,;-2.82,6.29,;-2.82,4.75,;-1.48,8.6,;-.15,9.37,;-2.82,9.37,;-.15,1.67,;1.18,2.44,;2.52,1.67,;3.85,2.44,;2.52,.13,;1.18,-.64,;1.18,-2.18,;2.52,-2.95,;-.15,-2.95,;-.15,-4.49,;-1.48,-5.26,;-1.48,-6.8,;-.39,-7.89,;-.79,-9.37,;-2.95,-7.27,;-3.72,-8.61,;-3.85,-6.03,;-2.95,-4.78,;-3.72,-3.45,;-.15,.13,;-1.48,-.64,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)n(C)c2=O)c1C |r,wU:6.9,wD:3.2,(-2.07,-.25,;-2.07,1.29,;-.74,2.06,;-.74,3.6,;.59,4.37,;.59,5.91,;-.74,6.68,;-2.07,5.91,;-2.07,4.37,;-.74,8.22,;.59,8.99,;-2.07,8.99,;.59,1.29,;1.93,2.06,;3.26,1.29,;4.6,2.06,;3.26,-.25,;1.93,-1.02,;1.93,-2.56,;3.26,-3.33,;.59,-3.33,;.59,-4.87,;-.74,-5.64,;-.74,-7.18,;.75,-7.58,;-2.2,-7.66,;-2.97,-8.99,;-3.11,-6.41,;-4.6,-6.01,;-2.2,-5.16,;-2.97,-3.83,;.59,-.25,;-.74,-1.02,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)n(C)nc2C(F)(F)F)c1C |r,wU:6.9,wD:3.2,(-2.07,.13,;-2.07,1.67,;-.74,2.44,;-.74,3.98,;.59,4.75,;.59,6.29,;-.74,7.06,;-2.07,6.29,;-2.07,4.75,;-.74,8.6,;.59,9.37,;-2.07,9.37,;.59,1.67,;1.93,2.44,;3.26,1.67,;4.6,2.44,;3.26,.13,;1.93,-.64,;1.93,-2.18,;3.26,-2.95,;.59,-2.95,;.59,-4.49,;-.74,-5.26,;-2.2,-4.78,;-2.6,-3.29,;-4.09,-2.89,;-3.11,-6.03,;-4.6,-5.63,;-2.2,-7.27,;-.74,-6.8,;.35,-7.89,;-.05,-9.37,;1.84,-7.49,;1.44,-8.97,;.59,.13,;-.74,-.64,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c([nH]n(C)c2=O)C(F)(F)F)c1C |r,wU:6.9,wD:3.2,(-2.07,.13,;-2.07,1.67,;-.74,2.44,;-.74,3.98,;.59,4.75,;.59,6.29,;-.74,7.06,;-2.07,6.29,;-2.07,4.75,;-.74,8.6,;.59,9.37,;-2.07,9.37,;.59,1.67,;1.93,2.44,;3.26,1.67,;4.6,2.44,;3.26,.13,;1.93,-.64,;1.93,-2.18,;3.26,-2.95,;.59,-2.95,;.59,-4.49,;-.74,-5.26,;-.74,-6.8,;-2.2,-7.27,;-3.11,-6.03,;-4.6,-5.63,;-2.2,-4.78,;-2.97,-3.45,;.35,-7.89,;-.05,-9.37,;1.84,-7.49,;1.44,-8.97,;.59,.13,;-.74,-.64,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(n(C)n(C)c2=O)C(F)(F)F)c1C |r,wU:6.9,wD:3.2,(-2.07,.13,;-2.07,1.67,;-.74,2.44,;-.74,3.98,;.59,4.75,;.59,6.29,;-.74,7.06,;-2.07,6.29,;-2.07,4.75,;-.74,8.6,;.59,9.37,;-2.07,9.37,;.59,1.67,;1.93,2.44,;3.26,1.67,;4.6,2.44,;3.26,.13,;1.93,-.64,;1.93,-2.18,;3.26,-2.95,;.59,-2.95,;.59,-4.49,;-.74,-5.26,;-.74,-6.8,;-2.2,-7.27,;-2.97,-8.61,;-3.11,-6.03,;-4.6,-5.63,;-2.2,-4.78,;-2.97,-3.45,;.35,-7.89,;-.05,-9.37,;1.84,-7.49,;1.44,-8.97,;.59,.13,;-.74,-.64,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)nn(C)c2OC)c1C |r,wU:3.2,wD:6.9,(1.15,7.91,;1.93,6.58,;1.15,5.25,;-.38,5.25,;-1.15,3.91,;-2.69,3.91,;-3.47,5.25,;-2.69,6.58,;-1.15,6.58,;-5,5.25,;-5.78,6.58,;-5.78,3.91,;1.93,3.91,;3.47,3.91,;4.23,2.58,;5.78,2.58,;3.47,1.25,;1.93,1.25,;1.15,-.09,;-.38,-.09,;1.93,-1.42,;1.15,-2.76,;1.93,-4.09,;3.39,-4.56,;4.72,-3.79,;3.39,-6.1,;1.93,-6.58,;1.15,-7.91,;1.02,-5.33,;-.47,-5.73,;-1.56,-4.64,;1.15,2.58,;-.38,2.58,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCCCC2)c1C |r,wU:3.2,wD:6.9,(.52,7.39,;1.29,6.06,;.52,4.73,;-1.02,4.73,;-1.79,3.39,;-3.33,3.39,;-4.1,4.73,;-3.33,6.06,;-1.79,6.06,;-5.64,4.73,;-6.41,6.06,;-6.41,3.39,;1.29,3.39,;2.83,3.39,;3.6,2.06,;5.14,2.06,;2.83,.73,;1.29,.73,;.52,-.61,;-1.02,-.61,;1.29,-1.94,;.52,-3.27,;1.29,-4.61,;.38,-5.85,;-1.11,-6.25,;-2.2,-5.16,;1.29,-7.1,;2.75,-6.62,;4.08,-7.39,;2.75,-5.08,;3.84,-4,;5.33,-4.39,;6.41,-3.31,;6.02,-1.82,;4.53,-1.42,;3.44,-2.51,;.52,2.06,;-1.02,2.06,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(N3CCCCC3)n(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(.52,7.39,;1.29,6.06,;.52,4.73,;-1.02,4.73,;-1.79,3.39,;-3.33,3.39,;-4.1,4.73,;-3.33,6.06,;-1.79,6.06,;-5.64,4.73,;-6.41,6.06,;-6.41,3.39,;1.29,3.39,;2.83,3.39,;3.6,2.06,;5.14,2.06,;2.83,.73,;1.29,.73,;.52,-.61,;-1.02,-.61,;1.29,-1.94,;.52,-3.27,;1.29,-4.61,;2.75,-5.08,;3.84,-4,;5.33,-4.39,;6.41,-3.31,;6.02,-1.82,;4.53,-1.42,;3.44,-2.51,;2.75,-6.62,;4.08,-7.39,;1.29,-7.1,;.38,-5.85,;-1.11,-6.25,;.52,2.06,;-1.02,2.06,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(nn(C)c2OC)N2CCCCC2)c1C |r,wU:3.2,wD:6.9,(.52,7.91,;1.29,6.58,;.52,5.25,;-1.02,5.25,;-1.79,3.91,;-3.33,3.91,;-4.1,5.25,;-3.33,6.58,;-1.79,6.58,;-5.64,5.25,;-6.41,6.58,;-6.41,3.91,;1.29,3.91,;2.83,3.91,;3.6,2.58,;5.14,2.58,;2.83,1.25,;1.29,1.25,;.52,-.09,;-1.02,-.09,;1.29,-1.42,;.52,-2.76,;1.29,-4.09,;2.75,-4.56,;2.75,-6.1,;1.29,-6.58,;.52,-7.91,;.38,-5.33,;-1.11,-5.73,;-1.51,-7.22,;3.84,-3.48,;5.33,-3.87,;6.41,-2.79,;6.02,-1.3,;4.53,-.9,;3.44,-1.99,;.52,2.58,;-1.02,2.58,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2OC)c1C |r,wU:3.2,wD:6.9,(1.06,8.02,;1.83,6.68,;1.06,5.35,;-.48,5.35,;-1.25,4.02,;-2.79,4.02,;-3.56,5.35,;-2.79,6.68,;-1.25,6.68,;-5.1,5.35,;-5.87,6.68,;-5.87,4.02,;1.83,4.02,;3.37,4.02,;4.14,2.68,;5.68,2.68,;3.37,1.35,;1.83,1.35,;1.06,.02,;-.48,.02,;1.83,-1.32,;1.06,-2.65,;1.83,-3.99,;3.29,-4.46,;4.38,-3.37,;5.87,-3.77,;3.29,-6,;1.83,-6.48,;1.83,-8.02,;.92,-5.23,;-.56,-5.63,;-1.65,-4.54,;1.06,2.68,;-.48,2.68,)|

CN(C1CCCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnn(CCN2CCOCC2)c1

COc1nn(C)c(C)c1CNC(=O)c1c(C)n(C(C)C2CCOCC2)c2ccccc12

CC(C1CCOCC1)n1c(C)c(C(=O)NCc2c(C)n(C)[nH]c2=O)c2ccccc12

CCC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)n(C)nc1OC

CCC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)n(C)[nH]c1=O

CCC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)n(CC)nc1OC

CCC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)n(CC)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2CCCC2)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN(C)C)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cnc(N)nc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cnn(CCN2CCOCC2)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(NC(C)=O)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CN2CCN(C)CC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(nc1)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)C(=O)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(c1)C(=O)NCCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CN)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CN(C)CCCN(C)C)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN(C)CCCN(C)C)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1nc(Br)c2c(cc(nc12)-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)C(=O)NCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CN(C)CCN(C)C)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(c1)C(=O)NCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CN(C)CCN2CCCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CN(C)C)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)C(=O)NCCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(c1)C(=O)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CNC2CCCCC2N)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CNCCN)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccnc(c1)N1CCN(CC1)C(=O)OC(C)(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CNCCN(C)C)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc2OCCOc2c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccnc(c1)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)S(C)(=O)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CN(C)CCN)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN(C)CCN)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc2OCOc2c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)C(N)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccnc(c1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN(C)CCN(C)C)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CNCCN(C)C)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CNCCN(C)Cc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2c1

CC(C)n1ncc2c(cc(cc12)-c1cccc(CN(C)CCN2CCCC2)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(NC(C)=O)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(CN(C)C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(nc1)N1CCN(CC1)C(=O)OC(C)(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)C#N)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN2CCN(C)CC2)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)c(Cl)c(cc12)-c1ccc2OCCOc2c1

CC(C)n1ncc2c(cc(nc12)-c1cnn(C)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cn[nH]c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(N)nc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)N1CCN(CC1)C(=O)OC(C)(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cc1OC)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)C(O)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN2CCOCC2)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)N(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(F)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc4cccc(c3cc(C(=O)NCc1c(C)cc(C)[nH]c1=O)c2cnn(C(C)C)c2n3)c4

CNCCN(C)Cc1cccc(c1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2CNN(C(C)C)c2n1

CC(C)n1ncc2c(cc(nc12)-c1ccc(CO)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(nc1)N1CCN(C)CC1)C(=O)NCc1ccc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(Cl)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(C)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccnc1N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccccc1-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CN1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(-c3ccc(C)cc3)c2n1

CC(C)n1ncc2c(cc(nc12)-c1cccnc1N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(c1)C(O)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(nc1)-c1ccccc1CN)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)C(C)(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN(C)CCN(C)C)c1)C(=O)NCc1c(C)cc[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc2OCCOc2c1)C(=O)NCc1cc2CNCCc2[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN2CCN(C)CC2)c1)C(=O)NCc1c(C)cc[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN2CCN(C)CC2)c1)C(=O)N(C)Cc1c(C)cc(C)[nH]c1=O

CC(C)N1NCc2c1nc(cc2C(=O)NCc1c(C)cc(C)n(C)c1=O)-c1cccc(CN(C)CCN(C)C)c1

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C(C)(C)C)-c2ccc3OCCOc3c2)c(=O)[nH]1

CCOc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)n1ncc2c(cc(nc12)-c1ccc2OCCOc2c1)C(=O)NCc1c(C)cc[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc2OCCOc2c1)C(=O)NCc1ccc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CNC2CCCCC2N)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CNC(=O)OC(C)(C)C)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccccc1Cl)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1nc(C(C)=C)c2c(cc(nc12)-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccnc1N1CCN(CC1)C(=O)OC(C)(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(CO)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccccc1C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccccc1CNC(=O)OC(C)(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN(C)CCN(C)C)c1)C(=O)NCc1ccc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN2CCN(C)CC2)c1)C(=O)NCc1ccc(C)[nH]c1=O

COc1cccc(c1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)n1ncc2c(cc(nc12)-c1ccc(cc1)C(C)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)n1ncc2c(cc(nc12)-c1cccc(c1)C(C)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)Oc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)n1ncc2c(cc(nc12)-c1cccc(c1)N(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CO)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1ccc(F)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(-c3ccccc3)c2n1

CCc1ccc(CNC(=O)c2cc(nc3n(ncc23)C(C)C)-c2ccc3OCCOc3c2)c(=O)[nH]1

CC(C)n1ncc2c(cc(nc12)-c1cccc(CNCCCN(C)C)c1)C(=O)NCC1=C(C)C=C(C)NC1C |c:33,t:36|

CC(C)n1ncc2c(cc(nc12)-c1cccc(CNCCN2CCOCC2)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2CCN(Cc3ccccc3)CC2)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:36|

CC(=O)N1CCC(CC1)n1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:21|

CC(=C)Cn1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:15|

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2CCCC2)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:27|

CC(C)n1ncc2c(cc(OC3CCN(C)CC3)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)CCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)C1CN(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2CCOCC2)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:28|

CC(C)n1ncc2c(cc(nc12)N1CCC(O)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)c(Cl)c(nc12)C1=CC(C)(C)NC(C)(C)C1 |t:29|

CC(C)n1nc(C)c2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:15|

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2CCC2)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:26|

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2COC2)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:26|

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2CCCCC2)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:28|

CC(C)n1ncc2c(cc(nc12)C(C)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CNC(=O)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(c1ccccc1)n1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:20|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)C1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

COCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(nc2n(ncc12)C(C)C)C1=CC(C)(C)NC(C)(C)C1 |t:30|

CC(C)n1ncc2c(cc(C=O)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(nc2n(ncc12)C(C)C)C1=CC(C)(C)NC(C)(C)C1 |t:29|

CCc1nn(C(C)C)c2nc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)C1=CC(C)(C)NC(C)(C)C1 |t:30|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)S(C)(=O)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)C1CCCNC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)C1CNC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)C1CCN(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)C1CCCN(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C1CCN(CCS(C)(=O)=O)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)C1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C1CCN(CC1)S(C)(=O)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)CCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CNCC(=O)N1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1 |c:8|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C1CCN(CC1)S(C)(=O)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)N1CCN(CC1)C1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)C1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)C1CCN(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N1CCC(CC1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)CC(N)CO)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

C[C@H](N)C(=O)N1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1 |r,c:8|

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2COC2)C2CC(C)(C)NC(C)(C)C2)c(=O)[nH]1

CC(C)n1ncc2c(cc(nc12)N1CCC(CC1)C1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)CCN)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)C1CN(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)C1CCCNC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)CN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)C1CCNC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C1CCN(CCS(C)(=O)=O)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C1CCN(CC1)C(C)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)CN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)C1CCCN(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)C1CCNC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)CCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)CCN)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)CN)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(C)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C1CCN(CC1)C(C)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)[C@@H](N)CO)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,t:14|

CC(O)[C@H](N)C(=O)N1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1 |r,c:10|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)C1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)CCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)C(O)CN)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CCC(F)(F)F)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(O)[C@H](N)C(=O)N1CCC(CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1 |r|

CC(C)n1ncc2c(cc(nc12)C1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CNCC(=O)N1CCC(CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)C1CNC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(C)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)CN)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCOCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCCCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)C(=O)CO)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CCS(C)(=O)=O)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CCC(F)(F)F)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)CO)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N1CCC(CC1)N(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N1CCC(CC1)N1CCOCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(Br)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CCS(C)(=O)=O)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)N(C)CCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C(C)=C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N1CCC(CC1)C1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N1CCC(=O)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)C(O)CN)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(C=C)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N1CCOCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CCN(CC1)S(C)(=O)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C1CCN(CC1)C(=O)[C@@H](N)CO)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CC(C)n1ncc2c(cc(nc12)N1CCC(CC1)N1CCN(CC1)S(C)(=O)=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N1CCC(CC1)N1CCN(CCS(C)(=O)=O)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2CCCC=C2)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |c:25,t:28|

CC(C)Oc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

C[C@H](N)C(=O)N1CCC(CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1 |r|

CC(C)n1ncc2c(cc(nc12)N1CCC(CC1)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2CCNCC2)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:28|

CC(C)n1ncc2c(cc(nc12)N1CCC(CC1)N1CCN(CC1)C(=O)OC(C)(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)c1cc(C(=O)NCC2C(C)C=C(C)NC2=O)c2cnn(C(C)C)c2n1 |t:13|

CC(C)n1ncc2c(cc(nc12)N1CCC(N)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCOc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)n1ncc2c(cc(CO)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(NCCS(C)(=O)=O)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N1CCCCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN1CCC(CC1)n1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:19|

CCc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

COc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)n1ncc2c(cc(nc12)N1CCC(O)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COC(=O)C(=C)Cn1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:18|

CC(C)n1ncc2c(cc(NC(C)=O)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCc1c(C)[nH]c(=O)c(CNC(=O)c2cc(nc3n(ncc23)C(C)C)C2=CC(C)(C)NC(C)(C)C2)c1C |t:27|

CC(C)n1ncc2c(cc(nc12)N1CCCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COC(=O)\C=C\Cn1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:18|

CC(C)n1ncc2c(cc(N)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C(O)CO)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(ccnc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C(=O)N1CCC(CC1)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCOCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(nc3n(CC4CC4)ncc23)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:26|

CCn1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:13|

CC(C)n1ncc2c(cc(nc12)C(=O)N(C)CCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N(C)CC(O)CO)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N(C)CCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)N(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCc1c(C)[nH]c(=O)c(CNC(=O)c2cc(nc3n(ncc23)C(C)C)C2CC(C)(C)NC(C)(C)C2)c1C

CC(C)n1ncc2c(cc(nc12)C(=O)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)c(C)c(C)[nH]c1=O |t:14|

CC(C)n1ncc2c(cc(nc12)C(=O)NCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C(=O)N(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1CCCCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)c(Cc2ccccc2)c(C)[nH]c1=O |t:14|

Cc1cc(C)c(CNC(=O)c2cc(nc3n(CCC#N)ncc23)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:25|

CC(C)n1ncc2c(cc(nc12)C1CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)c(Cc2ccccc2)c(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(nc3n(CCO)ncc23)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:24|

CC(C)n1ncc2c(cc(O)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)c1cc(C)[nH]c(=O)c1CNC(=O)c1cc(nc2n(ncc12)C(C)C)C1CC(C)(C)NC(C)(C)C1

Cc1cc(C)c(CNC(=O)c2cc(nc3n(Cc4ccccc4)ncc23)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:29|

CN(C)CCn1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:16|

Cc1cc(C)c(CNC(=O)c2cc(nc3n(C)ncc23)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:22|

CC(=O)n1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:14|

Cc1cc(C)c(CNC(=O)c2cc(nc3n(CC=C)ncc23)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:24|

CCOC(=O)Cn1ncc2c(cc(nc12)C1=CC(C)(C)NC(C)(C)C1)C(=O)NCc1c(C)cc(C)[nH]c1=O |t:17|

Cc1cc(C)c(CNC(=O)c2cc(nc3n(CC(F)(F)F)ncc23)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:26|

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(CN3CCOCC3)nc2)c(=O)[nH]1

CN(C)Cc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

CN(C)CCCOCc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

CC(C)n1ncc2c(cc(cc12)-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(CN3CCOCC3)cc2C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(CNCCS(C)(=O)=O)o2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2cccc(CO)c2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2cccc(CNCCO)c2)c(=O)[nH]1

CNCCCOc1cccc(c1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

CN(C)CCCOc1cccc(c1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

CNCCCOc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(CC3CCC[C@@H]3C(N)=O)cc2)c(=O)[nH]1 |r|

CCOc1ccc(cc1-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1)S(=O)(=O)N1CCN(CC)CC1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(CN3CCOCC3)cn2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(C)c(c2)S(N)(=O)=O)c(=O)[nH]1

CN(C)CCCN(C)Cc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(COCCCN3CCOCC3)cc2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2cccc(C[N+](C)(C)CCO)c2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(COCCN3CCOCC3)cc2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2cccnc2)c(=O)[nH]1

CN(C)CCOCc1cccc(c1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2cccc(COCCN)c2)c(=O)[nH]1

CC(C)n1ncc2c(cc(cc12)-c1cccc(CN2CCN(C)CC2)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(CN3CCNC(=O)C3)cc2)c(=O)[nH]1

CN(C)Cc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C1CCCC1)-c1ccc(CN2CCOCC2)cc1

CCOc1ccc(cc1-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1)S(=O)(=O)N1CCN(C)CC1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(CN3CCOCC3)c(Cl)c2)c(=O)[nH]1

CN(CCO)Cc1cccc(c1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2cnc(N)nc2)c(=O)[nH]1

CN(C)Cc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCN(CC3)C(=O)C(C)(C)C)c2c1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(CN3CCOCC3)cc2Cl)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2cnn(CCN3CCOCC3)c2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCN(CC2)C(=O)C(C)(C)C)-c2cnn(CCN3CCOCC3)c2)c(=O)[nH]1

CN(C)CCCOc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:27|

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2CC(C)(C)NC(C)(C)C2)c(=O)[nH]1

CC(=O)N1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1 |c:6|

CN1CCC(CC1)C(=O)N1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1 |c:13|

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2CCN(CC2)C2CCNCC2)c(=O)[nH]1

CN1CCN(Cc2cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c3cnn(C4CCCC4)c3c2)CC1

Cc1cc(C)c(CNC(=O)c2cc(CO)cc3n(ncc23)C2CCCC2)c(=O)[nH]1

Cc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(Cl)cc3n(ncc23)C2CCCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C(F)(F)F)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(CC2)C(=O)OC(C)(C)C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(CC2)C(=O)C(C)(C)C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(CC2)C(=O)C2CNC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(Cc3ccccc3)CC2)c(=O)[nH]1

CN1CCC(CC1)N1CCC(CC1)n1ncc2c(cc(Br)cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C)Cc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Br)cc2n(ncc12)C1CCCC1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)N2CCN(CC2)C(=O)C2CCNCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)N2CCNCC2)c(=O)[nH]1

CC(C)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)N2CCN(CCO)CC2)c(=O)[nH]1

Cc1cc(CN2CCC[C@@H]2C(N)=O)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCCC2)c(=O)[nH]1 |r|

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCN(CC2)C(=O)C(C)(C)C)C(F)(F)F)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Cl)cc3n(ncc23)C2CCN(CC2)C(=O)C(C)(C)C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCN(CC2)C(=O)C(C)(C)C)C2=CC(C)(C)NC(C)(C)C2)c(=O)[nH]1 |t:34|

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(CC2)C(=O)C2CCCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(CC2)C(=O)C2CCCCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(CC2)C(=O)C2CCOCC2)c(=O)[nH]1

CN(C)CC(=O)N1CCC(CC1)n1ncc2c(cc(Br)cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C)CCCN1CCC(CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCOCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(C2)C(=O)OC(C)(C)C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(C2)C(=O)C(C)(C)C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CN(C2)C(=O)OC(C)(C)C)c(=O)[nH]1

CC(=O)N1CC(C1)n1ncc2c(cc(Br)cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CN(C2)C(=O)C(C)(C)C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CCN(CC2)C(=O)C2CNC2)c(=O)[nH]1 |t:27|

CN(C)CC(=O)N1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1 |c:9|

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CCN(CC2)C(=O)C2CCNCC2)c(=O)[nH]1 |t:27|

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CCNCC2)c(=O)[nH]1 |t:27|

CC(C)C(=O)N1CCC(CC1)n1ncc2c(cc(Br)cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(C=O)cc3n(ncc23)C2CCCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CCN(CC2)C2CCNCC2)c(=O)[nH]1 |t:27|

CNCC(=O)N1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1 |c:8|

CN(C)CCN1CCC(CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CCN(CC2)C(=O)CN)c(=O)[nH]1 |t:27|

CNCCN1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1 |c:7|

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CCN(CCN)CC2)c(=O)[nH]1 |t:27|

CN1CC(C1)C(=O)N1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1 |c:11|

CNCCN1CCC(CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(CC2)C(=O)C2CCNCC2)c(=O)[nH]1

CN(C)CCNCc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CCN(CC2)C(=O)CO)c(=O)[nH]1 |t:27|

CCC(=O)N1CCC(CC1)n1ncc2c(cc(Br)cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C)CCN1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1 |c:8|

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)N2CCN(CCN)CC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)N2CCN(CC2)C2CCNCC2)c(=O)[nH]1

CC(=O)N1CCC(CC1)n1ncc2c(cc(Br)cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

CC(=O)N1CCN(CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

CN(C)CCCN(C)Cc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Br)cc2n(ncc12)C1CCCC1

CN1CCN(Cc2cc(C)[nH]c(=O)c2CNC(=O)c2cc(Br)cc3n(ncc23)C2CCCC2)CC1

Cc1cc(C)c(CNC(=O)c2cc(CN3CCOCC3)cc3n(ncc23)C2CCCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(CC2)C2CCCCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cccc3n(ncc23)C2CCCC2)c(=O)[nH]1

CN(C)CCCN(C)Cc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(C)c(CNC(=O)c2cc(COCCO)cc3n(ncc23)C2CCCC2)c(=O)[nH]1

Cc1cc(CN2CCNC(=O)C2)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCCC2)c(=O)[nH]1

CC(C)N1CCC(CC1)n1ncc2c(cc(Br)cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cccc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

COCCOCc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

COCCNCc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

CN1CCN(Cc2cc(C)[nH]c(=O)c2CNC(=O)c2cccc3n(ncc23)C2CCCC2)CC1

CN(C)CCN(C)Cc1cc(C)[nH]c(=O)c1CNC(=O)c1cccc2n(ncc12)C1CCCC1

CN(CCN)Cc1cc(C)[nH]c(=O)c1CNC(=O)c1cccc2n(ncc12)C1CCCC1

Cc1cc(C)c(CNC(=O)c2cc(CNCCO)cc3n(ncc23)C2CCCC2)c(=O)[nH]1

CN(C)CCN(C)Cc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(CN2CCC(CC2)N2CCCCC2)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCCC2)c(=O)[nH]1

CN(C)CCCN(C)Cc1cc(C)[nH]c(=O)c1CNC(=O)c1cccc2n(ncc12)C1CCCC1

CN(C)Cc1cc(C)[nH]c(=O)c1CNC(=O)c1cccc2n(ncc12)C1CCCC1

Cc1cc(CN2CCCC2)c(CNC(=O)c2cccc3n(ncc23)C2CCCC2)c(=O)[nH]1

CNCc1cc(C)[nH]c(=O)c1CNC(=O)c1cccc2n(ncc12)C1CCCC1

Cc1cc(CN2CCOCC2)c(CNC(=O)c2cccc3n(ncc23)C2CCCC2)c(=O)[nH]1

CN(C)CCOCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Br)cc2n(ncc12)C1CCCC1

CN(C)CCCOCc1cc(C)[nH]c(=O)c1CNC(=O)c1cccc2n(ncc12)C1CCCC1

CN(C)CCCOCc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1

Cc1cc(CO)c(CNC(=O)c2cccc3n(ncc23)C2CCCC2)c(=O)[nH]1

Cc1cc(CNCC2CCOCC2)c(CNC(=O)c2cccc3n(ncc23)C2CCCC2)c(=O)[nH]1

CN(C)CCCOCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Br)cc2n(ncc12)C1CCCC1

CN(C)CCCN1CCC(=CC1)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C3CCCC3)c2c1 |c:9|

Cc1cc(C)c(CNC(=O)c2cc(CN3CCC[C@@H]3C(N)=O)cc3n(ncc23)C2CCCC2)c(=O)[nH]1 |r|

Cc1cc(C)c(CNC(=O)c2cc(CN3CCNC(=O)C3)cc3n(ncc23)C2CCCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2=CCN(CCO)CC2)c(=O)[nH]1 |t:27|

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2CCN(CCN)CC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)C2CCN(CCO)CC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)cc3n(ncc23)C2CCN(CC2)C(=O)C2CCC2)c(=O)[nH]1

CC(C)n1ccc2c(cccc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ccc23)C2CCCC2)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

CC(C)n1ccc2c(ccnc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ccc2c(cc(nc12)-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3ccccc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3ccc(F)cc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3cc(OC)c(OC)cc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3cc(OC)ccc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCC2C(=O)NC(C)c3cccc(F)c23)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3c(F)cccc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCS(=O)(=O)CC2)cc1

CCC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(CC1)C(=O)OC(C)(C)C)C(=O)NCc1c2ccccc2c(C)[nH]c1=O

CCC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c2ccccc2c(C)[nH]c1=O

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3cc(F)cc(F)c3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3cccc(F)c3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3ccccc3c(CC)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3ccc(F)cc3c(CC)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3ccc(C)cc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

Cc1[nH]c(=O)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(nc2)N2CCNCC2)c2ccccc12

CCN(c1cc(OC2CCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(OC2CC(C)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(OC2CC(F)(F)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

Cc1cc(C)c(CNC(=O)c2cc(OC3CCC3)cc(OC3CCOCC3)c2C)c(=O)[nH]1

CCN(c1cc(O[C@H]2C[C@@H](CN3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](CN3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(SC2CCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(S(=O)C2CCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(S(=O)(=O)C2CCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(OC2CCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(OC2CC(C)(C)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(OC2CC(C(=O)N3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(OC2CC(CN3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@@H](N3CCNCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCNCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@@H](N3CCN(C)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCN(C)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@@H](N3CCN(C(C)C)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCN(C(C)C)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN1CCN([C@H]2C[C@@H](Oc3cc(C(=O)NCc4c(C)cc(C)[nH]c4=O)c(C)c(N(CC)C4CCOCC4)c3)C2)CC1

CCN1CCN([C@H]2C[C@H](Oc3cc(C(=O)NCc4c(C)cc(C)[nH]c4=O)c(C)c(N(CC)C4CCOCC4)c3)C2)CC1

CCN(c1cc(O[C@H]2C[C@@H](N3CCN(C(C)=O)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCN(C(C)=O)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@@H](N3CCN(S(C)(=O)=O)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCN(S(C)(=O)=O)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](CN3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](CN3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](CN3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](CN3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)[C@H]1CC[C@H](N(C)CCOC)CC1

CCN(c1cc(OC2CC(N3CC(C)OC(C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CC(C)OC(C)C1

CCN(c1cc(OC2CC(N3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)[C@H]1CC[C@H](N(C)CCOC)CC1

CCN(c1cc(O[C@H]2C[C@H](N3CC(C)OC(C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CC(C)OC(C)C1

CCN(c1cc(O[C@H]2C[C@H](CN3CCCCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCC(C)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(OC2CC(N3CC(C)OC(C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CC(C)OC(C)C1

CCN(c1cc(OC2CC(N3CC(C)OC(C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CC(C)OC(C)C1

CCN(c1cc(O[C@H]2C[C@@H](N3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@@H](N3CCNCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCNCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCC(F)(F)CC1

CCN(c1cc(O[C@H]2C[C@H](N3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOC1

CCN(c1cc(O[C@H]2C[C@H](N3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CC2CCC(C1)O2

CCN(c1cc(O[C@H]2C[C@H](N3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CC4CCC(C3)O4)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCN(CC(F)(F)F)CC1

CCN(c1cc(O[C@H]2C[C@H](N3CCOCC3)C2)cc(C(=O)N(C)Cc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)[C@H]1CC[C@H](N(C)CCOC)CC1

CCN(c1cc(O[C@H]2C[C@H](CN3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CC4CC(C3)O4)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CC4CC(C3)O4)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@@H](N3CCC(C)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

Cc1cc(C)c(CNC(=O)c2cc(O[C@H]3C[C@H](N4C[C@@H](C)O[C@@H](C)C4)C3)cc(NC3CCOCC3)c2C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(O[C@H]3C[C@H](N4C[C@@H](C)O[C@@H](C)C4)C3)cc(NC3CCOC3)c2C)c(=O)[nH]1

CCN(c1cc(O[C@H]2C[C@H](N3CCC(C)CC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](CN3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1F)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCC(F)(F)CC1

CCN(c1cc(O[C@H]2C[C@H](N3CCOCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOC1

CCN(c1cc(C2CC2CO)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2CN2CCOCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2CN2CCNCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2CN2CCN(C)CC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2CN2C[C@@H](C)O[C@@H](C)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2CN2CCN(CC(C)(C)C)CC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2CN2CCCCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2CN2CCC(F)(F)CC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2CN2CCC(F)CC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2CN2CCN(C(=O)OC)CC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(C2CC2CN2CCN(C)CC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)[C@H]1CC[C@H](N(C)CCOC)CC1

CCN(c1cc(C2CC2CN2CCOCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)[C@H]1CC[C@H](N(C)CCOC)CC1

CCN(c1cc(C2CC2CN2CCNCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(C2CC2CN2CCOCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(C2CC2CN2C[C@@H](C)O[C@@H](C)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCN(C)CC3)C2)cc(C(=O)NCc2c(OC)cc(C)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCN(C)CC3)C2)cc(C(=O)NCc2c(C)cc(C(F)(F)F)[nH]c2=O)c1Cl)C1CCOCC1

CCN(c1cc(OC2CN(C(=O)OC(C)(C)C)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(OC2CNC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(C1CCC(F)(F)CC1)c1cc(O[C@H]2C[C@@H](C2)N2CCCCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r,wU:15.15,wD:17.20,(5.23,5.93,;3.89,5.16,;3.89,3.62,;5.23,2.85,;6.56,3.62,;7.9,2.85,;7.9,1.31,;8.67,-.02,;9.44,1.31,;6.56,.54,;5.23,1.31,;2.56,2.85,;2.56,1.31,;1.24,.54,;1.24,-1,;2.57,-1.77,;4.08,-1.36,;4.48,-2.85,;2.97,-3.26,;5.81,-3.62,;7.15,-2.85,;8.48,-3.62,;8.48,-5.16,;7.15,-5.93,;5.81,-5.16,;-.1,1.3,;-.1,2.85,;-1.44,3.62,;-1.44,5.16,;-2.77,2.85,;-4.1,3.62,;-5.44,2.85,;-5.43,1.31,;-4.1,.54,;-6.77,.54,;-8.1,1.31,;-9.44,.54,;-8.1,2.85,;-6.77,3.62,;-6.77,5.16,;1.23,3.62,;1.23,5.16,)|

CCN(c1cc(O[C@H]2C[C@H](N3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(OC)cc(C)[nH]c2=O)c1C)C1CCC(F)(F)CC1

CCN(c1cc(O[C@H]2C[C@H](N3C[C@@H](C)O[C@@H](C)C3)C2)cc(C(=O)NCc2c(OC)cc(C)[nH]c2=O)c1C)C1CC2CCC(C1)O2

CCN(C1CCC(F)(F)CC1)c1cc(O[C@H]2C[C@@H](C2)N2CCCCC2)cc(C(=O)NCc2c(OC)cc(C)[nH]c2=O)c1C |r,wU:15.15,wD:17.20,(5.23,5.93,;3.89,5.16,;3.89,3.62,;5.23,2.85,;6.56,3.62,;7.9,2.85,;7.9,1.31,;8.67,-.02,;9.44,1.31,;6.56,.54,;5.23,1.31,;2.56,2.85,;2.56,1.31,;1.24,.54,;1.24,-1,;2.57,-1.77,;4.08,-1.36,;4.48,-2.85,;2.97,-3.26,;5.81,-3.62,;7.15,-2.85,;8.48,-3.62,;8.48,-5.16,;7.15,-5.93,;5.81,-5.16,;-.1,1.3,;-.1,2.85,;-1.44,3.62,;-1.44,5.16,;-2.77,2.85,;-4.1,3.62,;-5.44,2.85,;-5.43,1.31,;-4.1,.54,;-2.77,1.31,;-6.77,.54,;-8.1,1.31,;-9.44,.54,;-8.1,2.85,;-6.77,3.62,;-6.77,5.16,;1.23,3.62,;1.23,5.16,)|

CCN(c1cc(OC2CC(N3CCCCC3)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCCCC3)C2)cc(C(=O)NCc2c(OC)cc(C)[nH]c2=O)c1C)C1CCOCC1

CCN(c1cc(O[C@H]2C[C@H](N3CCCCC3)C2)cc(C(=O)NCc2c(O)cc(C)[nH]c2=O)c1C)C1CCC(F)(F)CC1

CCN(c1cc(O[C@H]2C[C@H](N3CCCCC3)C2)cc(C(=O)NCc2c(CO)cc(C)[nH]c2=O)c1C)C1CCC(F)(F)CC1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(Br)c2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2ccc3OC(C)(C)Cc3c2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(Cl)c2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(F)c2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)C(F)(F)F)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(C)c2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)c3OC(C)(C)Cc3c2C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2ccc3OC(C)(C)Cc3c2C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(C)c3OC(C)(C)Cc3c2C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(nc2)N2CCOCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2cnc3ccccc3c2)c(=O)[nH]1

COc1ccc(cn1)-c1cc(cc2CC(C)(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(\C=C\c3ccccc3)c2)c(=O)[nH]1

CN1CCN(CC1)C(=O)c1ccc(cc1)-c1cc(cc2CC(C)(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2cnc(nc2)N2CCN(CC2)C(=O)OC(C)(C)C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(cc2)N2CCNCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(CN3CCCCC3)cc2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2cnc(nc2)N2CCNCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(Cc3ccccc3)c2)c(=O)[nH]1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(C)Oc2c(Cl)c1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(C)Oc2c(Br)c1

COc1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)c2CC(C)(C)Oc12

Cc1cc(C)c(CNC(=O)c2cc(c3OC(C)(C)Cc3c2C)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1

CC1COc2c1cc(cc2-c1ccc(nc1)N1CCOCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1COc2c1cc(cc2-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1COc2c1cc(cc2-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cn1)-c1cc(cc2C(C)COc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1Cc2cc(cc(Br)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cn1)-c1cc(cc2CC(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1Cc2cc(cc(c2O1)-c1ccc(nc1)N1CCOCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1Cc2cc(cc(c2O1)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1Cc2cc(cc(c2O1)-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cn1)-c1cc(cc2CCOc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc3CCOc3c(c2)-c2ccc(nc2)N2CCOCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CCOc3c(c2)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1

COc1ccc(cn1)-c1cc(cc2c1OCC2(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

C[C@@H]1Oc2c(cc(cc2Br)C(=O)NCc2c(C)cc(C)[nH]c2=O)[C@H]1C |r|

Cc1cc(C)c(CNC(=O)c2ccc3OC(C)(C)CCc3c2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)c3OC(C)(C)CCc3c2)c(=O)[nH]1

COc1ccc(cn1)-c1cc(cc2CCC(C)(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(Br)c3OCC=C(C)Cc3c2)c(=O)[nH]1 |t:17|

CC1COCc2c(Br)cc(cc2C1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cn1)-c1cc(cc2CC(C)CCOc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1CC=Cc2cc(ccc2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O |c:3|

CC1CCCc2cc(ccc2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1CCCc2cc(cc(Br)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1CCCc2cc(cc(-c3ccc(CN4CCOCC4)cc3)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1CCCc2cc(cc(-c3ccc(nc3)N3CCNCC3)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cn1)-c1cc(cc2CCCC(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1CCc2cc(cc(Br)c2OC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cn1)-c1cc(cc2CCC(C)COc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC1CCc2cc(cc(-c3ccc(nc3)N3CCNCC3)c2OC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cn1)-c1cc(cc2CC(C)(Oc12)C=C)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(Oc3c(Br)c2)C=C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(Oc3c(c2)-c2ccc(CN3CCOCC3)cc2)C=C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(Oc3c(c2)-c2ccc(nc2)N2CCNCC2)C=C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC(C)(Oc3c(c2)-c2cnc(nc2)N2CCN(CC2)C(=O)OC(C)(C)C)C=C)c(=O)[nH]1

CCC1(C)Cc2cc(cc(c2O1)-c1ccc(OC)nc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCC1(C)Cc2cc(cc(c2O1)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc3[C@@H]4CCC[C@]4(C)Oc3c(Br)c2)c(=O)[nH]1 |r|

Cc1cc(C)c(CNC(=O)c2cc3[C@@H]4CCC[C@]4(C)Oc3c(c2)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1 |r|

COc1ccc(cn1)-c1cc(cc2[C@@H]3CCC[C@]3(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

Cc1cc(C)c(CNC(=O)c2cc3[C@@H]4CCC[C@]4(C)Oc3c(c2)-c2ccc(CN3CCCCC3)cc2)c(=O)[nH]1 |r|

Cc1cc(C)c(CNC(=O)c2cc3[C@@H]4CCC[C@]4(C)Oc3c(c2)-c2ccc(cc2)N2CCNCC2)c(=O)[nH]1 |r|

Cc1cc(C)c(CNC(=O)c2cc3[C@@H]4CCC[C@]4(C)Oc3c(Br)c2C)c(=O)[nH]1 |r|

Cc1cc(C)c(CNC(=O)c2cc3CC4(CCCC4)Oc3c(Br)c2)c(=O)[nH]1

COc1ccc(cn1)-c1cc(cc2CC3(CCCC3)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc3CC4(CCCC4)Oc3c(c2)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC4(CCCC4)Oc3c(c2)-c2cnc(nc2)N2CCN(CC2)C(=O)OC(C)(C)C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3CC4(CCCC4)Oc3c(c2)-c2ccc(CN3CCCCC3)cc2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3c(OCC33CCCC3)c(Br)c2)c(=O)[nH]1

COc1ccc(cn1)-c1cc(cc2c1OCC21CCCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc3c(OCC33CCCC3)c(c2)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc3c(OCC33CCCC3)c(c2)-c2ccc(CN3CCCCC3)cc2)c(=O)[nH]1

CC(C)C1Cc2cc(cc(Br)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)C1Cc2cc(cc(c2O1)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(Br)c3OCC(C)=C(C)Cc3c2)c(=O)[nH]1 |t:18|

CC(=C)C1(C)Cc2cc(cc(Br)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cn1)-c1cc(cc2CC(C)(Oc12)C(C)=C)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1ccc(cn1)-c1cc(cc2CC(C)(Oc12)C(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(=C)C1(C)Cc2cc(cc(c2O1)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Br)c2OCC(C)=C(C)Cc2c1 |t:24|

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(Oc2c(c1)-c1ccc(nc1)N1CCNCC1)C(C)=C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(Oc2c(c1)-c1ccc(nc1)N1CCNCC1)C(C)C

Cc1cc(C)c(CNC(=O)c2cc(Br)c3OC\C=C/COc3c2)c(=O)[nH]1 |c:17|

Cc1cc(C)c(CNC(=O)c2cc(Br)c3OC(COc3c2)C=C)c(=O)[nH]1

CCC1COc2cc(cc(Br)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCC1COc2cc(cc(-c3ccc(nc3)N3CCNCC3)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(Oc2c(c1)-c1ccc(nc1)N1CCN(CC1)C(C)C)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(Oc2c(c1)-c1cnc(nc1)N1CCNCC1)C(C)=C

CC(C)Oc1cc(Cl)c2CCN(Cc3c4occc4c(C)[nH]c3=O)C(=O)c2c1Cl

Cc1[nH]c(=O)c(CN2CCc3c(Cl)cc(N4CC5(C4)CCOCC5)c(Cl)c3C2=O)c2occc12

CCN(C1CCOCC1)c1cc(Cl)c2CCN(Cc3c4occc4c(C)[nH]c3=O)C(=O)c2c1Cl

CC(C)Oc1cc(Cl)c2CCN(Cc3c4cc[nH]c4c(C)[nH]c3=O)C(=O)c2c1Cl

Cc1[nH]c(=O)c(CN2CCc3c(Cl)cc(N4CC5(C4)CCOCC5)c(Cl)c3C2=O)c2CCNc12

CC(C)Oc1ccc2CCN(Cc3c4occc4c(C)[nH]c3=O)C(=O)c2c1Cl

Cc1nnn(C)c1-c1cc(Br)c2CCN(Cc3c4occc4c(C)[nH]c3=O)C(=O)c2c1Cl |(-9.04,-9.59,;-8.72,-8.08,;-9.75,-6.94,;-8.98,-5.6,;-7.47,-5.92,;-6.33,-4.89,;-7.31,-7.46,;-5.98,-8.23,;-5.98,-9.77,;-4.64,-10.54,;-4.64,-12.08,;-3.31,-9.77,;-1.97,-10.54,;-.64,-9.77,;-.64,-8.23,;.69,-7.46,;2.03,-8.23,;2.03,-9.77,;.88,-10.8,;1.51,-12.2,;3.04,-12.04,;3.36,-10.54,;4.69,-9.77,;6.03,-10.54,;4.69,-8.23,;3.36,-7.46,;3.36,-5.92,;-1.97,-7.46,;-1.97,-5.92,;-3.31,-8.23,;-4.64,-7.46,;-4.64,-5.92,)|

CC(C)Oc1cc(Cl)c2CCN(Cc3c4oc(C)cc4c(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1COC1)c1cc(Cl)c2CCN(Cc3c4occc4c(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CNC1)c1cc(Cl)c2CCN(Cc3c4occc4c(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CN(C)C1)c1cc(Cl)c2CCN(Cc3c4cc[nH]c4c(C)[nH]c3=O)C(=O)c2c1Cl

Cc1noc(C)c1-c1cc(Cl)c2CCN(Cc3c4cc[nH]c4c(C)[nH]c3=O)C(=O)c2c1Cl |(-6.52,-22.08,;-7.85,-22.85,;-9.32,-22.38,;-10.22,-23.62,;-9.32,-24.87,;-9.72,-26.36,;-7.85,-24.39,;-6.52,-25.16,;-6.52,-26.7,;-5.19,-27.47,;-5.19,-29.01,;-3.85,-26.7,;-2.52,-27.47,;-1.19,-26.7,;-1.19,-25.16,;.15,-24.39,;1.48,-25.16,;1.48,-26.7,;.34,-27.73,;.96,-29.14,;2.52,-29.07,;2.81,-27.47,;4.15,-26.7,;5.48,-27.47,;4.15,-25.16,;2.81,-24.39,;2.81,-22.85,;-2.52,-24.39,;-2.52,-22.85,;-3.85,-25.16,;-5.19,-24.39,;-5.19,-22.85,)|

Cc1nnn(C)c1-c1cc(Cl)c2CCN(Cc3c4cc[nH]c4c(C)[nH]c3=O)C(=O)c2c1Cl |(-27.32,4.32,;-26.93,5.8,;-27.83,7.05,;-26.93,8.3,;-25.46,7.82,;-24.13,8.59,;-25.46,6.28,;-24.13,5.51,;-24.13,3.97,;-22.79,3.2,;-22.79,1.66,;-21.46,3.97,;-20.13,3.2,;-18.79,3.97,;-18.79,5.51,;-17.46,6.28,;-16.13,5.51,;-16.13,3.97,;-17.27,2.94,;-16.64,1.53,;-15.11,1.69,;-14.79,3.2,;-13.46,3.97,;-12.12,3.2,;-13.46,5.51,;-14.79,6.28,;-14.79,7.82,;-20.13,6.28,;-20.13,7.82,;-21.46,5.51,;-22.79,6.28,;-22.79,7.82,)|

Cc1nnn(C)c1-c1cc(Cl)c2CCN(Cc3c4cc[nH]c4c(C)[nH]c3=O)C(=O)c2c1Cl |(-9.48,-12.44,;-9.08,-10.96,;-9.98,-9.71,;-9.08,-8.46,;-7.61,-8.94,;-6.28,-8.17,;-7.61,-10.48,;-6.28,-11.25,;-6.28,-12.79,;-4.95,-13.56,;-4.95,-15.1,;-3.61,-12.79,;-2.28,-13.56,;-.94,-12.79,;-.94,-11.25,;.39,-10.48,;1.72,-11.25,;1.72,-12.79,;.58,-13.82,;1.21,-15.23,;2.77,-15.16,;3.06,-13.56,;4.39,-12.79,;5.72,-13.56,;4.39,-11.25,;3.06,-10.48,;3.06,-8.94,;-2.28,-10.48,;-2.28,-8.94,;-3.61,-11.25,;-4.95,-10.48,;-4.95,-8.94,)|

Cc1noc(C)c1-c1cc(Cl)c2CCN(Cc3c4occc4c(C)[nH]c3=O)C(=O)c2c1Cl |(-6.35,.99,;-7.68,.22,;-9.15,.69,;-10.05,-.55,;-9.15,-1.8,;-9.55,-3.29,;-7.68,-1.32,;-6.35,-2.09,;-6.35,-3.63,;-5.02,-4.4,;-5.02,-5.94,;-3.68,-3.63,;-2.35,-4.4,;-1.02,-3.63,;-1.02,-2.09,;.32,-1.32,;1.65,-2.09,;1.65,-3.63,;.51,-4.66,;1.13,-6.07,;2.67,-5.91,;2.99,-4.4,;4.32,-3.63,;5.65,-4.4,;4.32,-2.09,;2.99,-1.32,;2.99,.22,;-2.35,-1.32,;-2.35,.22,;-3.68,-2.09,;-5.02,-1.32,;-5.02,.22,)|

COC(C1COC1)c1cc(Cl)c2CCN(Cc3c4ccn(C)c4c(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CS(=O)(=O)C1)c1cc(Cl)c2CCN(Cc3c4occc4c(C)[nH]c3=O)C(=O)c2c1Cl

CC(C1COC1)c1cc(Cl)c2CCN(Cc3c4cc[nH]c4c(C)[nH]c3=O)C(=O)c2c1Cl

CNCCN(C)Cc1ccc(cc1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN(C)CCN2CCCC2)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)c(Cl)c(nc12)-c1ccc2OCCOc2c1

CNCCN(C)Cc1cccc(c1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)n1ncc2c(cc(nc12)-c1ccccc1CN)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(nc12)-c1cccc(CN(C)CCN(C)C)c1)C(=O)NCc1c(C)cc(C)n(C)c1=O

Cc1cc[nH]c(=O)c1CNC(=O)c1cc(nc2n(ncc12)C(C)(C)C)-c1ccc2OCCOc2c1

CC(C)n1ncc2c(cc(nc12)-c1cccc(CNCCCN(C)C)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(nc3n(ncc23)C2CCCC2)C2CC(C)(C)NC(C)(C)C2)c(=O)[nH]1

CC(C)c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

CC(C)c1cc(C)[nH]c(=O)c1CNC(=O)c1cc(nc2n(ncc12)C(C)C)C1=CC(C)(C)NC(C)(C)C1 |t:30|

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2ccc(CN3CCC[C@@H]3C(N)=O)cc2)c(=O)[nH]1 |r|

CC(=O)N1CC(C1)n1ncc2c(cc(Br)cc12)C(=O)NCC1C(=O)NC(C)=CC1=O |c:29|

CC1NC(C)=CC(C)=C1CNC(=O)c1cc(cc2n(ncc12)C1CCCC1)C1=CCN(CC1)C(=O)C1CN(C)C1 |c:4,7,t:31|

CNCCN1CCC(CC1)c1cc(C(=O)NCC2=C(C)C=C(C)NC2C)c2cnn(C3CCCC3)c2c1 |c:18,t:21|

[H][C@@]1(CCOC1)[C@@H](CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(CO)C4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1

[H][C@]1(CCOC1)[C@H](CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(CO)N4CC[C@@H](F)C4)c(Cl)c3C2=O)c(=O)[nH]1 |r|

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(F)C4CCN(CC4)C(=O)CO)c(Cl)c3C2=O)c(=O)[nH]1

COC(CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

[H][C@]1(CCCO1)[C@@H](CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

[H][C@@]1(CCCO1)[C@@H](CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

CC(C)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CCC(OC)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

C[C@H](CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

C[C@@H](CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

CCC(CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(CN(C)CCO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

Cc1cc(C)c(CN2CCc3c(Cl)cc(CC(O)=O)c(Cl)c3C2=O)c(=O)[nH]1

Cc1cc(C)c(CN2CCc3c(Cl)cc(CC4CCN(CC4)C(=O)CO)c(Cl)c3C2=O)c(=O)[nH]1

CC(C1CCN(CC1)C(=O)CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CCC(O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(O)C(C)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(CO)C4CCOCC4)c(Cl)c3C2=O)c(=O)[nH]1

CC(C#N)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(CCO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCN(CC1)C(=O)CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

C[C@@H](O)C([C@@H](C)O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

C[C@@H](O)C([C@H](C)O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(CO)c4ccon4)c(Cl)c3C2=O)c(=O)[nH]1

COC(C)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

[H][C@@]1(CCCO1)[C@H](CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

[H][C@]1(CCCO1)[C@H](CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

COC(C(C)=O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCOCC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl)C1(O)CCOCC1

Cc1cc(C)c(CN2CCc3c(Cl)cc([C@@H](CC#N)[C@@H]4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1 |r|

Cc1cc(OC(F)F)c(CN2CCc3c(Cl)cc(C(C4CCOCC4)C(O)=O)c(Cl)c3C2=O)c(=O)[nH]1

Cc1cc(OC(F)F)c(CN2CCc3c(Cl)cc(C(CO)C4CCOCC4)c(Cl)c3C2=O)c(=O)[nH]1

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(CO)N4CCCC4)c(Cl)c3C2=O)c(=O)[nH]1

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(CO)N4CC[C@H](F)C4)c(Cl)c3C2=O)c(=O)[nH]1 |r|

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(CO)N4CCC(F)(F)C4)c(Cl)c3C2=O)c(=O)[nH]1

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(CO)N4CCOCC4)c(Cl)c3C2=O)c(=O)[nH]1

COC(C1CCN(CC1)C(=O)CC#N)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

Cc1cc(C)c(CN2CCc3ccc([C@@H](CO)[C@@H]4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1 |r|

Cc1cc(C)c(CN2CCc3ccc([C@H](CO)[C@@H]4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1 |r|

COC(C1CCN(CC1)C=O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(=C1CNC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |(-5.06,3.08,;-5.06,1.54,;-6.39,.77,;-7.88,1.17,;-8.28,-.32,;-6.79,-.72,;-3.72,.77,;-3.72,-.77,;-2.39,-1.54,;-2.39,-3.08,;-1.06,-.77,;.28,-1.54,;1.61,-.77,;1.61,.77,;2.94,1.54,;4.28,.77,;4.28,-.77,;2.94,-1.54,;5.61,-1.54,;6.94,-.77,;8.28,-1.54,;6.94,.77,;5.61,1.54,;5.61,3.08,;.28,1.54,;.28,3.08,;-1.06,.77,;-2.39,1.54,;-2.39,3.08,)|

CC(=C1CN(C1)C(=O)CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |(-3.06,3.08,;-3.06,1.54,;-4.39,.77,;-5.88,1.17,;-6.28,-.32,;-4.79,-.72,;-7.61,-1.09,;-7.61,-2.63,;-8.95,-.32,;-10.28,-1.09,;-1.72,.77,;-1.72,-.77,;-.39,-1.54,;-.39,-3.08,;.94,-.77,;2.28,-1.54,;3.61,-.77,;3.61,.77,;4.94,1.54,;6.28,.77,;6.28,-.77,;4.94,-1.54,;7.61,-1.54,;8.95,-.77,;10.28,-1.54,;8.95,.77,;7.61,1.54,;7.61,3.08,;2.28,1.54,;2.28,3.08,;.94,.77,;-.39,1.54,;-.39,3.08,)|

CC(=O)N1CC(C1)=C(C)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |(-9.61,-.32,;-8.28,-1.09,;-8.28,-2.63,;-6.94,-.32,;-6.55,1.17,;-5.06,.77,;-5.46,-.72,;-3.72,1.54,;-3.72,3.08,;-2.39,.77,;-2.39,-.77,;-1.06,-1.54,;-1.06,-3.08,;.28,-.77,;1.61,-1.54,;2.94,-.77,;2.94,.77,;4.28,1.54,;5.61,.77,;5.61,-.77,;4.28,-1.54,;6.94,-1.54,;8.28,-.77,;9.61,-1.54,;8.28,.77,;6.94,1.54,;6.94,3.08,;1.61,1.54,;1.61,3.08,;.28,.77,;-1.06,1.54,;-1.06,3.08,)|

CC(=C1CN(C1)S(C)(=O)=O)c1cc(C)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |(-3.72,3.08,;-3.72,1.54,;-5.06,.77,;-6.55,1.17,;-6.94,-.32,;-5.46,-.72,;-8.28,-1.09,;-9.61,-1.86,;-9.05,.24,;-7.51,-2.42,;-2.39,.77,;-2.39,-.77,;-1.06,-1.54,;-1.06,-3.08,;.28,-.77,;1.61,-1.54,;2.94,-.77,;2.94,.77,;4.28,1.54,;5.61,.77,;5.61,-.77,;4.28,-1.54,;6.94,-1.54,;8.28,-.77,;9.61,-1.54,;8.28,.77,;6.94,1.54,;6.94,3.08,;1.61,1.54,;1.61,3.08,;.28,.77,;-1.06,1.54,;-1.06,3.08,)|

COc1cc(C)[nH]c(=O)c1CN1CCc2c(C)cc(C(C)=C3CN(C3)S(C)(=O)=O)c(Cl)c2C1=O |(4.28,-3.08,;4.28,-1.54,;5.61,-.77,;6.94,-1.54,;8.28,-.77,;9.61,-1.54,;8.28,.77,;6.94,1.54,;6.94,3.08,;5.61,.77,;4.28,1.54,;2.94,.77,;2.94,-.77,;1.61,-1.54,;.28,-.77,;-1.06,-1.54,;-1.06,-3.08,;-2.39,-.77,;-2.39,.77,;-3.72,1.54,;-3.72,3.08,;-5.06,.77,;-6.55,1.17,;-6.94,-.32,;-5.46,-.72,;-8.28,-1.09,;-9.61,-1.86,;-9.05,.24,;-7.51,-2.42,;-1.06,1.54,;-1.06,3.08,;.28,.77,;1.61,1.54,;1.61,3.08,)|

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(F)=C4CN(C4)C(=O)CO)c(Cl)c3C2=O)c(=O)[nH]1 |(10.28,-1.54,;8.95,-.77,;7.61,-1.54,;6.28,-.77,;4.94,-1.54,;6.28,.77,;4.94,1.54,;3.61,.77,;3.61,-.77,;2.28,-1.54,;.94,-.77,;-.39,-1.54,;-.39,-3.08,;-1.72,-.77,;-1.72,.77,;-3.06,1.54,;-3.06,3.08,;-4.39,.77,;-5.88,1.17,;-6.28,-.32,;-4.79,-.72,;-7.61,-1.09,;-7.61,-2.63,;-8.95,-.32,;-10.28,-1.09,;-.39,1.54,;-.39,3.08,;.94,.77,;2.28,1.54,;2.28,3.08,;7.61,1.54,;7.61,3.08,;8.95,.77,)|

CC(=C1CCNCC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |(-4.67,3.08,;-4.67,1.54,;-6,.77,;-7.34,1.54,;-8.67,.77,;-8.67,-.77,;-7.34,-1.54,;-6,-.77,;-3.33,.77,;-3.33,-.77,;-2,-1.54,;-2,-3.08,;-.67,-.77,;.67,-1.54,;2,-.77,;2,.77,;3.33,1.54,;4.67,.77,;4.67,-.77,;3.33,-1.54,;6,-1.54,;7.34,-.77,;8.67,-1.54,;7.34,.77,;6,1.54,;6,3.08,;.67,1.54,;.67,3.08,;-.67,.77,;-2,1.54,;-2,3.08,)|

CC1=CC(=C(C(=O)N1)CN2CCc3c(cc(c(c3C2=O)Cl)[C@@H](C4COC4)OC)Cl)OC

CO[C@@H](C1COC1)c1cc(Cl)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

CO[C@H]([C@@H]1CCOC1)c1cc(C)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

COC(C1CCOC1)c1cc(C)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl

CO[C@@H]([C@H]1CCOC1)c1cc(C)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

COc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)cc(C(C)C3CN(C)C3)c(Cl)c2C1=O

CC(C1CN(C)C1)c1cc(C)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(N1CCOCC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

Cc1cc(OC(F)F)c(CN2CCc3c(Cl)cc(C(CO)C4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1

Cc1cc(C)c(CN2CCc3ccc(C(CO)C4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1

Cc1cc(C)c(CN2CCc3c(C)cc(C(CO)C4CCOCC4)c(Cl)c3C2=O)c(=O)[nH]1

COC(C(C)O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(CO)O[C@@H]4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1 |r|

COc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)cc([C@H](CO)[C@H]3CCCO3)c(Cl)c2C1=O |r|

COc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)cc([C@H](CO)[C@@H]3CCCO3)c(Cl)c2C1=O |r|

CCC(OC)c1cc(Cl)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCN(CC1)C(C)=O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCN(CC1)C(=O)CO)c1cc(Cl)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCN(C1)C(=O)CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCS(=O)CC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCS(=O)(=O)CC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCN(CC1)C=O)c1cc(Cl)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl)C1(F)CCN(C)CC1

COC(C1CCN(CC1)C(C)=O)c1cc(Cl)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCOC1)c1cc(Cl)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CN(C1)C(=O)CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCS(=O)(=O)CC1)c1cc(C)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCS(=O)(=O)CC1)c1cc(C)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCOC1)c1ccc2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCN(C)CC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CN(C1)C(=O)CO)c1cc(Br)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC([C@H](C)CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

COC([C@@H](C)CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

COC(C1COC1)c1cc(C)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCN(C)CC1)c1cc(Br)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCS(=O)(=O)C1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CS(=O)(=O)C1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCN(CC1)C1COC1)c1cc(C)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCN(CC1)C1COC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CCOC(C1CS(=O)(=O)C1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCOC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCNCC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CCN(CC1)C(=O)CO)c1cc(C)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CN(C1)C(=O)[C@@H](C)O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

COC(C1CN(C1)C(=O)[C@H](C)O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

COC(C1CN(C)C1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CN(C1)S(C)(=O)=O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CNC1)c1cc(C)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CN(C)C(=O)C1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COC(C1CN(C1)C1COC1)c1cc(C)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(C1CN(C1)C(=O)CO)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(C1CN(C1)S(C)(=O)=O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(C1CN(C)C1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(C1CNC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COc1cc(C)[nH]c(=O)c1CN1CCc2c(C)cc(C(C)C3CN(C3)S(C)(=O)=O)c(Cl)c2C1=O

CC(C1CN(C1)S(C)(=O)=O)c1cc(C)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(C1COC1)c1cc(C)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COc1cc(C)[nH]c(=O)c1CN1CCc2c(C)cc(C(C)C3COC3)c(Cl)c2C1=O

Cc1cc(C)c(CN2CCc3c(Cl)cc(C(CO)C4CC4)c(Cl)c3C2=O)c(=O)[nH]1

COc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)cc(C(C)C3CCN(CC3)C(=O)CO)c(Cl)c2C1=O

CC(N1CCN(C)CC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)cc(C(C3COC3)N(C)C)c(Cl)c2C1=O

CC(N1CCNCC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

C[C@H](C1CCN(CC(C)(C)C)CC1)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

C[C@H](C1CCN(CC2CCC2)CC1)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

CC(C)CN1CCC(CC1)[C@@H](C)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

C[C@H](C1CCN(CC2CCCC2)CC1)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

CCC(C)(C)CN1CCC(CC1)[C@@H](C)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

C[C@H](C1CCN(CC(C)(C)F)CC1)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

C[C@H](C1CCN(CC2CC2)CC1)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

C[C@H](C1CCN(CC2(C)CCCC2)CC1)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

C[C@H](C1CCN(CC23CCC(CC2)CC3)CC1)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

C[C@H](C1CCN(CC2(C)CCC2)CC1)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

C[C@H](C1CCN(CC2(C)CC2)CC1)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r|

CC(OCC#C)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(OCc1ccc(F)cc1)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(OCc1ccccc1F)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(OCc1cccc(F)c1)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(OCc1cc(F)cc(F)c1)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1cccc(COC(C)c2c(C)c(cc3cccn23)C(=O)NCc2c(C)cc(C)[nH]c2=O)c1

CC(OCc1nccs1)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(OCc1ccsc1)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(OCc1ccn(C)n1)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(OCc1ccnn1C)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(c1ccccc1)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(N1CCOCC1)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(N1CCOCC1)c1c(C)c(cc2c(Cl)ccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1c(C)c(cc2cccn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1c(C)c(cc2cc(Br)cn12)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2c(ccn2c(C(C)N2CCN(CC(F)(F)F)CC2)c1C)-c1ccn[nH]1

COc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2c(ccn2c([C@H](C)N2CCN(CC(F)(F)F)CC2)c1C)-c1ccn[nH]1

COc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2c(ccn2c(C(C)N2CCN(CC(F)(F)F)CC2)c1C)-c1ccc(N)nc1

C[C@H](N1CCN(CC(F)(F)F)CC1)c1c(C)c(cc2c(ccn12)-c1ccc(N)nc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

COc1cc(C)c(CNC(=O)c2cc3c(ccn3c([C@H](C)N3CCN(CC(F)(F)F)CC3)c2C)-c2c(C)noc2C)c(=O)[nH]1 |wU:19.20,(3.33,-9.14,;4.67,-8.37,;4.67,-6.83,;3.33,-6.06,;3.33,-4.52,;2,-3.75,;4.67,-3.75,;4.67,-2.21,;3.33,-1.44,;3.33,.1,;4.67,.87,;2,.87,;.67,.1,;-.67,.87,;-2.13,.4,;-3.04,1.64,;-2.13,2.89,;-.67,2.41,;.67,3.18,;.67,4.72,;2,5.49,;-.67,5.49,;-2,4.72,;-3.33,5.49,;-3.33,7.03,;-4.67,7.8,;-6,7.03,;-7.34,6.26,;-6.77,8.37,;-5.23,5.7,;-2,7.8,;-.67,7.03,;2,2.41,;3.33,3.18,;-2.61,-1.07,;-4.07,-1.54,;-5.32,-.64,;-4.07,-3.08,;-2.61,-3.56,;-1.7,-2.31,;-.16,-2.31,;6,-4.52,;7.34,-3.75,;6,-6.06,)|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2c(ccn2c(C(C)N2CCN(CC(F)(F)F)CC2)c1C)-c1ccc(F)cc1

CN(C1CCCC1)c1cc(cc(c1)-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C1CCCCC1)c1cc(cc(c1)-c1cnn(CCN2CCOCC2)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC.CN(C)Cc1ccc(cc1)-c1cc(N(C)C2CCCCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN([C@@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:2.1,5.8,(-1.33,2.69,;,1.92,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;2.67,5,;1.33,4.23,;5.33,5.01,;6.67,4.24,;8,5.01,;6.67,2.7,;,.38,;-1.33,-.39,;-1.33,-1.93,;,-2.7,;1.33,-1.93,;2.67,-2.7,;2.67,-4.24,;4,-1.93,;5.33,-2.7,;6.67,-1.93,;8,-2.7,;8,-4.24,;9.34,-1.93,;9.34,-.39,;10.67,.38,;8,.38,;6.67,-.39,;5.33,.38,;1.33,-.39,;2.67,.38,;-2.67,-2.7,;-2.67,-4.24,;-4,-5.01,;-5.33,-4.24,;-6.67,-5.01,;-8,-4.24,;-9.34,-5.01,;-10.67,-4.24,;-10.67,-2.7,;-9.34,-1.93,;-8,-2.7,;-5.33,-2.7,;-4,-1.93,)|

CN([C@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:5.8,wD:2.1,(-1.33,2.69,;,1.92,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;2.67,5,;1.33,4.23,;5.33,5.01,;6.67,4.24,;8,5.01,;6.67,2.7,;,.38,;-1.33,-.39,;-1.33,-1.93,;,-2.7,;1.33,-1.93,;2.67,-2.7,;2.67,-4.24,;4,-1.93,;5.33,-2.7,;6.67,-1.93,;8,-2.7,;8,-4.24,;9.34,-1.93,;9.34,-.39,;10.67,.38,;8,.38,;6.67,-.39,;5.33,.38,;1.33,-.39,;2.67,.38,;-2.67,-2.7,;-2.67,-4.24,;-4,-5.01,;-5.33,-4.24,;-6.67,-5.01,;-8,-4.24,;-9.34,-5.01,;-10.67,-4.24,;-10.67,-2.7,;-9.34,-1.93,;-8,-2.7,;-5.33,-2.7,;-4,-1.93,)|

CN([C@@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:2.1,5.5,(-1.33,2.69,;,1.93,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;5.33,5,;2.67,5,;1.33,4.23,;,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;8,-4.23,;9.34,-1.93,;9.34,-.38,;10.67,.38,;8,.38,;6.67,-.38,;5.33,.38,;1.33,-.38,;2.67,.38,;-2.67,-2.69,;-2.67,-4.23,;-4,-5,;-5.33,-4.23,;-6.67,-5,;-8,-4.23,;-8,-2.69,;-9.34,-1.93,;-10.67,-2.69,;-10.67,-4.23,;-9.34,-5,;-5.33,-2.69,;-4,-1.93,)|

CN([C@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:5.5,wD:2.1,(-1.33,2.69,;,1.93,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;5.33,5,;2.67,5,;1.33,4.23,;,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;8,-4.23,;9.34,-1.93,;9.34,-.38,;10.67,.38,;8,.38,;6.67,-.38,;5.33,.38,;1.33,-.38,;2.67,.38,;-2.67,-2.69,;-2.67,-4.23,;-4,-5,;-5.33,-4.23,;-6.67,-5,;-8,-4.23,;-8,-2.69,;-9.34,-1.93,;-10.67,-2.69,;-10.67,-4.23,;-9.34,-5,;-5.33,-2.69,;-4,-1.93,)|

CN(C)Cc1ccc(cc1)-c1cc(N(C)[C@@H]2CC[C@H](N)CC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:15.15,18.19,(-8.67,-2.69,;-8.67,-4.24,;-10,-5.01,;-7.34,-5.01,;-6,-4.24,;-4.67,-5.01,;-3.33,-4.24,;-3.33,-2.69,;-4.67,-1.93,;-6,-2.69,;-2,-1.93,;-2,-.38,;-.67,.38,;-.67,1.93,;-2,2.69,;.67,2.69,;2,1.93,;3.33,2.69,;3.33,4.24,;4.67,5.01,;2,5.01,;.67,4.24,;.67,-.38,;2,.38,;.67,-1.93,;-.67,-2.69,;2,-2.69,;2,-4.24,;3.33,-1.93,;4.67,-2.69,;6,-1.93,;7.34,-2.69,;7.34,-4.24,;8.67,-1.93,;8.67,-.38,;10,.38,;7.34,.38,;6,-.38,;4.67,.38,)|

CN([C@@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1 |r,wU:2.1,5.5,(-1.33,2.69,;,1.93,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;5.33,5,;2.67,5,;1.33,4.23,;,.38,;-1.33,-.38,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;5.33,-2.69,;6.67,-1.93,;8,-2.69,;8,-4.23,;9.34,-1.93,;9.34,-.38,;10.67,.38,;8,.38,;6.67,-.38,;5.33,.38,;1.33,-.38,;2.67,.38,;-2.67,-2.69,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-6.67,-5,;-8,-4.23,;-8,-2.69,;-9.34,-1.93,;-10.67,-2.69,;-10.67,-4.23,;-9.34,-5,;-4,-5,;-2.67,-4.23,)|

CN([C@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1 |r,wU:5.5,wD:2.1,(-1.33,2.69,;,1.92,;1.33,2.69,;2.67,1.93,;4,2.69,;4,4.23,;5.33,5.01,;2.67,5,;1.33,4.23,;,.38,;-1.33,-.39,;-1.33,-1.93,;,-2.7,;1.33,-1.93,;2.67,-2.7,;2.67,-4.24,;4,-1.93,;5.33,-2.7,;6.67,-1.93,;8,-2.7,;8,-4.24,;9.34,-1.93,;9.34,-.39,;10.67,.38,;8,.38,;6.67,-.39,;5.33,.38,;1.33,-.39,;2.67,.38,;-2.67,-2.7,;-4,-1.92,;-5.33,-2.7,;-5.33,-4.24,;-6.67,-5.01,;-8,-4.24,;-9.34,-5.01,;-10.67,-4.24,;-10.67,-2.7,;-9.34,-1.93,;-8,-2.7,;-4,-5.01,;-2.67,-4.24,)|

CN([C@H]1CC[C@H](N)CC1)c1cc(cc(c1)-c1cnn(CCN2CCOCC2)c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:5.5,wD:2.1,(-4,-6.44,;-4,-4.9,;-5.33,-4.13,;-5.33,-2.59,;-6.67,-1.82,;-8,-2.59,;-9.34,-1.82,;-8,-4.13,;-6.67,-4.9,;-2.67,-4.13,;-1.33,-4.9,;,-4.13,;,-2.59,;-1.33,-1.82,;-2.67,-2.59,;-1.33,-.28,;-.09,.62,;-.56,2.09,;-2.1,2.09,;-3.19,3.18,;-4.68,2.78,;-5.77,3.87,;-5.37,5.35,;-6.46,6.44,;-7.95,6.04,;-8.35,4.56,;-7.26,3.47,;-2.58,.62,;1.33,-4.9,;1.33,-6.44,;2.67,-4.13,;4,-4.9,;5.33,-4.13,;6.67,-4.9,;6.67,-6.44,;8,-4.13,;8,-2.59,;9.34,-1.82,;6.67,-1.82,;5.33,-2.59,;4,-1.82,)|

CN(C)Cc1ccc(cn1)-c1cc(N(C)[C@@H]2CC[C@H](N)CC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:15.15,18.19,(-10,-5.01,;-8.67,-4.24,;-8.67,-2.7,;-7.34,-5.01,;-6,-4.24,;-4.67,-5.01,;-3.33,-4.24,;-3.33,-2.7,;-4.67,-1.92,;-6,-2.7,;-2,-1.93,;-2,-.39,;-.67,.38,;-.67,1.92,;-2,2.69,;.67,2.69,;2,1.93,;3.33,2.69,;3.33,4.23,;4.67,5.01,;2,5,;.67,4.23,;.67,-.39,;2,.38,;.67,-1.93,;-.67,-2.7,;2,-2.7,;2,-4.24,;3.33,-1.93,;4.67,-2.7,;6,-1.93,;7.34,-2.7,;7.34,-4.24,;8.67,-1.93,;8.67,-.39,;10,.38,;7.34,.38,;6,-.39,;4.67,.38,)|

CN(C)Cc1ccc(cn1)-c1cc(N(C)[C@H]2CC[C@H](N)CC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:18.19,wD:15.15,(-10,-5.01,;-8.67,-4.24,;-8.67,-2.7,;-7.34,-5.01,;-6,-4.24,;-4.67,-5.01,;-3.33,-4.24,;-3.33,-2.7,;-4.67,-1.92,;-6,-2.7,;-2,-1.93,;-2,-.39,;-.67,.38,;-.67,1.92,;-2,2.69,;.67,2.69,;2,1.93,;3.33,2.69,;3.33,4.23,;4.67,5.01,;2,5,;.67,4.23,;.67,-.39,;2,.38,;.67,-1.93,;-.67,-2.7,;2,-2.7,;2,-4.24,;3.33,-1.93,;4.67,-2.7,;6,-1.93,;7.34,-2.7,;7.34,-4.24,;8.67,-1.93,;8.67,-.39,;10,.38,;7.34,.38,;6,-.39,;4.67,.38,)|

CN([C@H]1CC[C@@H](CC1)NC(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1 |r,wU:5.8,wD:2.1,(-1.33,2.69,;,1.92,;1.33,2.69,;2.67,1.92,;4,2.69,;4,4.23,;2.67,5,;1.33,4.23,;5.33,5,;6.67,4.24,;8,5.01,;6.67,2.7,;,.38,;-1.33,-.39,;-1.33,-1.93,;,-2.7,;1.33,-1.93,;2.67,-2.7,;2.67,-4.24,;4,-1.93,;5.33,-2.7,;6.67,-1.93,;8,-2.7,;8,-4.24,;9.34,-1.93,;9.34,-.39,;10.67,.38,;8,.38,;6.67,-.39,;5.33,.38,;1.33,-.39,;2.67,.38,;-2.67,-2.7,;-4,-1.93,;-5.33,-2.7,;-5.33,-4.24,;-6.67,-5.01,;-8,-4.24,;-8,-2.7,;-9.34,-1.93,;-10.67,-2.7,;-10.67,-4.24,;-9.34,-5.01,;-4,-5.01,;-2.67,-4.24,)|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCB(C)CC2)cc1

CCN([C@H]1CC[C@H](N)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)nc2C)c1C)-c1ccc(CN2CCOCC2)cc1 |r,wU:3.2,wD:6.6,(4.23,-3.33,;3.47,-2,;1.93,-2,;1.15,-3.33,;1.93,-4.67,;1.15,-6,;-.38,-6,;-1.15,-7.34,;-1.16,-4.67,;-.38,-3.33,;1.15,-.67,;-.38,-.67,;-1.15,.67,;-.38,2,;1.15,2,;1.93,3.33,;1.15,4.67,;3.47,3.33,;4.23,4.67,;5.78,4.67,;6.54,6,;5.78,7.34,;8.08,6,;8.85,4.67,;10.39,4.67,;8.08,3.33,;6.54,3.33,;5.78,2,;1.93,.67,;3.47,.67,;-2.69,.67,;-3.47,-.67,;-5,-.67,;-5.78,.67,;-7.31,.67,;-8.08,2,;-7.31,3.33,;-8.08,4.67,;-9.63,4.67,;-10.39,3.33,;-9.63,2,;-5,2,;-3.47,2,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCC2=C(C)C=C(C)NC2C)c1C)-c1cncnc1 |r,wU:3.2,wD:6.9,c:22,t:25,(-2,6.16,;-.67,5.39,;-.67,3.85,;-2,3.08,;-2,1.54,;-3.33,.77,;-4.67,1.54,;-4.67,3.08,;-3.33,3.85,;-6,.77,;-7.34,1.54,;-6,-.77,;.67,3.08,;2,3.85,;3.33,3.08,;3.33,1.54,;2,.77,;2,-.77,;3.33,-1.54,;.67,-1.54,;.67,-3.08,;-.67,-3.85,;-.67,-5.39,;.67,-6.16,;-2,-6.16,;-3.33,-5.39,;-4.67,-6.16,;-3.33,-3.85,;-2,-3.08,;-2,-1.54,;.67,1.54,;-.67,.77,;4.67,3.85,;6,3.08,;7.34,3.85,;7.34,5.39,;6,6.16,;4.67,5.39,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCC(CC1)N1CC(C1)OC(F)F |(-6.63,-5.38,;-6.63,-3.84,;-7.97,-3.07,;-9.3,-3.84,;-10.63,-3.07,;-11.97,-3.84,;-10.63,-1.53,;-9.3,-.76,;-9.3,.78,;-7.97,-1.53,;-6.63,-.76,;-5.3,-1.53,;-3.96,-.76,;-3.96,.78,;-2.63,-1.53,;-2.63,-3.07,;-1.3,-3.84,;-1.3,-5.38,;.04,-3.07,;1.5,-3.54,;2.41,-2.3,;3.49,-3.39,;1.5,-1.05,;.04,-1.53,;-1.3,-.76,;-1.3,.78,;3.49,-1.21,;4.98,-1.61,;6.07,-.52,;5.67,.97,;4.19,1.37,;3.1,.28,;6.76,2.06,;8.3,2.06,;8.3,3.6,;6.76,3.6,;9.39,4.69,;10.88,4.29,;11.97,5.38,;11.28,2.8,)|

CSc1cc(Cl)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCC(CC1)N1CC(C1)OC(F)F |(-6.63,-5.38,;-6.63,-3.84,;-7.97,-3.07,;-9.3,-3.84,;-10.63,-3.07,;-11.97,-3.84,;-10.63,-1.53,;-9.3,-.76,;-9.3,.78,;-7.97,-1.53,;-6.63,-.76,;-5.3,-1.53,;-3.96,-.76,;-3.96,.78,;-2.63,-1.53,;-2.63,-3.07,;-1.3,-3.84,;-1.3,-5.38,;.04,-3.07,;1.5,-3.54,;2.41,-2.3,;3.49,-3.39,;1.5,-1.05,;.04,-1.53,;-1.3,-.76,;-1.3,.78,;3.49,-1.21,;4.98,-1.61,;6.07,-.52,;5.67,.97,;4.19,1.37,;3.1,.28,;6.76,2.06,;8.3,2.06,;8.3,3.6,;6.76,3.6,;9.39,4.69,;10.88,4.29,;11.28,2.8,;11.97,5.38,)|

CSc1cc(Cl)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2O[C@@](C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N(C)C |r,wU:29.35,wD:20.21,26.29,(-4.77,-4.46,;-4.77,-2.92,;-6.11,-2.15,;-7.44,-2.92,;-8.77,-2.15,;-10.11,-2.92,;-8.77,-.61,;-7.44,.16,;-7.44,1.7,;-6.11,-.61,;-4.77,.16,;-3.44,-.61,;-2.11,.16,;-2.11,1.7,;-.77,-.61,;-.77,-2.15,;.56,-2.92,;.56,-4.46,;1.9,-2.15,;3.36,-2.63,;4.26,-1.38,;5.35,-2.47,;3.36,-.14,;1.9,-.61,;.56,.16,;.56,1.7,;5.35,-.29,;6.84,-.69,;7.93,.4,;7.53,1.89,;6.04,2.28,;4.96,1.19,;8.62,2.97,;10.11,2.58,;8.22,4.46,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2O[C@@](C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N(C)C |r,wU:29.35,wD:20.21,26.29,(-4.77,-4.46,;-4.77,-2.92,;-6.11,-2.15,;-7.44,-2.92,;-8.77,-2.15,;-10.11,-2.92,;-8.77,-.61,;-7.44,.16,;-7.44,1.7,;-6.11,-.61,;-4.77,.16,;-3.44,-.61,;-2.11,.16,;-2.11,1.7,;-.77,-.61,;-.77,-2.15,;.56,-2.92,;.56,-4.46,;1.9,-2.15,;3.36,-2.63,;4.26,-1.38,;5.35,-2.47,;3.36,-.14,;1.9,-.61,;.56,.16,;.56,1.7,;5.35,-.29,;6.84,-.69,;7.93,.4,;7.53,1.89,;6.04,2.28,;4.96,1.19,;8.62,2.97,;10.11,2.58,;8.22,4.46,)|

CSc1nc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2O[C@@](C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N(C)C |r,wU:29.35,wD:20.21,26.29,(-4.77,-4.46,;-4.77,-2.92,;-6.11,-2.15,;-7.44,-2.92,;-8.77,-2.15,;-10.11,-2.92,;-8.77,-.61,;-7.44,.16,;-7.44,1.7,;-6.11,-.61,;-4.77,.16,;-3.44,-.61,;-2.11,.16,;-2.11,1.7,;-.77,-.61,;-.77,-2.15,;.56,-2.92,;.56,-4.46,;1.9,-2.15,;3.36,-2.63,;4.26,-1.38,;5.35,-2.47,;3.36,-.14,;1.9,-.61,;.56,.16,;.56,1.7,;5.35,-.29,;6.84,-.69,;7.93,.4,;7.53,1.89,;6.04,2.28,;4.96,1.19,;8.62,2.97,;10.11,2.58,;8.22,4.46,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCC(CC1)NC1(COC1)C(F)(F)F |(8.89,-3.03,;10.22,-2.26,;10.22,-.72,;11.56,.05,;11.56,1.59,;12.89,2.36,;10.22,2.36,;8.89,1.59,;7.55,2.36,;8.89,.05,;7.55,-.72,;6.22,.05,;4.89,-.72,;4.89,-2.26,;3.55,.05,;3.55,1.59,;2.22,2.36,;2.22,3.9,;.89,1.59,;-.58,2.06,;-1.48,.82,;-2.83,1.57,;-.58,-.43,;.89,.05,;2.22,-.72,;2.22,-2.26,;-2.83,.06,;-2.84,-1.48,;-4.18,-2.24,;-5.51,-1.45,;-5.49,.09,;-4.15,.84,;-6.85,-2.21,;-6.87,-3.75,;-6.88,-5.29,;-5.34,-5.3,;-5.33,-3.76,;-8.41,-3.73,;-9.95,-3.72,;-8.39,-2.19,;-8.42,-5.27,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCC(CC1)N1CC(F)(F)C1 |(-5.54,-5.23,;-5.54,-3.69,;-6.88,-2.92,;-8.21,-3.69,;-9.54,-2.92,;-10.88,-3.69,;-9.54,-1.38,;-8.21,-.61,;-8.21,.93,;-6.88,-1.38,;-5.54,-.61,;-4.21,-1.38,;-2.88,-.61,;-2.88,.93,;-1.54,-1.38,;-1.54,-2.92,;-.21,-3.69,;-.21,-5.23,;1.13,-2.92,;2.59,-3.4,;3.49,-2.15,;4.58,-3.24,;2.59,-.91,;1.13,-1.38,;-.21,-.61,;-.21,.93,;4.58,-1.06,;6.07,-1.46,;7.16,-.37,;6.76,1.12,;5.27,1.51,;4.19,.42,;7.85,2.2,;9.39,2.2,;9.39,3.74,;9.79,5.23,;10.88,4.14,;7.85,3.74,)|

Cc1cc(Cl)c(CNC(=O)c2cc(Cl)c3OC(C)(Oc3c2C)C2CCC(CC2)N2CC(C2)OC2CC2)c(=O)[nH]1 |(-12.17,-3.49,;-10.83,-2.72,;-9.5,-3.49,;-8.17,-2.72,;-6.83,-3.49,;-8.17,-1.18,;-6.83,-.41,;-5.5,-1.18,;-4.16,-.41,;-4.16,1.13,;-2.83,-1.18,;-2.83,-2.72,;-1.5,-3.49,;-1.5,-5.03,;-.16,-2.72,;1.3,-3.2,;2.21,-1.95,;3.3,-3.04,;1.3,-.71,;-.16,-1.18,;-1.5,-.41,;-1.5,1.13,;3.3,-.86,;4.78,-1.26,;5.87,-.17,;5.47,1.31,;3.99,1.71,;2.9,.62,;6.56,2.4,;8.1,2.4,;8.1,3.94,;6.56,3.94,;9.19,5.03,;10.68,4.63,;11.77,3.54,;12.17,5.03,;-9.5,-.41,;-9.5,1.13,;-10.83,-1.18,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCC(CC1)N1CC(C1)OC1CC1 |(-6.83,-5.03,;-6.83,-3.49,;-8.17,-2.72,;-9.5,-3.49,;-10.83,-2.72,;-12.17,-3.49,;-10.83,-1.18,;-9.5,-.41,;-9.5,1.13,;-8.17,-1.18,;-6.83,-.41,;-5.5,-1.18,;-4.16,-.41,;-4.16,1.13,;-2.83,-1.18,;-2.83,-2.72,;-1.5,-3.49,;-1.5,-5.03,;-.16,-2.72,;1.3,-3.2,;2.21,-1.95,;3.3,-3.04,;1.3,-.71,;-.16,-1.18,;-1.5,-.41,;-1.5,1.13,;3.3,-.86,;4.78,-1.26,;5.87,-.17,;5.47,1.31,;3.99,1.71,;2.9,.62,;6.56,2.4,;8.1,2.4,;8.1,3.94,;6.56,3.94,;9.19,5.03,;10.68,4.63,;11.77,3.54,;12.17,5.03,)|

CSc1nc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCC(CC1)N1CC(C1)OC(F)F |(-6.63,-5.38,;-6.63,-3.84,;-7.97,-3.07,;-9.3,-3.84,;-10.63,-3.07,;-11.97,-3.84,;-10.63,-1.53,;-9.3,-.76,;-9.3,.78,;-7.97,-1.53,;-6.63,-.76,;-5.3,-1.53,;-3.96,-.76,;-3.96,.78,;-2.63,-1.53,;-2.63,-3.07,;-1.3,-3.84,;-1.3,-5.38,;.04,-3.07,;1.5,-3.54,;2.41,-2.3,;3.49,-3.39,;1.5,-1.05,;.04,-1.53,;-1.3,-.76,;-1.3,.78,;3.49,-1.21,;4.98,-1.61,;6.07,-.52,;5.67,.97,;4.19,1.37,;3.1,.28,;6.76,2.06,;8.3,2.06,;8.3,3.6,;6.76,3.6,;9.39,4.69,;10.88,4.29,;11.97,5.38,;11.28,2.8,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCC(CC1)NC1(CF)COC1 |(-6.06,-4.06,;-6.06,-2.52,;-7.4,-1.75,;-8.73,-2.52,;-10.06,-1.75,;-11.4,-2.52,;-10.06,-.21,;-8.73,.56,;-8.73,2.1,;-7.4,-.21,;-6.06,.56,;-4.73,-.21,;-3.39,.56,;-3.39,2.1,;-2.06,-.21,;-2.06,-1.75,;-.73,-2.52,;-.73,-4.06,;.61,-1.75,;2.07,-2.23,;2.98,-.98,;4.07,-2.07,;2.07,.26,;.61,-.21,;-.73,.56,;-.73,2.1,;4.07,.11,;5.55,-.29,;6.64,.8,;6.24,2.28,;4.76,2.68,;3.67,1.59,;7.33,3.37,;8.82,2.97,;9.91,4.06,;11.4,3.66,;8.05,1.64,;9.38,.87,;10.15,2.2,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCC(CC1)N1CC(F)C1 |(-5.34,-5.03,;-5.34,-3.49,;-6.68,-2.72,;-8.01,-3.49,;-9.35,-2.72,;-10.68,-3.49,;-9.35,-1.18,;-8.01,-.41,;-8.01,1.13,;-6.68,-1.18,;-5.34,-.41,;-4.01,-1.18,;-2.68,-.41,;-2.68,1.13,;-1.34,-1.18,;-1.34,-2.72,;-.01,-3.49,;-.01,-5.03,;1.32,-2.72,;2.79,-3.2,;3.69,-1.95,;4.78,-3.04,;2.79,-.71,;1.32,-1.18,;-.01,-.41,;-.01,1.13,;4.78,-.86,;6.27,-1.26,;7.36,-.17,;6.96,1.31,;5.47,1.71,;4.38,.62,;8.05,2.4,;9.59,2.4,;9.59,3.94,;10.68,5.03,;8.05,3.94,)|

Cc1cc(Cl)c(CNC(=O)c2cc(Cl)c3OC(C)(Oc3c2C)C2CCC(CC2)N2CC(C2)OC(F)F)c(=O)[nH]1 |(-11.97,-3.84,;-10.63,-3.07,;-9.3,-3.84,;-7.97,-3.07,;-6.63,-3.84,;-7.97,-1.53,;-6.63,-.76,;-5.3,-1.53,;-3.96,-.76,;-3.96,.78,;-2.63,-1.53,;-2.63,-3.07,;-1.3,-3.84,;-1.3,-5.38,;.04,-3.07,;1.5,-3.54,;2.41,-2.3,;3.49,-3.39,;1.5,-1.05,;.04,-1.53,;-1.3,-.76,;-1.3,.78,;3.49,-1.21,;4.98,-1.61,;6.07,-.52,;5.67,.97,;4.19,1.37,;3.1,.28,;6.76,2.06,;8.3,2.06,;8.3,3.6,;6.76,3.6,;9.39,4.69,;10.88,4.29,;11.97,5.38,;11.28,2.8,;-9.3,-.76,;-9.3,.78,;-10.63,-1.53,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC(F)(F)F)CC1

Cc1cc(Cl)c(CNC(=O)c2cc(Cl)c3OC(C)(Oc3c2C)C2CCN(CC(F)(F)F)CC2)c(=O)[nH]1

COC1CN(C1)C1CCC(CC1)C1(C)Oc2c(O1)c(C)c(cc2Cl)C(=O)NCc1c(SC)cc(C)[nH]c1=O |(11.42,4.63,;9.94,5.03,;8.85,3.94,;8.85,2.4,;7.31,2.4,;7.31,3.94,;6.22,1.31,;6.62,-.17,;5.53,-1.26,;4.04,-.86,;3.64,.62,;4.73,1.71,;2.95,-1.95,;4.04,-3.04,;2.05,-3.2,;.58,-2.72,;.58,-1.18,;2.05,-.71,;-.75,-.41,;-.75,1.13,;-2.09,-1.18,;-2.09,-2.72,;-.75,-3.49,;-.75,-5.03,;-3.42,-.41,;-3.42,1.13,;-4.75,-1.18,;-6.09,-.41,;-7.42,-1.18,;-7.42,-2.72,;-6.09,-3.49,;-6.09,-5.03,;-8.76,-3.49,;-10.09,-2.72,;-11.42,-3.49,;-10.09,-1.18,;-8.76,-.41,;-8.76,1.13,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@@H]2CC[C@@H](CC2)NC2(C)COC2)c2ccccc12 |r,wD:18.19,20.26,23.27,(-3.81,-26.05,;-3.81,-24.51,;-5.14,-23.74,;-6.48,-24.51,;-7.81,-23.74,;-9.14,-24.51,;-7.81,-22.2,;-6.48,-21.43,;-6.48,-19.89,;-5.14,-22.2,;-3.81,-21.43,;-2.49,-22.2,;-1.16,-21.43,;-1.16,-19.89,;.18,-22.2,;1.64,-21.73,;2.12,-20.26,;2.55,-22.97,;4.09,-22.97,;4.86,-21.64,;4.86,-24.31,;6.4,-24.31,;7.17,-25.64,;6.4,-26.98,;4.86,-26.98,;4.09,-25.64,;7.17,-28.31,;8.71,-28.31,;8.71,-26.77,;9.8,-29.4,;10.89,-28.31,;9.8,-27.22,;1.64,-24.22,;1.96,-25.73,;.82,-26.76,;-.65,-26.28,;-.97,-24.78,;.18,-23.74,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CC[C@@H](CC2)NC2(C)COC2)c2ccccc12 |r,wU:20.26,wD:18.19,23.27,(-3.81,-26.05,;-3.81,-24.51,;-5.14,-23.74,;-6.48,-24.51,;-7.81,-23.74,;-9.14,-24.51,;-7.81,-22.2,;-6.48,-21.43,;-6.48,-19.89,;-5.14,-22.2,;-3.81,-21.43,;-2.49,-22.2,;-1.16,-21.43,;-1.16,-19.89,;.18,-22.2,;1.64,-21.73,;2.12,-20.26,;2.55,-22.97,;4.09,-22.97,;4.86,-21.64,;4.86,-24.3,;6.4,-24.3,;7.17,-25.64,;6.4,-26.97,;4.86,-26.97,;4.09,-25.64,;7.17,-28.31,;8.71,-28.31,;8.71,-26.77,;9.8,-29.39,;10.88,-28.31,;9.8,-27.22,;1.64,-24.22,;1.96,-25.72,;.82,-26.75,;-.65,-26.28,;-.97,-24.77,;.18,-23.74,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2COC2)c2ccccc12 |r,wD:20.20,18.19,(-5.18,-1.99,;-5.18,-.44,;-6.61,.44,;-7.88,-.37,;-9.38,.35,;-10.73,-.37,;-9.38,1.81,;-7.99,2.59,;-7.99,4.15,;-6.62,2.01,;-5.18,2.63,;-3.8,1.81,;-2.45,2.59,;-2.45,4.15,;-.99,1.92,;.39,2.48,;.77,4.01,;1.52,1.32,;3.05,1.51,;3.72,2.89,;4.06,.31,;3.43,-1.11,;4.32,-2.27,;5.9,-2.13,;6.53,-.74,;5.63,.46,;6.46,-3.44,;8.44,-3.17,;9.45,-2.05,;10.73,-3.02,;9.75,-4.15,;.66,.05,;1.18,-1.38,;.17,-2.46,;-1.4,-2.16,;-1.85,-.7,;-.84,.35,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2COC2)c2ccccc12 |r,wU:20.20,wD:18.19,(-5.18,-1.99,;-5.18,-.44,;-6.61,.44,;-7.88,-.37,;-9.38,.35,;-10.73,-.37,;-9.38,1.81,;-7.99,2.59,;-7.99,4.15,;-6.62,2.01,;-5.18,2.63,;-3.8,1.81,;-2.45,2.59,;-2.45,4.15,;-.99,1.92,;.39,2.48,;.77,4.01,;1.52,1.32,;3.05,1.51,;3.72,2.89,;4.06,.31,;5.63,.46,;6.53,-.74,;5.9,-2.13,;4.32,-2.27,;3.43,-1.11,;6.46,-3.44,;8.44,-3.17,;9.45,-2.05,;10.73,-3.02,;9.75,-4.15,;.66,.05,;1.18,-1.38,;.17,-2.46,;-1.4,-2.16,;-1.85,-.7,;-.84,.35,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N(C)C2(C)COC2)c2ccccc12 |r,wD:20.20,18.19,(-5.1,-1.7,;-5.1,-.16,;-6.46,.64,;-7.7,-.09,;-9.17,.64,;-10.49,-.09,;-9.18,2.11,;-7.86,2.92,;-7.86,4.46,;-6.43,2.22,;-5.1,2.96,;-3.75,2.11,;-2.43,2.92,;-2.43,4.46,;-.99,2.22,;.36,2.81,;.73,4.35,;1.46,1.6,;3.01,1.82,;3.67,3.21,;3.96,.57,;3.34,-.86,;4.25,-2.04,;5.76,-1.85,;6.38,-.46,;5.5,.75,;6.71,-3.21,;6.09,-4.46,;8.29,-2.92,;8.29,-1.41,;9.28,-1.78,;10.49,-2.81,;9.54,-3.91,;.66,.35,;1.13,-1.16,;.14,-2.22,;-1.4,-1.93,;-1.84,-.46,;-.85,.61,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N(C)C2(C)COC2)c2ccccc12 |r,wU:20.20,wD:18.19,(-5.1,-1.7,;-5.1,-.16,;-6.46,.64,;-7.7,-.09,;-9.17,.64,;-10.49,-.09,;-9.18,2.11,;-7.86,2.92,;-7.86,4.46,;-6.43,2.22,;-5.1,2.96,;-3.75,2.11,;-2.43,2.92,;-2.43,4.46,;-.99,2.22,;.36,2.81,;.73,4.35,;1.46,1.6,;3.01,1.82,;3.67,3.21,;3.96,.57,;5.5,.75,;6.38,-.46,;5.76,-1.85,;4.25,-2.04,;3.34,-.86,;6.71,-3.21,;6.09,-4.46,;8.29,-2.92,;8.29,-1.41,;9.28,-1.78,;10.49,-2.81,;9.54,-3.91,;.66,.35,;1.13,-1.16,;.14,-2.22,;-1.4,-1.93,;-1.84,-.46,;-.85,.61,)|

COC1CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wD:9.13,12.14,(10.41,-4.86,;8.88,-5.38,;7.95,-4.04,;6.45,-3.78,;6.68,-2.36,;8.21,-2.54,;5.71,-1.01,;4.21,-1.16,;3.32,.03,;3.92,1.45,;5.45,1.64,;6.34,.4,;2.95,2.72,;3.62,4.1,;1.45,2.49,;.37,3.69,;.74,5.26,;-.97,3.13,;-2.39,3.84,;-2.39,5.38,;-3.7,3.02,;-5.08,3.84,;-6.38,3.09,;-6.42,1.52,;-5.07,.7,;-5.07,-.84,;-7.65,.78,;-9.1,1.52,;-10.41,.78,;-9.11,3.02,;-7.8,3.84,;-7.8,5.38,;-.86,1.49,;-1.83,.44,;-1.38,-1.09,;.15,-1.35,;1.12,-.3,;.63,1.23,)|

COC1CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:9.13,wD:12.14,(10.41,-4.86,;8.88,-5.38,;7.95,-4.04,;6.45,-3.78,;6.68,-2.36,;8.21,-2.54,;5.71,-1.01,;6.34,.4,;5.45,1.64,;3.92,1.45,;3.32,.03,;4.21,-1.16,;2.95,2.72,;3.62,4.1,;1.45,2.49,;.37,3.69,;.74,5.26,;-.97,3.13,;-2.39,3.84,;-2.39,5.38,;-3.7,3.02,;-5.08,3.84,;-6.38,3.09,;-6.42,1.52,;-5.07,.7,;-5.07,-.84,;-7.65,.78,;-9.1,1.52,;-10.41,.78,;-9.11,3.02,;-7.8,3.84,;-7.8,5.38,;-.86,1.49,;-1.83,.44,;-1.38,-1.09,;.15,-1.35,;1.12,-.3,;.63,1.23,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)NC(C)(C)C)c2ccccc12 |r,wD:20.21,18.19,(-4.64,-1.85,;-4.64,-.31,;-6,.52,;-7.21,-.2,;-8.68,.52,;-9.96,-.2,;-8.69,2.02,;-7.36,2.8,;-7.36,4.34,;-5.97,2.12,;-4.68,2.84,;-3.36,2.02,;-2.04,2.8,;-2.04,4.34,;-.65,2.12,;.67,2.69,;1.03,4.27,;1.75,1.52,;3.28,1.73,;3.89,3.12,;4.18,.48,;3.57,-.98,;4.46,-2.16,;5.96,-2.02,;6.61,-.59,;5.71,.59,;6.89,-3.34,;8.43,-3.13,;9.43,-4.34,;8.89,-1.63,;9.96,-2.84,;.96,.19,;1.46,-1.27,;.46,-2.38,;-1.04,-2.06,;-1.5,-.63,;-.5,.52,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)NC(C)(C)C)c2ccccc12 |r,wU:20.26,wD:18.19,(-4.64,-1.85,;-4.64,-.31,;-6,.52,;-7.21,-.2,;-8.68,.52,;-9.96,-.2,;-8.69,2.02,;-7.36,2.8,;-7.36,4.34,;-5.97,2.12,;-4.68,2.84,;-3.36,2.02,;-2.04,2.8,;-2.04,4.34,;-.65,2.12,;.67,2.69,;1.03,4.27,;1.75,1.52,;3.28,1.73,;3.89,3.12,;4.18,.48,;5.71,.59,;6.61,-.59,;5.96,-2.02,;4.46,-2.16,;3.57,-.98,;6.89,-3.34,;8.43,-3.13,;9.43,-4.34,;8.89,-1.63,;9.96,-2.84,;.96,.19,;1.46,-1.27,;.46,-2.38,;-1.04,-2.06,;-1.5,-.63,;-.5,.52,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)NC2(C)COC2)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@@H](C)C2OCC(CO2)NC2(C)COC2)c2ccccc12 |r,wU:18.19,(-4.81,-1.67,;-4.81,-.13,;-6.13,.69,;-7.35,-.05,;-8.79,.69,;-10.08,-.05,;-8.8,2.2,;-7.51,2.97,;-7.51,4.51,;-6.11,2.23,;-4.82,3.01,;-3.49,2.2,;-2.16,3.01,;-2.16,4.55,;-.76,2.27,;.6,2.86,;.9,4.45,;1.64,1.68,;3.11,1.9,;3.78,3.3,;4.07,.69,;3.44,-.83,;4.33,-2.01,;6,-1.93,;6.48,-.52,;5.58,.72,;6.48,-3.03,;8.31,-2.93,;8.35,-4.55,;8.57,-1.42,;10.08,-1.75,;9.82,-3.19,;.83,.39,;1.31,-1.12,;.35,-2.19,;-1.16,-1.9,;-1.61,-.42,;-.65,.69,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)N(C)C)c2ccccc12 |r,wD:20.21,18.19,(-3.92,-1.65,;-3.92,-.11,;-5.25,.7,;-6.46,-.04,;-7.9,.7,;-9.19,-.04,;-7.91,2.21,;-6.62,2.98,;-6.62,4.52,;-5.22,2.25,;-3.93,3.02,;-2.6,2.21,;-1.28,3.02,;-1.28,4.56,;.12,2.28,;1.48,2.87,;1.78,4.46,;2.52,1.69,;3.99,1.91,;4.65,3.31,;4.95,.7,;4.32,-.81,;5.2,-1.99,;6.74,-1.91,;7.22,-.5,;6.46,.74,;7.66,-3.14,;7.06,-4.56,;9.19,-2.96,;1.71,.4,;2.18,-1.11,;1.23,-2.17,;-.28,-1.88,;-.73,-.37,;.23,.7,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)N(C)C)c2ccccc12 |r,wU:20.26,wD:18.19,(-3.92,-1.65,;-3.92,-.11,;-5.25,.7,;-6.47,-.04,;-7.9,.7,;-9.19,-.04,;-7.91,2.21,;-6.62,2.98,;-6.62,4.52,;-5.22,2.25,;-3.93,3.02,;-2.6,2.21,;-1.28,3.02,;-1.28,4.56,;.12,2.28,;1.48,2.87,;1.78,4.46,;2.52,1.69,;3.99,1.91,;4.65,3.31,;4.95,.7,;6.46,.74,;7.22,-.5,;6.74,-1.91,;5.2,-1.99,;4.32,-.81,;7.66,-3.14,;7.06,-4.56,;9.19,-2.96,;1.71,.4,;2.18,-1.11,;1.23,-2.17,;-.28,-1.88,;-.73,-.37,;.23,.7,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C23CC(C2)(C3)NC2COC2)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C23CC(C2)(C3)N(C)C2COC2)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C23CC(C2)(C3)N(C)CC(F)(F)F)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(C)(C)O)CC2)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCOCC2)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2COC2)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@@H](C)C2COC2)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)N2CCC2(C)C)c2ccccc12 |r,wD:20.21,18.19,(-4.73,-1.5,;-4.73,.04,;-6.09,.86,;-7.34,.11,;-8.73,.86,;-10.02,.07,;-8.74,2.37,;-7.42,3.15,;-7.42,4.66,;-6.06,2.4,;-4.73,3.19,;-3.41,2.37,;-2.08,3.15,;-2.08,4.69,;-.68,2.44,;.68,3.05,;1.03,4.59,;1.71,1.83,;3.22,2.04,;3.9,3.44,;4.19,.86,;3.54,-.64,;4.28,-1.75,;6.08,-1.71,;6.47,-.35,;5.73,.9,;6.91,-3.01,;6.69,-4.47,;8.2,-4.69,;8.41,-3.15,;8.84,-1.64,;10.02,-3.15,;.93,.54,;1.39,-.93,;.39,-2,;-1.08,-1.68,;-1.51,-.21,;-.54,.9,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)N2CCC2(C)C)c2ccccc12 |r,wU:20.26,wD:18.19,(-4.73,-1.5,;-4.73,.04,;-6.09,.86,;-7.34,.11,;-8.73,.86,;-10.02,.07,;-8.74,2.37,;-7.42,3.15,;-7.42,4.66,;-6.06,2.4,;-4.73,3.19,;-3.41,2.37,;-2.08,3.15,;-2.08,4.69,;-.68,2.44,;.68,3.05,;1.03,4.59,;1.72,1.83,;3.22,2.04,;3.9,3.44,;4.19,.86,;5.73,.9,;6.47,-.35,;6.08,-1.71,;4.28,-1.75,;3.54,-.64,;6.91,-3.01,;6.69,-4.47,;8.2,-4.69,;8.41,-3.15,;8.84,-1.65,;10.02,-3.15,;.93,.54,;1.39,-.93,;.39,-2,;-1.08,-1.68,;-1.51,-.21,;-.54,.9,)|

COCCN(C)C1CO[C@@H](OC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wD:9.8,12.13,(11.07,-4.93,;10.13,-3.7,;8.55,-3.74,;7.6,-2.52,;6.07,-2.76,;5.52,-4.14,;5.12,-1.38,;3.62,-1.54,;2.68,-.43,;3.35,1.1,;4.89,1.18,;5.79,.04,;2.4,2.32,;3.07,3.74,;.87,2.09,;-.2,3.31,;.16,4.89,;-1.54,2.72,;-2.95,3.43,;-2.95,4.93,;-4.29,2.6,;-5.63,3.47,;-7.01,2.68,;-7.01,1.14,;-5.67,.28,;-5.67,-1.27,;-8.31,.35,;-9.78,1.14,;-11.07,.32,;-9.77,2.6,;-8.35,3.43,;-8.35,4.93,;-1.42,1.18,;-2.4,.04,;-1.97,-1.46,;-.47,-1.77,;.55,-.63,;.08,.83,)|

COCCN(C)C1CO[C@@H](OC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:9.9,wD:12.13,(11.07,-4.93,;10.13,-3.7,;8.55,-3.74,;7.6,-2.52,;6.07,-2.76,;5.52,-4.14,;5.12,-1.38,;5.79,.04,;4.89,1.18,;3.35,1.1,;2.68,-.43,;3.63,-1.54,;2.4,2.32,;3.07,3.74,;.87,2.09,;-.2,3.31,;.16,4.89,;-1.54,2.72,;-2.96,3.43,;-2.96,4.93,;-4.3,2.6,;-5.63,3.47,;-7.01,2.68,;-7.01,1.14,;-5.67,.28,;-5.67,-1.27,;-8.31,.35,;-9.78,1.14,;-11.07,.32,;-9.77,2.6,;-8.35,3.43,;-8.35,4.93,;-1.42,1.18,;-2.4,.04,;-1.97,-1.46,;-.47,-1.77,;.55,-.63,;.08,.83,)|

CNC1COC(OC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wD:8.9,(9.49,-3.61,;7.48,-3.84,;6.68,-2.59,;5.18,-2.76,;4.24,-1.56,;4.88,-.06,;6.45,.01,;7.35,-1.16,;3.94,1.15,;4.61,2.55,;2.41,.95,;1.34,2.15,;1.7,3.72,;,1.55,;-1.4,2.28,;-1.4,3.82,;-2.74,1.48,;-4.07,2.32,;-5.41,1.52,;-5.43,-.02,;-4.03,-.86,;-4.03,-2.42,;-6.67,-.79,;-8.15,-.02,;-9.49,-.79,;-8.15,1.48,;-6.81,2.28,;-6.81,3.84,;.13,-.06,;-.83,-1.16,;-.4,-2.63,;1.1,-2.96,;2.1,-1.86,;1.6,-.36,)|

COC1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wD:5.8,8.9,(9.28,-3.6,;7.71,-3.86,;6.76,-2.5,;5.29,-2.69,;4.38,-1.48,;4.97,-.06,;6.5,.13,;7.38,-1.12,;4.02,1.19,;4.67,2.61,;2.52,.97,;1.46,2.17,;1.82,3.74,;.11,1.59,;-1.28,2.32,;-1.28,3.82,;-2.6,1.51,;-3.95,2.32,;-5.26,1.55,;-5.29,.02,;-3.94,-.82,;-3.94,-2.36,;-6.5,-.71,;-7.96,.02,;-9.28,-.71,;-7.97,1.51,;-6.65,2.32,;-6.65,3.86,;.25,-.02,;-.73,-1.08,;-.3,-2.58,;1.24,-2.87,;2.19,-1.81,;1.71,-.31,)|

COC1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:5.8,wD:8.9,(9.28,-3.6,;7.71,-3.86,;6.76,-2.5,;7.38,-1.12,;6.5,.13,;4.97,-.06,;4.38,-1.48,;5.3,-2.69,;4.02,1.19,;4.67,2.61,;2.52,.97,;1.46,2.17,;1.82,3.74,;.11,1.59,;-1.28,2.32,;-1.28,3.82,;-2.6,1.52,;-3.95,2.32,;-5.27,1.55,;-5.3,.02,;-3.94,-.82,;-3.94,-2.36,;-6.5,-.71,;-7.96,.02,;-9.28,-.71,;-7.97,1.52,;-6.66,2.32,;-6.66,3.86,;.25,-.02,;-.73,-1.08,;-.3,-2.58,;1.24,-2.87,;2.19,-1.81,;1.71,-.31,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(O)CC2)c2ccccc12 |r,wD:20.20,18.19,(-3.19,-2.36,;-3.19,-.82,;-4.51,.02,;-5.76,-.71,;-7.22,.02,;-8.54,-.71,;-7.23,1.49,;-5.91,2.33,;-5.91,3.87,;-4.48,1.56,;-3.19,2.33,;-1.84,1.49,;-.52,2.33,;-.52,3.87,;.92,1.6,;2.31,2.18,;2.6,3.72,;3.34,.97,;4.84,1.19,;5.5,2.59,;5.79,-.05,;5.21,-1.52,;6.12,-2.69,;7.59,-2.51,;8.54,-3.87,;8.21,-1.12,;7.33,.09,;2.53,-.31,;3.01,-1.81,;2.02,-2.88,;.51,-2.58,;.07,-1.08,;1.03,-.02,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(O)CC2)c2ccccc12 |r,wU:20.20,wD:18.19,(-3.19,-2.36,;-3.19,-.82,;-4.51,.02,;-5.76,-.71,;-7.22,.02,;-8.54,-.71,;-7.23,1.49,;-5.91,2.33,;-5.91,3.87,;-4.48,1.56,;-3.19,2.33,;-1.84,1.49,;-.52,2.33,;-.52,3.87,;.92,1.6,;2.31,2.18,;2.6,3.72,;3.34,.97,;4.84,1.19,;5.5,2.59,;5.79,-.05,;7.33,.09,;8.21,-1.12,;7.59,-2.51,;8.54,-3.87,;6.12,-2.69,;5.21,-1.52,;2.53,-.31,;3.01,-1.81,;2.02,-2.88,;.51,-2.58,;.07,-1.08,;1.03,-.02,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC(F)F)c2ccccc12 |r,wD:20.20,18.19,(-5.42,-.33,;-5.42,1.19,;-6.8,2.03,;-8.07,1.27,;-9.5,2.03,;-10.8,1.31,;-9.5,3.49,;-8.15,4.32,;-8.15,5.85,;-6.81,3.57,;-5.46,4.32,;-4.12,3.49,;-2.81,4.32,;-2.81,5.85,;-1.42,3.61,;-.08,4.2,;.28,5.71,;.99,2.98,;2.49,3.21,;3.17,4.6,;3.44,1.99,;2.85,.56,;3.72,-.63,;5.22,-.47,;5.86,.96,;4.99,2.14,;6.13,-1.81,;5.94,-3.24,;7.44,-3.48,;7.68,-1.97,;8.35,-4.78,;9.89,-4.5,;10.8,-5.85,;10.53,-3.24,;.2,1.75,;.67,.24,;-.32,-.82,;-1.82,-.51,;-2.26,.96,;-1.27,2.03,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC(F)F)c2ccccc12 |r,wU:20.20,wD:18.19,(-5.42,-.33,;-5.42,1.19,;-6.8,2.03,;-8.07,1.27,;-9.5,2.03,;-10.8,1.31,;-9.5,3.49,;-8.15,4.32,;-8.15,5.85,;-6.81,3.57,;-5.46,4.32,;-4.12,3.49,;-2.81,4.32,;-2.81,5.85,;-1.42,3.61,;-.08,4.2,;.28,5.71,;.99,2.98,;2.49,3.21,;3.17,4.6,;3.44,1.99,;4.99,2.14,;5.86,.96,;5.22,-.47,;3.72,-.63,;2.85,.56,;6.13,-1.81,;5.94,-3.24,;7.44,-3.48,;7.68,-1.97,;8.35,-4.78,;9.89,-4.5,;10.8,-5.85,;10.53,-3.24,;.2,1.75,;.67,.24,;-.32,-.82,;-1.82,-.51,;-2.26,.96,;-1.27,2.03,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC(F)(F)F)c2ccccc12 |r,wD:20.20,18.19,(-5.75,-.33,;-5.75,1.2,;-7.1,2.03,;-8.41,1.27,;-9.83,2.03,;-11.14,1.31,;-9.83,3.49,;-8.49,4.32,;-8.49,5.85,;-7.1,3.57,;-5.76,4.32,;-4.45,3.49,;-3.11,4.32,;-3.11,5.79,;-1.72,3.61,;-.38,4.2,;-.02,5.71,;.69,2.98,;2.2,3.21,;2.87,4.6,;3.15,1.99,;2.55,.56,;3.42,-.63,;4.93,-.47,;5.56,.96,;4.69,2.14,;5.84,-1.81,;5.68,-3.24,;7.14,-3.47,;7.38,-1.97,;8.05,-4.78,;9.6,-4.5,;10.51,-5.85,;10.23,-3.24,;11.14,-4.46,;-.14,1.75,;.34,.25,;-.65,-.82,;-2.12,-.51,;-2.55,.96,;-1.6,2.03,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC(F)(F)F)c2ccccc12 |r,wU:20.20,wD:18.19,(-5.75,-.33,;-5.75,1.2,;-7.1,2.03,;-8.41,1.27,;-9.83,2.03,;-11.14,1.31,;-9.83,3.49,;-8.49,4.32,;-8.49,5.85,;-7.1,3.57,;-5.76,4.32,;-4.45,3.49,;-3.11,4.32,;-3.11,5.79,;-1.72,3.61,;-.38,4.2,;-.02,5.71,;.69,2.98,;2.2,3.21,;2.87,4.6,;3.15,1.99,;4.69,2.14,;5.56,.96,;4.93,-.47,;3.42,-.63,;2.55,.56,;5.84,-1.81,;5.68,-3.24,;7.14,-3.47,;7.38,-1.97,;8.05,-4.78,;9.6,-4.5,;10.51,-5.85,;10.23,-3.24,;11.14,-4.46,;-.14,1.75,;.34,.25,;-.65,-.82,;-2.12,-.51,;-2.55,.96,;-1.6,2.03,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(C)(O)CC2)c2ccccc12 |r,wD:20.20,18.19,(-3.47,-2.34,;-3.47,-.8,;-4.82,.04,;-6.02,-.73,;-7.49,.04,;-8.76,-.73,;-7.49,1.5,;-6.18,2.3,;-6.18,3.84,;-4.79,1.57,;-3.47,2.34,;-2.16,1.5,;-.84,2.3,;-.84,3.84,;.54,1.61,;1.93,2.19,;2.26,3.73,;2.95,.99,;4.45,1.21,;5.11,2.59,;5.4,-.04,;4.82,-1.5,;5.7,-2.67,;7.23,-2.48,;8.76,-2.34,;8.11,-3.84,;7.78,-1.1,;6.94,.11,;2.15,-.29,;2.63,-1.79,;1.68,-2.89,;.14,-2.59,;-.3,-1.1,;.69,-0,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(C)(O)CC2)c2ccccc12 |r,wU:20.20,wD:18.19,(-3.47,-2.34,;-3.47,-.8,;-4.82,.04,;-6.02,-.73,;-7.49,.04,;-8.76,-.73,;-7.49,1.5,;-6.18,2.3,;-6.18,3.84,;-4.79,1.57,;-3.47,2.34,;-2.16,1.5,;-.84,2.3,;-.84,3.84,;.54,1.61,;1.93,2.19,;2.26,3.73,;2.95,.99,;4.45,1.21,;5.11,2.59,;5.4,-.04,;6.94,.11,;7.78,-1.1,;7.23,-2.48,;8.76,-2.34,;8.11,-3.84,;5.7,-2.67,;4.82,-1.5,;2.15,-.29,;2.63,-1.79,;1.68,-2.89,;.14,-2.59,;-.3,-1.1,;.69,-0,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(F)(F)C2)c2ccccc12 |r,wD:20.20,18.19,(-4.58,-.81,;-4.58,.74,;-5.92,1.59,;-7.19,.82,;-8.62,1.59,;-9.93,.86,;-8.62,3.06,;-7.31,3.92,;-7.31,5.39,;-5.92,3.15,;-4.58,3.92,;-3.23,3.06,;-1.92,3.88,;-1.92,5.39,;-.53,3.19,;.82,3.76,;1.19,5.35,;1.88,2.53,;3.39,2.78,;4.09,4.21,;4.37,1.51,;3.76,.04,;4.62,-1.1,;6.13,-.94,;6.78,.45,;5.88,1.68,;7.11,-2.33,;6.91,-3.8,;8.42,-4.04,;9.32,-5.39,;9.93,-3.76,;8.62,-2.49,;1.06,1.27,;1.55,-.25,;.57,-1.35,;-.9,-1.02,;-1.35,.49,;-.41,1.59,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(F)(F)C2)c2ccccc12 |r,wU:20.20,wD:18.19,(-4.58,-.81,;-4.58,.74,;-5.92,1.59,;-7.19,.82,;-8.62,1.59,;-9.93,.86,;-8.62,3.06,;-7.31,3.92,;-7.31,5.39,;-5.92,3.15,;-4.58,3.92,;-3.23,3.06,;-1.92,3.88,;-1.92,5.39,;-.53,3.19,;.82,3.76,;1.19,5.35,;1.88,2.53,;3.39,2.78,;4.09,4.21,;4.37,1.51,;5.88,1.67,;6.78,.45,;6.13,-.94,;4.62,-1.1,;3.76,.04,;7.11,-2.33,;6.9,-3.8,;8.42,-4.04,;9.32,-5.39,;9.93,-3.76,;8.62,-2.49,;1.06,1.27,;1.55,-.25,;.57,-1.35,;-.9,-1.02,;-1.35,.49,;-.41,1.59,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(F)C2)c2ccccc12 |r,wD:20.20,18.19,(-4.22,-.81,;-4.22,.73,;-5.59,1.57,;-6.88,.81,;-8.3,1.57,;-9.59,.85,;-8.3,3.03,;-6.96,3.88,;-6.96,5.33,;-5.59,3.11,;-4.26,3.88,;-2.93,3.03,;-1.59,3.84,;-1.59,5.33,;-.18,3.15,;1.15,3.72,;1.51,5.29,;2.2,2.5,;3.7,2.75,;4.38,4.16,;4.66,1.49,;4.06,.04,;4.95,-1.13,;6.44,-.97,;7.09,.44,;6.2,1.65,;7.41,-2.3,;7.21,-3.76,;8.66,-4,;9.59,-5.33,;8.91,-2.46,;1.39,1.25,;1.88,-.24,;.87,-1.33,;-.59,-1.01,;-1.03,.48,;-.06,1.57,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(F)C2)c2ccccc12 |r,wD:18.19,(-4.22,-.81,;-4.22,.73,;-5.59,1.57,;-6.89,.81,;-8.3,1.57,;-9.59,.85,;-8.3,3.03,;-6.97,3.88,;-6.97,5.33,;-5.59,3.11,;-4.26,3.88,;-2.93,3.03,;-1.59,3.84,;-1.59,5.33,;-.18,3.15,;1.15,3.72,;1.51,5.29,;2.2,2.5,;3.7,2.75,;4.38,4.16,;4.66,1.49,;4.06,.04,;4.95,-1.13,;6.44,-.97,;7.09,.44,;6.2,1.65,;7.41,-2.3,;7.21,-3.76,;8.66,-4,;9.59,-5.33,;8.91,-2.46,;1.39,1.25,;1.88,-.24,;.87,-1.33,;-.59,-1.01,;-1.03,.49,;-.06,1.57,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2ncccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2CC2)c2ncccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CC[C@H](CC2)N2CC(C2)OC(F)F)c2ncccc12 |r,wD:18.19,20.21,23.27,(-4.69,-28.73,;-4.69,-27.19,;-6.03,-26.42,;-7.36,-27.19,;-8.69,-26.42,;-10.03,-27.19,;-8.69,-24.88,;-7.36,-24.11,;-7.36,-22.57,;-6.03,-24.88,;-4.69,-24.11,;-3.36,-24.88,;-2.02,-24.11,;-2.02,-22.57,;-.69,-24.88,;.72,-24.26,;1.04,-22.75,;1.75,-25.4,;3.28,-25.24,;3.98,-23.87,;4.05,-26.58,;3.28,-27.91,;4.05,-29.24,;5.59,-29.24,;6.36,-27.91,;5.59,-26.58,;6.36,-30.58,;5.96,-32.06,;7.45,-32.46,;7.85,-30.97,;8.22,-33.8,;9.76,-33.8,;10.53,-35.13,;10.53,-32.46,;.98,-26.74,;1.45,-28.2,;.42,-29.35,;-1.08,-29.03,;-1.56,-27.56,;-.53,-26.42,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC2CC2)c2ncc(F)cc12 |r,wD:18.19,20.21,(4.86,-31.11,;4.46,-29.62,;2.97,-29.23,;1.88,-30.32,;.39,-29.92,;-.69,-31.01,;-0,-28.43,;1.08,-27.34,;.69,-25.85,;2.57,-27.74,;3.66,-26.65,;5.15,-27.05,;6.28,-26.01,;5.95,-24.51,;7.75,-26.47,;8.99,-25.56,;8.98,-24.02,;10.24,-26.45,;11.71,-25.97,;12.09,-24.48,;12.75,-27.1,;12.28,-28.57,;13.32,-29.71,;14.82,-29.38,;15.29,-27.91,;14.25,-26.77,;15.86,-30.51,;15.79,-32.05,;17.33,-32.12,;17.4,-30.58,;18.37,-33.25,;19.88,-32.92,;21.34,-33.39,;21.01,-31.88,;9.78,-27.92,;10.56,-29.25,;9.8,-30.59,;8.26,-30.6,;7.5,-31.94,;7.48,-29.27,;8.24,-27.93,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC2CC2)c2ncc(F)cc12 |r,wU:20.26,wD:18.19,(4.86,-31.11,;4.46,-29.62,;2.97,-29.23,;1.88,-30.32,;.39,-29.92,;-.69,-31.01,;-0,-28.43,;1.08,-27.34,;.69,-25.85,;2.57,-27.74,;3.66,-26.65,;5.15,-27.05,;6.28,-26.01,;5.95,-24.51,;7.75,-26.47,;8.99,-25.56,;8.98,-24.02,;10.24,-26.45,;11.71,-25.97,;12.09,-24.48,;12.75,-27.1,;14.25,-26.77,;15.29,-27.91,;14.82,-29.38,;13.32,-29.71,;12.28,-28.57,;15.86,-30.51,;15.79,-32.05,;17.33,-32.12,;17.4,-30.58,;18.37,-33.25,;19.88,-32.92,;21.34,-33.39,;21.01,-31.88,;9.78,-27.92,;10.56,-29.25,;9.8,-30.59,;8.26,-30.6,;7.5,-31.94,;7.48,-29.27,;8.24,-27.93,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OC(F)F)c2cc(F)ccc12 |r,wD:18.19,(-.88,-10.68,;-.88,-9.14,;-2.21,-8.37,;-3.55,-9.14,;-4.88,-8.37,;-6.21,-9.14,;-4.88,-6.83,;-3.55,-6.06,;-3.55,-4.52,;-2.21,-6.83,;-.88,-6.06,;.46,-6.83,;1.79,-6.06,;1.79,-4.52,;3.12,-6.82,;4.53,-6.2,;4.85,-4.69,;5.56,-7.34,;7.09,-7.18,;7.7,-5.76,;8.03,-8.4,;7.44,-9.82,;8.38,-11.04,;9.91,-10.84,;10.5,-9.42,;9.56,-8.2,;10.84,-12.06,;10.64,-13.59,;12.17,-13.79,;12.37,-12.26,;13.11,-15.01,;14.64,-14.81,;15.57,-16.03,;15.23,-13.39,;4.79,-8.67,;5.27,-10.14,;4.24,-11.28,;4.72,-12.75,;2.74,-10.97,;2.26,-9.5,;3.29,-8.36,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OC2CC2)c2ncccc12 |r,wD:18.19,(-11.53,-33.79,;-11.53,-32.25,;-12.87,-31.48,;-14.2,-32.25,;-15.53,-31.48,;-16.87,-32.25,;-15.53,-29.94,;-14.2,-29.17,;-14.2,-27.63,;-12.87,-29.94,;-11.53,-29.17,;-10.2,-29.94,;-8.87,-29.17,;-8.87,-27.63,;-7.53,-29.94,;-6.12,-29.31,;-5.81,-27.8,;-5.09,-30.45,;-3.56,-30.29,;-2.95,-28.87,;-2.62,-31.51,;-3.21,-32.93,;-2.27,-34.15,;-.75,-33.95,;-.16,-32.53,;-1.1,-31.31,;.19,-35.17,;-.01,-36.7,;1.52,-36.9,;1.72,-35.37,;2.46,-38.12,;3.98,-37.92,;5.42,-38.46,;5.17,-36.94,;-5.86,-31.79,;-5.38,-33.25,;-6.41,-34.4,;-7.92,-34.08,;-8.4,-32.61,;-7.37,-31.47,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)CO)c2ccccc12

COC[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12

CCOC[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@@H](C)c2cnc(C)nc2)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)c2cnc(C)nc2)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(O)CC2)c2ncccc12 |wU:18.19,20.21,(.96,-1.88,;2.45,-2.28,;2.85,-3.76,;4.34,-4.16,;4.73,-5.65,;6.22,-6.05,;3.65,-6.74,;2.16,-6.34,;1.07,-7.43,;1.76,-4.85,;.27,-4.45,;-.13,-2.97,;-1.61,-2.57,;-2.7,-3.66,;-2.09,-1.1,;-1.18,.14,;.36,.14,;-2.09,1.39,;-1.61,2.85,;-.11,3.17,;-2.64,4,;-4.15,3.68,;-5.18,4.82,;-4.71,6.29,;-5.74,7.43,;-3.2,6.61,;-2.17,5.46,;-3.55,.91,;-4.89,1.68,;-6.22,.91,;-6.22,-.63,;-4.89,-1.4,;-3.55,-.63,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(O)CC2)c2ncccc12 |wU:18.19,wD:20.27,(.96,-1.88,;2.45,-2.28,;2.85,-3.76,;4.34,-4.16,;4.73,-5.65,;6.22,-6.05,;3.65,-6.74,;2.16,-6.34,;1.07,-7.43,;1.76,-4.85,;.27,-4.45,;-.13,-2.97,;-1.61,-2.57,;-2.7,-3.66,;-2.09,-1.1,;-1.18,.14,;.36,.14,;-2.09,1.39,;-1.61,2.85,;-.11,3.17,;-2.64,4,;-2.17,5.46,;-3.2,6.61,;-4.71,6.29,;-5.74,7.43,;-5.18,4.82,;-4.15,3.68,;-3.55,.91,;-4.89,1.68,;-6.22,.91,;-6.22,-.63,;-4.89,-1.4,;-3.55,-.63,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCNC[C@@H]2F)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCNC[C@H]2F)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C#N)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(O)CC2)c2nc(C)ccc12 |wU:18.19,(1.63,-1.88,;3.12,-2.28,;3.52,-3.76,;5,-4.16,;5.4,-5.65,;6.89,-6.05,;4.31,-6.74,;2.82,-6.34,;1.74,-7.43,;2.43,-4.85,;.94,-4.45,;.54,-2.97,;-.95,-2.57,;-2.04,-3.66,;-1.42,-1.1,;-.52,.14,;1.02,.14,;-1.42,1.39,;-.95,2.85,;.56,3.17,;-1.98,4,;-3.48,3.68,;-4.51,4.82,;-4.04,6.29,;-5.07,7.43,;-2.53,6.61,;-1.5,5.46,;-2.89,.91,;-4.22,1.68,;-5.56,.91,;-6.89,1.68,;-5.56,-.63,;-4.22,-1.4,;-2.89,-.63,)|

COC1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cncnc12 |wU:8.9,5.4,(-6.73,7.11,;-5.23,7.43,;-4.2,6.29,;-4.67,4.82,;-3.64,3.68,;-2.13,4,;-1.66,5.46,;-2.69,6.61,;-1.1,2.85,;.4,3.17,;-1.58,1.39,;-.67,.14,;.87,.14,;-1.58,-1.1,;-1.1,-2.57,;-2.19,-3.66,;.38,-2.97,;.78,-4.45,;2.27,-4.85,;3.36,-3.76,;2.96,-2.28,;1.47,-1.88,;4.85,-4.16,;5.24,-5.65,;6.73,-6.05,;4.16,-6.74,;2.67,-6.34,;1.58,-7.43,;-3.04,-.63,;-4.38,-1.4,;-5.71,-.63,;-5.71,.91,;-4.38,1.68,;-3.04,.91,)|

COC1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cncnc12 |wU:8.9,wD:5.5,(-6.73,7.11,;-5.23,7.43,;-4.2,6.29,;-2.69,6.61,;-1.66,5.46,;-2.13,4,;-3.64,3.68,;-4.67,4.82,;-1.1,2.85,;.4,3.17,;-1.58,1.39,;-.67,.14,;.87,.14,;-1.58,-1.1,;-1.1,-2.57,;-2.19,-3.66,;.38,-2.97,;.78,-4.45,;2.27,-4.85,;3.36,-3.76,;2.96,-2.28,;1.47,-1.88,;4.85,-4.16,;5.24,-5.65,;6.73,-6.05,;4.16,-6.74,;2.67,-6.34,;1.58,-7.43,;-3.04,-.63,;-4.38,-1.4,;-5.71,-.63,;-5.71,.91,;-4.38,1.68,;-3.04,.91,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCN(C)C[C@@H]2F)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(C)C[C@H]2F)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(O)CC2)c2cc(F)ccc12 |wU:18.19,20.21,(.39,5.89,;1.9,6.21,;2.93,5.07,;4.44,5.39,;5.47,4.24,;6.97,4.56,;4.99,2.78,;3.49,2.46,;3.01,.99,;2.46,3.6,;.95,3.28,;.47,1.82,;-1.03,1.5,;-2.06,2.64,;-1.51,.03,;-.6,-1.21,;.94,-1.21,;-1.51,-2.46,;-1.03,-3.93,;-2.12,-5.01,;.45,-4.32,;1.54,-3.23,;3.03,-3.63,;3.43,-5.12,;4.92,-5.52,;2.34,-6.21,;.85,-5.81,;-2.97,-1.98,;-4.31,-2.75,;-5.64,-1.98,;-6.97,-2.75,;-5.64,-.44,;-4.31,.33,;-2.97,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(O)CC2)c2cc(F)ccc12 |wU:18.19,wD:20.27,(.39,5.89,;1.9,6.21,;2.93,5.07,;4.44,5.39,;5.47,4.24,;6.97,4.56,;4.99,2.78,;3.49,2.46,;3.01,.99,;2.46,3.6,;.95,3.28,;.47,1.82,;-1.03,1.5,;-2.06,2.64,;-1.51,.03,;-.6,-1.21,;.94,-1.21,;-1.51,-2.46,;-1.03,-3.93,;-2.12,-5.01,;.45,-4.32,;.85,-5.81,;2.34,-6.21,;3.43,-5.12,;4.92,-5.52,;3.03,-3.63,;1.54,-3.23,;-2.97,-1.98,;-4.31,-2.75,;-5.64,-1.98,;-6.97,-2.75,;-5.64,-.44,;-4.31,.33,;-2.97,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(F)(F)CC2)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)c2ccc(cc2)N(C)C)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@@H](C)c2ccc(cc2)N(C)C)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2CC2)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CC(C2)NC2COC2)c2ccccc12 |wU:18.19,(-.27,7.22,;1.23,7.54,;2.26,6.4,;3.77,6.72,;4.8,5.57,;6.31,5.9,;4.33,4.11,;2.82,3.79,;2.34,2.33,;1.79,4.93,;.28,4.61,;-.19,3.15,;-1.7,2.83,;-2.73,3.97,;-2.18,1.36,;-1.27,.12,;.27,.12,;-2.18,-1.13,;-1.7,-2.59,;-2.79,-3.68,;-.21,-2.99,;1.12,-2.22,;1.89,-3.55,;.56,-4.32,;3.38,-3.95,;3.78,-5.44,;3.01,-6.77,;4.34,-7.54,;5.11,-6.21,;-3.64,-.65,;-4.97,-1.42,;-6.31,-.65,;-6.31,.89,;-4.97,1.66,;-3.64,.89,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2CC2)c2ncncc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N(C)C)c2ncccc12 |wU:18.19,(1.47,-2.61,;2.96,-3.01,;3.36,-4.5,;4.85,-4.9,;5.24,-6.38,;6.73,-6.78,;4.16,-7.47,;2.67,-7.07,;1.58,-8.16,;2.27,-5.59,;.78,-5.19,;.38,-3.7,;-1.1,-3.3,;-2.19,-4.39,;-1.58,-1.84,;-.67,-.59,;.87,-.59,;-1.58,.66,;-1.1,2.12,;.4,2.44,;-2.13,3.26,;-3.64,2.94,;-4.67,4.09,;-4.2,5.55,;-2.69,5.87,;-1.66,4.73,;-5.23,6.7,;-4.75,8.16,;-6.73,6.38,;-3.04,.18,;-4.38,.95,;-5.71,.18,;-5.71,-1.36,;-4.38,-2.13,;-3.04,-1.36,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CCO)CC2)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(O)CC2)c2ncc(Cl)cc12 |wU:18.19,20.21,(1.63,-1.88,;3.12,-2.28,;3.52,-3.76,;5,-4.16,;5.4,-5.65,;6.89,-6.05,;4.31,-6.74,;2.82,-6.34,;1.74,-7.43,;2.43,-4.85,;.94,-4.45,;.54,-2.97,;-.95,-2.57,;-2.04,-3.66,;-1.42,-1.1,;-.52,.14,;1.02,.14,;-1.42,1.39,;-.95,2.85,;.56,3.17,;-1.98,4,;-3.48,3.68,;-4.51,4.82,;-4.04,6.29,;-5.07,7.43,;-2.53,6.61,;-1.5,5.46,;-2.89,.91,;-4.22,1.68,;-5.56,.91,;-5.56,-.63,;-6.89,-1.4,;-4.22,-1.4,;-2.89,-.63,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(O)CC2)c2ncc(Cl)cc12 |wU:18.19,wD:20.27,(1.63,-1.88,;3.12,-2.28,;3.52,-3.76,;5,-4.16,;5.4,-5.65,;6.89,-6.05,;4.31,-6.74,;2.82,-6.34,;1.74,-7.43,;2.43,-4.85,;.94,-4.45,;.54,-2.97,;-.95,-2.57,;-2.04,-3.66,;-1.42,-1.1,;-.52,.14,;1.02,.14,;-1.42,1.39,;-.95,2.85,;.56,3.17,;-1.98,4,;-1.5,5.46,;-2.53,6.61,;-4.04,6.29,;-5.07,7.43,;-4.51,4.82,;-3.48,3.68,;-2.89,.91,;-4.22,1.68,;-5.56,.91,;-5.56,-.63,;-6.89,-1.4,;-4.22,-1.4,;-2.89,-.63,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CN(CC(F)(F)F)C2)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@@H](C)C2CN(CC(F)(F)F)C2)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCN(C[C@H]2F)C2CC2)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2CC2)c2cc(F)ccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2CC2)c2ncc(F)cc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)F)CC2)c2ncccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)OC(F)F)c2ccccc12 |wU:18.19,20.21,(-.53,5.89,;.97,6.21,;2.01,5.07,;3.51,5.39,;4.54,4.24,;6.05,4.56,;4.07,2.78,;2.56,2.46,;2.08,.99,;1.53,3.6,;.02,3.28,;-.45,1.82,;-1.96,1.5,;-2.99,2.64,;-2.44,.03,;-1.53,-1.21,;.01,-1.21,;-2.44,-2.46,;-1.96,-3.93,;-3.05,-5.01,;-.47,-4.32,;.62,-3.23,;2.1,-3.63,;2.5,-5.12,;1.41,-6.21,;-.07,-5.81,;3.99,-5.52,;5.08,-4.43,;4.68,-2.94,;6.57,-4.83,;-3.9,-1.98,;-5.23,-2.75,;-6.57,-1.98,;-6.57,-.44,;-5.23,.33,;-3.9,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)OC(F)F)c2ccccc12 |wU:18.19,wD:20.26,(-.53,5.89,;.97,6.21,;2.01,5.07,;3.51,5.39,;4.54,4.24,;6.05,4.56,;4.07,2.78,;2.56,2.46,;2.08,.99,;1.53,3.6,;.02,3.28,;-.45,1.82,;-1.96,1.5,;-2.99,2.64,;-2.44,.03,;-1.53,-1.21,;.01,-1.21,;-2.44,-2.46,;-1.96,-3.93,;-3.05,-5.01,;-.47,-4.32,;-.07,-5.81,;1.41,-6.21,;2.5,-5.12,;2.1,-3.63,;.62,-3.23,;3.99,-5.52,;5.08,-4.43,;4.68,-2.94,;6.57,-4.83,;-3.9,-1.98,;-5.23,-2.75,;-6.57,-1.98,;-6.57,-.44,;-5.23,.33,;-3.9,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)NC(C)(C)C)c2ccccc12 |wU:18.19,(.56,.58,;2.07,.9,;2.54,2.37,;4.05,2.69,;4.52,4.15,;6.03,4.47,;3.49,5.3,;1.99,4.98,;.96,6.12,;1.51,3.51,;.01,3.19,;-.47,1.73,;-1.98,1.41,;-3.01,2.55,;-2.45,-.06,;-1.55,-1.3,;-.01,-1.3,;-2.45,-2.55,;-1.98,-4.02,;-3.01,-5.16,;-.47,-4.34,;.56,-3.19,;2.07,-3.51,;2.54,-4.98,;1.51,-6.12,;.01,-5.8,;4.05,-5.3,;5.08,-4.15,;4.6,-2.69,;6.11,-3.01,;6.59,-4.47,;-3.92,-2.07,;-5.25,-2.84,;-6.59,-2.07,;-6.59,-.53,;-5.25,.24,;-3.92,-.53,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2COC2)c2ncccc12 |wU:18.19,wD:20.26,(2.54,-2.14,;4.03,-2.54,;4.42,-4.02,;5.91,-4.42,;6.31,-5.91,;7.8,-6.31,;5.22,-7,;3.73,-6.6,;2.64,-7.69,;3.33,-5.11,;1.85,-4.71,;1.45,-3.23,;-.04,-2.83,;-1.13,-3.92,;-.51,-1.36,;.39,-.12,;1.93,-.12,;-.51,1.13,;-.04,2.59,;1.47,2.91,;-1.07,3.74,;-.59,5.2,;-1.62,6.35,;-3.13,6.03,;-3.61,4.56,;-2.58,3.42,;-4.16,7.17,;-5.67,6.85,;-6.96,7.69,;-7.8,6.4,;-6.51,5.56,;-1.98,.65,;-3.31,1.42,;-4.65,.65,;-4.65,-.89,;-3.31,-1.66,;-1.98,-.89,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2COC2)c2ncccc12 |wU:18.19,20.21,(2.54,-2.14,;4.03,-2.54,;4.42,-4.02,;5.91,-4.42,;6.31,-5.91,;7.8,-6.31,;5.22,-7,;3.73,-6.6,;2.64,-7.69,;3.33,-5.11,;1.85,-4.71,;1.45,-3.23,;-.04,-2.83,;-1.13,-3.92,;-.51,-1.36,;.39,-.12,;1.93,-.12,;-.51,1.13,;-.04,2.59,;1.47,2.91,;-1.07,3.74,;-2.58,3.42,;-3.61,4.56,;-3.13,6.03,;-1.62,6.35,;-.59,5.2,;-4.16,7.17,;-5.67,6.85,;-6.96,7.69,;-7.8,6.4,;-6.51,5.56,;-1.98,.65,;-3.31,1.42,;-4.65,.65,;-4.65,-.89,;-3.31,-1.66,;-1.98,-.89,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)NC2COC2)c2ncncc12 |wU:18.19,(2.54,-2.14,;4.03,-2.54,;4.42,-4.02,;5.91,-4.42,;6.31,-5.91,;7.8,-6.31,;5.22,-7,;3.73,-6.6,;2.64,-7.69,;3.33,-5.11,;1.85,-4.71,;1.45,-3.23,;-.04,-2.83,;-1.13,-3.92,;-.51,-1.36,;.39,-.12,;1.93,-.12,;-.51,1.13,;-.04,2.59,;1.47,2.91,;-1.07,3.74,;-2.58,3.42,;-3.61,4.56,;-3.13,6.03,;-1.62,6.35,;-.59,5.2,;-4.16,7.17,;-5.67,6.85,;-6.96,7.69,;-7.8,6.4,;-6.51,5.56,;-1.98,.65,;-3.31,1.42,;-4.65,.65,;-4.65,-.89,;-3.31,-1.66,;-1.98,-.89,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2CC(F)C2)c2ccccc12 |wU:18.19,(.01,.82,;1.52,1.14,;1.99,2.6,;3.5,2.92,;3.97,4.38,;5.48,4.71,;2.94,5.53,;1.44,5.21,;.41,6.35,;.96,3.74,;-.54,3.42,;-1.02,1.96,;-2.53,1.64,;-3.56,2.78,;-3,.17,;-2.1,-1.07,;-.56,-1.07,;-3,-2.32,;-2.53,-3.78,;-3.56,-4.93,;-1.02,-4.1,;-.54,-5.57,;.96,-5.89,;1.99,-4.74,;1.52,-3.28,;.01,-2.96,;3.5,-5.06,;4.79,-4.22,;5.63,-5.51,;7.13,-5.84,;4.34,-6.35,;-4.47,-1.84,;-5.8,-2.61,;-7.13,-1.84,;-7.13,-.3,;-5.8,.47,;-4.47,-.3,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2CC(F)C2)c2ccccc12 |wU:18.19,(-1.04,6.21,;.47,6.53,;1.5,5.39,;3,5.71,;4.03,4.56,;5.54,4.88,;3.56,3.1,;2.05,2.78,;1.58,1.31,;1.02,3.92,;-.48,3.6,;-.96,2.14,;-2.47,1.82,;-3.5,2.96,;-2.94,.35,;-2.04,-.89,;-.5,-.89,;-2.94,-2.14,;-2.47,-3.6,;-3.56,-4.69,;-.98,-4,;-.58,-5.49,;.91,-5.89,;2,-4.8,;1.6,-3.31,;.11,-2.91,;3.48,-5.2,;4.82,-4.43,;5.59,-5.76,;7.07,-6.16,;4.25,-6.53,;-4.41,-1.66,;-5.74,-2.43,;-7.07,-1.66,;-7.07,-.12,;-5.74,.65,;-4.41,-.12,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(F)C2)c2ncccc12 |wU:18.19,(1.96,-3.26,;3.45,-3.66,;3.85,-5.15,;5.34,-5.54,;5.74,-7.03,;7.22,-7.43,;4.65,-8.12,;3.16,-7.72,;2.07,-8.81,;2.76,-6.24,;1.27,-5.84,;.87,-4.35,;-.61,-3.95,;-1.7,-5.04,;-1.09,-2.49,;-.18,-1.24,;1.36,-1.24,;-1.09,.01,;-.61,1.47,;.89,1.79,;-1.64,2.62,;-3.15,2.3,;-4.18,3.44,;-3.7,4.9,;-2.2,5.22,;-1.17,4.08,;-4.74,6.05,;-6.27,6.13,;-6.19,7.67,;-7.22,8.81,;-4.65,7.59,;-2.55,-.47,;-3.89,.3,;-5.22,-.47,;-5.22,-2.01,;-3.89,-2.78,;-2.55,-2.01,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2CC(F)C2)c2ncccc12 |wU:18.19,(.73,-8.42,;2.23,-8.74,;3.27,-7.59,;4.77,-7.91,;5.8,-6.77,;7.31,-7.09,;5.33,-5.3,;3.82,-4.98,;3.34,-3.52,;2.79,-6.13,;1.28,-5.81,;.81,-4.34,;-.7,-4.02,;-1.73,-5.17,;-1.17,-2.56,;-.27,-1.31,;1.27,-1.31,;-1.17,-.07,;-.7,1.4,;.81,1.72,;-1.73,2.54,;-1.25,4.01,;-2.28,5.15,;-3.79,4.83,;-4.27,3.37,;-3.24,2.22,;-4.82,5.98,;-6.36,6.06,;-6.28,7.59,;-7.31,8.74,;-4.74,7.51,;-2.64,-.54,;-3.97,.23,;-5.31,-.54,;-5.31,-2.08,;-3.97,-2.85,;-2.64,-2.08,)|

COCCOC1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |wU:11.12,8.7,(7.86,-4.14,;6.37,-3.74,;5.28,-4.83,;3.79,-4.43,;2.7,-5.52,;1.22,-5.12,;.82,-3.63,;-.67,-3.23,;-1.76,-4.32,;-1.36,-5.81,;.13,-6.21,;-3.25,-3.93,;-4.34,-5.01,;-3.72,-2.46,;-2.82,-1.21,;-1.28,-1.21,;-3.72,.03,;-3.25,1.5,;-4.28,2.64,;-1.74,1.82,;-1.27,3.28,;.24,3.6,;.72,5.07,;-.31,6.21,;-1.82,5.89,;2.22,5.39,;3.25,4.24,;4.76,4.56,;2.78,2.78,;1.27,2.46,;.8,.99,;-5.19,-.44,;-6.52,.33,;-7.86,-.44,;-7.86,-1.98,;-6.52,-2.75,;-5.19,-1.98,)|

COCCOC1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |wU:11.12,wD:8.8,(7.86,-4.14,;6.37,-3.74,;5.28,-4.83,;3.79,-4.43,;2.7,-5.52,;1.22,-5.12,;.13,-6.21,;-1.36,-5.81,;-1.76,-4.32,;-.67,-3.23,;.82,-3.63,;-3.25,-3.93,;-4.34,-5.01,;-3.72,-2.46,;-2.82,-1.21,;-1.28,-1.21,;-3.72,.03,;-3.25,1.5,;-4.28,2.64,;-1.74,1.82,;-1.27,3.28,;.24,3.6,;.72,5.07,;-.31,6.21,;-1.82,5.89,;2.22,5.39,;3.25,4.24,;4.76,4.56,;2.78,2.78,;1.27,2.46,;.8,.99,;-5.19,-.44,;-6.52,.33,;-7.86,-.44,;-7.86,-1.98,;-6.52,-2.75,;-5.19,-1.98,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(F)C2)c2ncncc12 |wU:18.19,(1.96,-3.26,;3.45,-3.66,;3.85,-5.15,;5.34,-5.54,;5.74,-7.03,;7.22,-7.43,;4.65,-8.12,;3.16,-7.72,;2.07,-8.81,;2.76,-6.24,;1.27,-5.84,;.87,-4.35,;-.61,-3.95,;-1.7,-5.04,;-1.09,-2.49,;-.18,-1.24,;1.36,-1.24,;-1.09,.01,;-.61,1.47,;.89,1.79,;-1.64,2.62,;-3.15,2.3,;-4.18,3.44,;-3.7,4.9,;-2.2,5.22,;-1.17,4.08,;-4.74,6.05,;-6.27,6.13,;-6.19,7.67,;-7.22,8.81,;-4.65,7.59,;-2.55,-.47,;-3.89,.3,;-5.22,-.47,;-5.22,-2.01,;-3.89,-2.78,;-2.55,-2.01,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2CC2)c2ncc(Cl)cc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCN(CC2(F)F)C2CC2)c2ncccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@@H]2CCN(CC2(F)F)C2CC2)c2ncccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCN(C)[C@@H](C2)C(F)(F)F)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CCCC2=O)c2ccccc12 |wU:18.19,(-.49,6.26,;1.02,6.58,;2.05,5.44,;3.56,5.76,;4.59,4.61,;6.09,4.94,;4.11,3.15,;2.6,2.83,;2.13,1.37,;1.57,3.97,;.07,3.65,;-.41,2.19,;-1.92,1.87,;-2.95,3.01,;-2.39,.4,;-1.49,-.84,;.05,-.84,;-2.39,-2.09,;-1.92,-3.55,;-3,-4.64,;-.43,-3.95,;.66,-2.86,;2.15,-3.26,;2.55,-4.75,;1.46,-5.84,;-.03,-5.44,;4.03,-5.15,;4.59,-6.58,;6.12,-6.5,;6.52,-5.02,;5.23,-4.18,;5.23,-2.64,;-3.86,-1.61,;-5.19,-2.38,;-6.52,-1.61,;-6.52,-.07,;-5.19,.7,;-3.86,-.07,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2ncncc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CCOC2=O)c2ccccc12 |wU:18.19,(-.49,6.93,;1.02,7.25,;2.05,6.11,;3.56,6.43,;4.59,5.28,;6.09,5.6,;4.11,3.82,;2.6,3.5,;2.13,2.03,;1.57,4.64,;.07,4.32,;-.41,2.86,;-1.92,2.54,;-2.95,3.68,;-2.39,1.07,;-1.49,-.17,;.05,-.17,;-2.39,-1.42,;-1.92,-2.88,;-3,-3.97,;-.43,-3.28,;.66,-2.19,;2.15,-2.59,;2.55,-4.08,;1.46,-5.17,;-.03,-4.77,;4.03,-4.48,;5.23,-3.51,;6.52,-4.35,;6.12,-5.84,;4.59,-5.92,;3.82,-7.25,;-3.86,-.94,;-5.19,-1.71,;-6.52,-.94,;-6.52,.6,;-5.19,1.37,;-3.86,.6,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CCOCC2)c2ccccc12 |wU:18.19,20.21,(-.73,6.49,;.78,6.81,;1.81,5.66,;3.31,5.98,;4.34,4.84,;5.85,5.16,;3.87,3.37,;2.36,3.05,;1.88,1.59,;1.33,4.2,;-.18,3.88,;-.65,2.41,;-2.16,2.09,;-3.19,3.24,;-2.63,.63,;-1.73,-.62,;-.19,-.62,;-2.63,-1.86,;-2.16,-3.33,;-3.25,-4.42,;-.67,-3.73,;.42,-2.64,;1.91,-3.04,;2.3,-4.52,;1.22,-5.61,;-.27,-5.21,;3.79,-4.92,;4.19,-6.41,;5.68,-6.81,;6.77,-5.72,;6.37,-4.23,;4.88,-3.83,;-4.1,-1.39,;-5.43,-2.16,;-6.77,-1.39,;-6.77,.15,;-5.43,.92,;-4.1,.15,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CCOCC2)c2ccccc12 |wU:18.19,wD:20.26,(-.73,6.49,;.78,6.81,;1.81,5.66,;3.31,5.98,;4.34,4.84,;5.85,5.16,;3.87,3.37,;2.36,3.05,;1.88,1.59,;1.33,4.2,;-.18,3.88,;-.65,2.41,;-2.16,2.09,;-3.19,3.24,;-2.63,.63,;-1.73,-.62,;-.19,-.62,;-2.63,-1.86,;-2.16,-3.33,;-3.25,-4.42,;-.67,-3.73,;-.27,-5.21,;1.22,-5.61,;2.3,-4.52,;1.91,-3.04,;.42,-2.64,;3.79,-4.92,;4.19,-6.41,;5.68,-6.81,;6.77,-5.72,;6.37,-4.23,;4.88,-3.83,;-4.1,-1.39,;-5.43,-2.16,;-6.77,-1.39,;-6.77,.15,;-5.43,.92,;-4.1,.15,)|

COC1CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccnc12 |wU:12.14,9.9,(-7.98,8.49,;-6.47,8.81,;-5.44,7.67,;-5.52,6.13,;-3.98,6.05,;-3.9,7.59,;-2.95,4.9,;-3.43,3.44,;-2.4,2.3,;-.89,2.62,;-.41,4.08,;-1.45,5.22,;.14,1.47,;1.65,1.79,;-.34,.01,;.57,-1.24,;2.11,-1.24,;-.34,-2.49,;.14,-3.95,;-.95,-5.04,;1.63,-4.35,;2.03,-5.84,;3.51,-6.24,;4.6,-5.15,;4.2,-3.66,;2.72,-3.26,;6.09,-5.54,;6.49,-7.03,;7.98,-7.43,;5.4,-8.12,;3.91,-7.72,;2.82,-8.81,;-1.8,-2.01,;-3.13,-2.78,;-4.47,-2.01,;-4.47,-.47,;-3.13,.3,;-1.8,-.47,)|

COC1CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccnc12 |wU:12.14,wD:9.10,(-7.98,8.49,;-6.47,8.81,;-5.44,7.67,;-5.52,6.13,;-3.98,6.05,;-3.9,7.59,;-2.95,4.9,;-1.45,5.22,;-.41,4.08,;-.89,2.62,;-2.4,2.3,;-3.43,3.44,;.14,1.47,;1.65,1.79,;-.34,.01,;.57,-1.24,;2.11,-1.24,;-.34,-2.49,;.14,-3.95,;-.95,-5.04,;1.63,-4.35,;2.03,-5.84,;3.51,-6.24,;4.6,-5.15,;4.2,-3.66,;2.72,-3.26,;6.09,-5.54,;6.49,-7.03,;7.98,-7.43,;5.4,-8.12,;3.91,-7.72,;2.82,-8.81,;-1.8,-2.01,;-3.13,-2.78,;-4.47,-2.01,;-4.47,-.47,;-3.13,.3,;-1.8,-.47,)|

COC1CN(C1)C1CCC(CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cncnc12 |wU:12.14,(-7.98,8.49,;-6.47,8.81,;-5.44,7.67,;-5.52,6.13,;-3.98,6.05,;-3.9,7.59,;-2.95,4.9,;-3.43,3.44,;-2.4,2.3,;-.89,2.62,;-.41,4.08,;-1.45,5.22,;.14,1.47,;1.65,1.79,;-.34,.01,;.57,-1.24,;2.11,-1.24,;-.34,-2.49,;.14,-3.95,;-.95,-5.04,;1.63,-4.35,;2.03,-5.84,;3.51,-6.24,;4.6,-5.15,;4.2,-3.66,;2.72,-3.26,;6.09,-5.54,;6.49,-7.03,;7.98,-7.43,;5.4,-8.12,;3.91,-7.72,;2.82,-8.81,;-1.8,-2.01,;-3.13,-2.78,;-4.47,-2.01,;-4.47,-.47,;-3.13,.3,;-1.8,-.47,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)N2CC(C)(C)C2)c2ccccc12 |wU:18.19,20.26,(-1.04,6.37,;.47,6.69,;1.5,5.55,;3,5.87,;4.03,4.72,;5.54,5.04,;3.56,3.26,;2.05,2.94,;1.58,1.47,;1.02,4.08,;-.48,3.76,;-.96,2.3,;-2.47,1.98,;-3.5,3.12,;-2.94,.51,;-2.04,-.73,;-.5,-.73,;-2.94,-1.98,;-2.47,-3.44,;-3.56,-4.53,;-.98,-3.84,;.11,-2.75,;1.6,-3.15,;2,-4.64,;.91,-5.73,;-.58,-5.33,;3.48,-5.04,;4.82,-4.27,;5.59,-5.6,;7.07,-5.2,;6.68,-6.69,;4.25,-6.37,;-4.41,-1.5,;-5.74,-2.27,;-7.07,-1.5,;-7.07,.04,;-5.74,.81,;-4.41,.04,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)N2CC(C)(C)C2)c2ccccc12 |wU:18.19,wD:20.21,(-1.04,6.37,;.47,6.69,;1.5,5.55,;3,5.87,;4.03,4.72,;5.54,5.04,;3.56,3.26,;2.05,2.94,;1.58,1.47,;1.02,4.08,;-.48,3.76,;-.96,2.3,;-2.47,1.98,;-3.5,3.12,;-2.94,.51,;-2.04,-.73,;-.5,-.73,;-2.94,-1.98,;-2.47,-3.44,;-3.56,-4.53,;-.98,-3.84,;-.58,-5.33,;.91,-5.73,;2,-4.64,;1.6,-3.15,;.11,-2.75,;3.48,-5.04,;4.82,-4.27,;5.59,-5.6,;7.07,-5.2,;6.68,-6.69,;4.25,-6.37,;-4.41,-1.5,;-5.74,-2.27,;-7.07,-1.5,;-7.07,.04,;-5.74,.81,;-4.41,.04,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC[C@@H](F)C2)c2ccccc12 |wU:18.19,20.21,wD:29.31,(-1.21,6.26,;.3,6.58,;1.33,5.44,;2.84,5.76,;3.87,4.61,;5.37,4.94,;3.39,3.15,;1.88,2.83,;1.41,1.37,;.85,3.97,;-.65,3.65,;-1.13,2.19,;-2.63,1.87,;-3.66,3.01,;-3.11,.4,;-2.2,-.84,;-.66,-.84,;-3.11,-2.09,;-2.63,-3.55,;-3.72,-4.64,;-1.15,-3.95,;-.06,-2.86,;1.43,-3.26,;1.83,-4.75,;.74,-5.84,;-.75,-5.44,;3.32,-5.15,;3.87,-6.58,;5.41,-6.5,;5.8,-5.02,;7.24,-4.46,;4.51,-4.18,;-4.57,-1.61,;-5.91,-2.38,;-7.24,-1.61,;-7.24,-.07,;-5.91,.7,;-4.57,-.07,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC[C@@H](F)C2)c2ccccc12 |wU:18.19,wD:20.26,29.31,(-1.21,6.26,;.3,6.58,;1.33,5.44,;2.84,5.76,;3.87,4.61,;5.37,4.94,;3.39,3.15,;1.88,2.83,;1.41,1.37,;.85,3.97,;-.65,3.65,;-1.13,2.19,;-2.63,1.87,;-3.66,3.01,;-3.11,.4,;-2.2,-.84,;-.66,-.84,;-3.11,-2.09,;-2.63,-3.55,;-3.72,-4.64,;-1.15,-3.95,;-.75,-5.44,;.74,-5.84,;1.83,-4.75,;1.43,-3.26,;-.06,-2.86,;3.32,-5.15,;3.87,-6.58,;5.41,-6.5,;5.8,-5.02,;7.24,-4.46,;4.51,-4.18,;-4.57,-1.61,;-5.91,-2.38,;-7.24,-1.61,;-7.24,-.07,;-5.91,.7,;-4.57,-.07,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C)(F)C2)c2ncccc12 |wU:18.19,(2.18,-3.44,;3.67,-3.84,;4.07,-5.33,;5.55,-5.73,;5.95,-7.21,;7.44,-7.61,;4.86,-8.3,;3.38,-7.9,;2.29,-8.99,;2.98,-6.42,;1.49,-6.02,;1.09,-4.53,;-.4,-4.13,;-1.49,-5.22,;-.87,-2.67,;.03,-1.42,;1.57,-1.42,;-.87,-.17,;-.4,1.29,;1.11,1.61,;-1.43,2.43,;-2.93,2.11,;-3.96,3.26,;-3.49,4.72,;-1.98,5.04,;-.95,3.9,;-4.52,5.87,;-6.06,5.95,;-5.98,7.49,;-6.3,8.99,;-7.44,7.96,;-4.44,7.41,;-2.34,-.65,;-3.67,.12,;-5,-.65,;-5,-2.19,;-3.67,-2.96,;-2.34,-2.19,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2CC(F)(F)C2)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(F)C2)c2c(F)cccc12 |wU:18.19,(-1.04,6.21,;.47,6.53,;1.5,5.39,;3,5.71,;4.03,4.56,;5.54,4.88,;3.56,3.1,;2.05,2.78,;1.58,1.31,;1.02,3.92,;-.48,3.6,;-.96,2.14,;-2.47,1.82,;-3.5,2.96,;-2.94,.35,;-2.04,-.89,;-.5,-.89,;-2.94,-2.14,;-2.47,-3.6,;-3.56,-4.69,;-.98,-4,;.11,-2.91,;1.6,-3.31,;2,-4.8,;.91,-5.89,;-.58,-5.49,;3.48,-5.2,;4.82,-4.43,;5.59,-5.76,;7.07,-6.16,;4.25,-6.53,;-4.41,-1.66,;-5.74,-2.43,;-5.74,-3.97,;-7.07,-1.66,;-7.07,-.12,;-5.74,.65,;-4.41,-.12,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(F)C2)c2cc(F)ccc12 |wU:18.19,(.68,.82,;2.18,1.14,;2.66,2.6,;4.17,2.92,;4.64,4.38,;6.15,4.71,;3.61,5.53,;2.1,5.21,;1.07,6.35,;1.63,3.74,;.12,3.42,;-.35,1.96,;-1.86,1.64,;-2.89,2.78,;-2.34,.17,;-1.43,-1.07,;.11,-1.07,;-2.34,-2.32,;-1.86,-3.78,;-2.89,-4.93,;-.35,-4.1,;.68,-2.96,;2.18,-3.28,;2.66,-4.74,;1.63,-5.89,;.12,-5.57,;4.17,-5.06,;5.46,-4.22,;6.3,-5.51,;7.8,-5.84,;5,-6.35,;-3.8,-1.84,;-5.13,-2.61,;-6.47,-1.84,;-7.8,-2.61,;-6.47,-.3,;-5.13,.47,;-3.8,-.3,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(F)C2)c2ncc(F)cc12 |wU:18.19,20.21,(1.96,-3.26,;3.45,-3.66,;3.85,-5.15,;5.34,-5.54,;5.74,-7.03,;7.22,-7.43,;4.65,-8.12,;3.16,-7.72,;2.07,-8.81,;2.76,-6.24,;1.27,-5.84,;.87,-4.35,;-.61,-3.95,;-1.7,-5.04,;-1.09,-2.49,;-.18,-1.24,;1.36,-1.24,;-1.09,.01,;-.61,1.47,;.89,1.79,;-1.64,2.62,;-3.15,2.3,;-4.18,3.44,;-3.7,4.9,;-2.2,5.22,;-1.17,4.08,;-4.74,6.05,;-6.27,6.13,;-6.19,7.67,;-7.22,8.81,;-4.65,7.59,;-2.55,-.47,;-3.89,.3,;-5.22,-.47,;-5.22,-2.01,;-6.55,-2.78,;-3.89,-2.78,;-2.55,-2.01,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(F)C2)c2ncc(F)cc12 |wU:18.19,wD:20.26,(1.96,-3.26,;3.45,-3.66,;3.85,-5.15,;5.34,-5.54,;5.74,-7.03,;7.22,-7.43,;4.65,-8.12,;3.16,-7.72,;2.07,-8.81,;2.76,-6.24,;1.27,-5.84,;.87,-4.35,;-.61,-3.95,;-1.7,-5.04,;-1.09,-2.49,;-.18,-1.24,;1.36,-1.24,;-1.09,.01,;-.61,1.47,;.89,1.79,;-1.64,2.62,;-1.17,4.08,;-2.2,5.22,;-3.7,4.9,;-4.18,3.44,;-3.15,2.3,;-4.74,6.05,;-6.27,6.13,;-6.19,7.67,;-7.22,8.81,;-4.65,7.59,;-2.55,-.47,;-3.89,.3,;-5.22,-.47,;-5.22,-2.01,;-6.55,-2.78,;-3.89,-2.78,;-2.55,-2.01,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)N2CC(F)(F)C2)c2ccccc12 |wU:18.19,20.26,(-1.04,6.37,;.47,6.69,;1.5,5.55,;3,5.87,;4.03,4.72,;5.54,5.04,;3.56,3.26,;2.05,2.94,;1.58,1.47,;1.02,4.08,;-.48,3.76,;-.96,2.3,;-2.47,1.98,;-3.5,3.12,;-2.94,.51,;-2.04,-.73,;-.5,-.73,;-2.94,-1.98,;-2.47,-3.44,;-3.56,-4.53,;-.98,-3.84,;.11,-2.75,;1.6,-3.15,;2,-4.64,;.91,-5.73,;-.58,-5.33,;3.48,-5.04,;4.82,-4.27,;5.59,-5.6,;6.68,-6.69,;7.07,-5.2,;4.25,-6.37,;-4.41,-1.5,;-5.74,-2.27,;-7.07,-1.5,;-7.07,.04,;-5.74,.81,;-4.41,.04,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OCC(CO2)N2CC(F)(F)C2)c2ccccc12 |wU:18.19,wD:20.21,(-1.04,6.37,;.47,6.69,;1.5,5.55,;3,5.87,;4.03,4.72,;5.54,5.04,;3.56,3.26,;2.05,2.94,;1.58,1.47,;1.02,4.08,;-.48,3.76,;-.96,2.3,;-2.47,1.98,;-3.5,3.12,;-2.94,.51,;-2.04,-.73,;-.5,-.73,;-2.94,-1.98,;-2.47,-3.44,;-3.56,-4.53,;-.98,-3.84,;-.58,-5.33,;.91,-5.73,;2,-4.64,;1.6,-3.15,;.11,-2.75,;3.48,-5.04,;4.82,-4.27,;5.59,-5.6,;6.68,-6.69,;7.07,-5.2,;4.25,-6.37,;-4.41,-1.5,;-5.74,-2.27,;-7.07,-1.5,;-7.07,.04,;-5.74,.81,;-4.41,.04,)|

CCSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2cccc(C)c12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CCC(F)(F)F)CC2)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)NCC(F)(F)F)c2ncncc12 |wU:18.19,(2.74,-3.02,;4.23,-3.42,;4.63,-4.91,;6.11,-5.31,;6.51,-6.8,;8,-7.19,;5.42,-7.88,;3.94,-7.49,;2.85,-8.57,;3.54,-6,;2.05,-5.6,;1.65,-4.11,;.16,-3.71,;-.92,-4.8,;-.31,-2.25,;.59,-1,;2.13,-1,;-.31,.24,;.16,1.71,;1.67,2.03,;-.87,2.85,;-2.37,2.53,;-3.4,3.68,;-2.93,5.14,;-1.42,5.46,;-.39,4.32,;-3.96,6.29,;-5.46,5.97,;-6.49,7.11,;-6.02,8.57,;-7.52,8.25,;-8,6.79,;-1.78,-.23,;-3.11,.54,;-4.44,-.23,;-4.44,-1.77,;-3.11,-2.54,;-1.78,-1.77,)|

COC1(C)CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |wU:13.15,10.10,(7.62,-6.29,;6.53,-5.2,;5.04,-5.6,;6.13,-6.69,;4.27,-4.27,;2.94,-5.04,;3.71,-6.37,;1.45,-4.64,;1.05,-3.15,;-.43,-2.75,;-1.52,-3.84,;-1.13,-5.33,;.36,-5.73,;-3.01,-3.44,;-4.1,-4.53,;-3.49,-1.98,;-2.58,-.73,;-1.04,-.73,;-3.49,.51,;-3.01,1.98,;-4.04,3.12,;-1.5,2.3,;-1.03,3.76,;.48,4.08,;.95,5.55,;-.08,6.69,;-1.58,6.37,;2.46,5.87,;3.49,4.72,;5,5.04,;3.01,3.26,;1.51,2.94,;1.03,1.47,;-4.95,.04,;-6.29,.81,;-7.62,.04,;-7.62,-1.5,;-6.29,-2.27,;-4.95,-1.5,)|

COC1(C)CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |wU:13.15,wD:10.11,(7.62,-6.29,;6.53,-5.2,;5.04,-5.6,;6.13,-6.69,;4.27,-4.27,;2.94,-5.04,;3.71,-6.37,;1.45,-4.64,;.36,-5.73,;-1.13,-5.33,;-1.52,-3.84,;-.43,-2.75,;1.05,-3.15,;-3.01,-3.44,;-4.1,-4.53,;-3.49,-1.98,;-2.58,-.73,;-1.04,-.73,;-3.49,.51,;-3.01,1.98,;-4.04,3.12,;-1.5,2.3,;-1.03,3.76,;.48,4.08,;.95,5.55,;-.08,6.69,;-1.58,6.37,;2.46,5.87,;3.49,4.72,;5,5.04,;3.01,3.26,;1.51,2.94,;1.03,1.47,;-4.95,.04,;-6.29,.81,;-7.62,.04,;-7.62,-1.5,;-6.29,-2.27,;-4.95,-1.5,)|

CCOC1CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccnc12 |wU:13.15,10.10,(-8.49,9.22,;-7.46,8.08,;-5.95,8.4,;-4.92,7.25,;-5,5.72,;-3.47,5.64,;-3.39,7.17,;-2.44,4.49,;-2.91,3.03,;-1.88,1.88,;-.38,2.2,;.1,3.67,;-.93,4.81,;.66,1.06,;2.16,1.38,;.18,-.41,;1.08,-1.65,;2.62,-1.65,;.18,-2.9,;.66,-4.36,;-.43,-5.45,;2.14,-4.76,;2.54,-6.25,;4.03,-6.65,;5.12,-5.56,;4.72,-4.07,;3.23,-3.67,;6.61,-5.96,;7,-7.44,;8.49,-7.84,;5.91,-8.53,;4.43,-8.13,;3.34,-9.22,;-1.29,-2.42,;-2.62,-3.19,;-3.95,-2.42,;-3.95,-.88,;-2.62,-.11,;-1.29,-.88,)|

CCOC1CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccnc12 |wU:13.15,wD:10.11,(-8.49,9.22,;-7.46,8.08,;-5.95,8.4,;-4.92,7.25,;-5,5.72,;-3.47,5.64,;-3.39,7.17,;-2.44,4.49,;-.93,4.81,;.1,3.67,;-.38,2.2,;-1.88,1.88,;-2.91,3.03,;.66,1.06,;2.16,1.38,;.18,-.41,;1.08,-1.65,;2.62,-1.65,;.18,-2.9,;.66,-4.36,;-.43,-5.45,;2.14,-4.76,;2.54,-6.25,;4.03,-6.65,;5.12,-5.56,;4.72,-4.07,;3.23,-3.67,;6.61,-5.96,;7,-7.44,;8.49,-7.84,;5.91,-8.53,;4.43,-8.13,;3.34,-9.22,;-1.29,-2.42,;-2.62,-3.19,;-3.95,-2.42,;-3.95,-.88,;-2.62,-.11,;-1.29,-.88,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2cc(F)ccc12

COC1CN(C1)C1CCC(CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SCF)cc(C)[nH]c2=O)c2ccccc12 |wU:12.14,(7.62,-5.48,;6.53,-6.57,;5.04,-6.17,;4.27,-4.84,;2.94,-5.61,;3.71,-6.94,;1.45,-5.21,;1.05,-3.72,;-.43,-3.33,;-1.52,-4.41,;-1.13,-5.9,;.36,-6.3,;-3.01,-4.02,;-4.1,-5.1,;-3.49,-2.55,;-2.58,-1.31,;-1.04,-1.31,;-3.49,-.06,;-3.01,1.41,;-4.04,2.55,;-1.5,1.73,;-1.03,3.19,;.48,3.51,;.95,4.98,;-.08,6.12,;-1.58,5.8,;-2.61,6.94,;2.46,5.3,;3.49,4.15,;5,4.47,;3.01,2.69,;1.51,2.37,;1.03,.9,;-4.95,-.54,;-6.29,.23,;-7.62,-.54,;-7.62,-2.08,;-6.29,-2.85,;-4.95,-2.08,)|

COC1CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cc(F)cnc12 |wU:12.14,9.9,(-7.98,8.49,;-6.47,8.81,;-5.44,7.67,;-5.52,6.13,;-3.98,6.05,;-3.9,7.59,;-2.95,4.9,;-3.43,3.44,;-2.4,2.3,;-.89,2.62,;-.41,4.08,;-1.45,5.22,;.14,1.47,;1.65,1.79,;-.34,.01,;.57,-1.24,;2.11,-1.24,;-.34,-2.49,;.14,-3.95,;-.95,-5.04,;1.63,-4.35,;2.03,-5.84,;3.51,-6.24,;4.6,-5.15,;4.2,-3.66,;2.72,-3.26,;6.09,-5.54,;6.49,-7.03,;7.98,-7.43,;5.4,-8.12,;3.91,-7.72,;2.82,-8.81,;-1.8,-2.01,;-3.13,-2.78,;-4.47,-2.01,;-5.8,-2.78,;-4.47,-.47,;-3.13,.3,;-1.8,-.47,)|

COC1CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cc(F)cnc12 |wU:12.14,wD:9.10,(-7.98,8.49,;-6.47,8.81,;-5.44,7.67,;-5.52,6.13,;-3.98,6.05,;-3.9,7.59,;-2.95,4.9,;-1.45,5.22,;-.41,4.08,;-.89,2.62,;-2.4,2.3,;-3.43,3.44,;.14,1.47,;1.65,1.79,;-.34,.01,;.57,-1.24,;2.11,-1.24,;-.34,-2.49,;.14,-3.95,;-.95,-5.04,;1.63,-4.35,;2.03,-5.84,;3.51,-6.24,;4.6,-5.15,;4.2,-3.66,;2.72,-3.26,;6.09,-5.54,;6.49,-7.03,;7.98,-7.43,;5.4,-8.12,;3.91,-7.72,;2.82,-8.81,;-1.8,-2.01,;-3.13,-2.78,;-4.47,-2.01,;-5.8,-2.78,;-4.47,-.47,;-3.13,.3,;-1.8,-.47,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CCC(F)(F)C2)c2ccccc12 |wU:18.19,(-1.25,6.26,;.26,6.58,;1.29,5.44,;2.79,5.76,;3.83,4.61,;5.33,4.94,;3.35,3.15,;1.84,2.83,;1.37,1.37,;.81,3.97,;-.69,3.65,;-1.17,2.19,;-2.68,1.87,;-3.71,3.01,;-3.15,.4,;-2.25,-.84,;-.71,-.84,;-3.15,-2.09,;-2.68,-3.55,;-3.76,-4.64,;-1.19,-3.95,;-.1,-2.86,;1.39,-3.26,;1.79,-4.75,;.7,-5.84,;-.79,-5.44,;3.27,-5.15,;3.83,-6.58,;5.36,-6.5,;5.76,-5.02,;7.28,-5.26,;6.73,-3.82,;4.47,-4.18,;-4.62,-1.61,;-5.95,-2.38,;-7.28,-1.61,;-7.28,-.07,;-5.95,.7,;-4.62,-.07,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)C(F)F)c2ncccc12 |wU:18.19,(2.72,-3.99,;4.2,-4.39,;4.6,-5.88,;6.09,-6.28,;6.49,-7.76,;7.98,-8.16,;5.4,-8.85,;3.91,-8.45,;2.82,-9.54,;3.51,-6.97,;2.03,-6.57,;1.63,-5.08,;.14,-4.68,;-.95,-5.77,;-.34,-3.22,;.57,-1.97,;2.11,-1.97,;-.34,-.73,;.14,.74,;1.65,1.06,;-.89,1.88,;-2.4,1.56,;-3.43,2.71,;-2.95,4.17,;-1.45,4.49,;-.41,3.35,;-3.98,5.32,;-5.52,5.4,;-5.44,6.93,;-3.9,6.85,;-6.47,8.08,;-5.99,9.54,;-7.98,7.76,;-1.8,-1.2,;-3.13,-.43,;-4.47,-1.2,;-4.47,-2.74,;-3.13,-3.51,;-1.8,-2.74,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2cccc(C#N)c12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(F)C2)c2ncc(Cl)cc12 |wU:18.19,(1.96,-3.26,;3.45,-3.66,;3.85,-5.15,;5.34,-5.54,;5.74,-7.03,;7.22,-7.43,;4.65,-8.12,;3.16,-7.72,;2.07,-8.81,;2.76,-6.24,;1.27,-5.84,;.87,-4.35,;-.61,-3.95,;-1.7,-5.04,;-1.09,-2.49,;-.18,-1.24,;1.36,-1.24,;-1.09,.01,;-.61,1.47,;.89,1.79,;-1.64,2.62,;-3.15,2.3,;-4.18,3.44,;-3.7,4.9,;-2.2,5.22,;-1.17,4.08,;-4.74,6.05,;-6.27,6.13,;-6.19,7.67,;-7.22,8.81,;-4.65,7.59,;-2.55,-.47,;-3.89,.3,;-5.22,-.47,;-5.22,-2.01,;-6.55,-2.78,;-3.89,-2.78,;-2.55,-2.01,)|

COC1CN(C1)C1CCC(CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC3CC3)cc(C)[nH]c2=O)c2ccccc12 |wU:12.14,(7.62,-5.15,;6.53,-6.24,;5.04,-5.84,;4.27,-4.51,;2.94,-5.28,;3.71,-6.61,;1.45,-4.88,;1.05,-3.39,;-.43,-2.99,;-1.52,-4.08,;-1.13,-5.57,;.36,-5.97,;-3.01,-3.68,;-4.1,-4.77,;-3.49,-2.22,;-2.58,-.97,;-1.04,-.97,;-3.49,.27,;-3.01,1.74,;-4.04,2.88,;-1.5,2.06,;-1.03,3.52,;.48,3.84,;.95,5.31,;-.08,6.45,;-1.58,6.13,;-2.73,5.1,;-3.05,6.61,;2.46,5.63,;3.49,4.49,;5,4.81,;3.01,3.02,;1.51,2.7,;1.03,1.24,;-4.95,-.2,;-6.29,.57,;-7.62,-.2,;-7.62,-1.74,;-6.29,-2.51,;-4.95,-1.74,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OC2CC2)c2ccccc12 |wU:18.19,(-1.78,7.51,;-.28,7.83,;.75,6.69,;2.26,7.01,;3.29,5.86,;4.8,6.18,;2.81,4.4,;1.31,4.08,;.83,2.62,;.28,5.22,;-1.23,4.9,;-1.7,3.44,;-3.21,3.12,;-4.24,4.26,;-3.69,1.65,;-2.78,.41,;-1.24,.41,;-3.69,-.84,;-3.21,-2.3,;-4.3,-3.39,;-1.72,-2.7,;-.63,-1.61,;.85,-2.01,;1.25,-3.5,;.16,-4.59,;-1.32,-4.19,;2.74,-3.9,;4.07,-3.13,;4.84,-4.46,;3.51,-5.23,;6.33,-4.86,;6.73,-6.35,;7.82,-7.43,;6.33,-7.83,;-5.15,-.36,;-6.48,-1.13,;-7.82,-.36,;-7.82,1.18,;-6.48,1.95,;-5.15,1.18,)|

COc1cccc2n([C@H](C)C3CCN(CC(F)(F)F)CC3)c(C)c(C(=O)NCc3c(SC)cc(C)[nH]c3=O)c12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC2CC2)c2ncncc12 |wU:18.19,20.21,(3.45,-3.34,;4.94,-3.74,;5.33,-5.22,;6.82,-5.62,;7.22,-7.11,;8.71,-7.51,;6.13,-8.2,;4.64,-7.8,;3.56,-8.89,;4.25,-6.31,;2.76,-5.91,;2.36,-4.43,;.87,-4.03,;-.22,-5.12,;.4,-2.56,;1.3,-1.32,;2.84,-1.32,;.4,-.07,;.87,1.39,;2.38,1.71,;-.16,2.54,;-1.66,2.22,;-2.7,3.36,;-2.22,4.83,;-.71,5.15,;.32,4,;-3.25,5.97,;-4.79,6.05,;-4.71,7.59,;-3.17,7.51,;-5.74,8.73,;-7.24,8.41,;-8.39,7.38,;-8.71,8.89,;-1.07,-.55,;-2.4,.22,;-3.74,-.55,;-3.74,-2.09,;-2.4,-2.86,;-1.07,-2.09,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC2CC2)c2ncncc12 |wU:18.19,wD:20.26,(3.45,-3.34,;4.94,-3.74,;5.33,-5.22,;6.82,-5.62,;7.22,-7.11,;8.71,-7.51,;6.13,-8.2,;4.64,-7.8,;3.56,-8.89,;4.25,-6.31,;2.76,-5.91,;2.36,-4.43,;.87,-4.03,;-.22,-5.12,;.4,-2.56,;1.3,-1.32,;2.84,-1.32,;.4,-.07,;.87,1.39,;2.38,1.71,;-.16,2.54,;.32,4,;-.71,5.15,;-2.22,4.83,;-2.7,3.36,;-1.66,2.22,;-3.25,5.97,;-4.79,6.05,;-4.71,7.59,;-3.17,7.51,;-5.74,8.73,;-7.24,8.41,;-8.39,7.38,;-8.71,8.89,;-1.07,-.55,;-2.4,.22,;-3.74,-.55,;-3.74,-2.09,;-2.4,-2.86,;-1.07,-2.09,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2cccc(Cl)c12

CO[C@@H]1CN(C[C@H]1F)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccnc12 |wU:14.16,11.11,2.1,wD:6.7,(-8.36,6,;-7.27,7.09,;-5.76,6.77,;-5.13,5.36,;-3.6,5.53,;-3.28,7.03,;-4.62,7.8,;-4.78,9.33,;-2.57,4.38,;-3.05,2.92,;-2.02,1.77,;-.51,2.09,;-.04,3.56,;-1.07,4.7,;.52,.95,;2.03,1.27,;.04,-.52,;.95,-1.76,;2.49,-1.76,;.04,-3.01,;.52,-4.47,;-.57,-5.56,;2.01,-4.87,;2.41,-6.36,;3.89,-6.76,;4.98,-5.67,;4.58,-4.18,;3.1,-3.78,;6.47,-6.07,;6.87,-7.55,;8.36,-7.95,;5.78,-8.64,;4.29,-8.25,;3.2,-9.33,;-1.42,-2.53,;-2.75,-3.3,;-4.09,-2.53,;-4.09,-.99,;-2.75,-.22,;-1.42,-.99,)|

CO[C@@H]1CN(C[C@H]1F)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccnc12 |wU:14.16,2.1,wD:11.12,6.7,(-8.36,6,;-7.27,7.09,;-5.76,6.77,;-5.13,5.36,;-3.6,5.53,;-3.28,7.03,;-4.62,7.8,;-4.78,9.33,;-2.57,4.38,;-1.07,4.7,;-.04,3.56,;-.51,2.09,;-2.02,1.77,;-3.05,2.92,;.52,.95,;2.03,1.27,;.04,-.52,;.95,-1.76,;2.49,-1.76,;.04,-3.01,;.52,-4.47,;-.57,-5.56,;2.01,-4.87,;2.41,-6.36,;3.89,-6.76,;4.98,-5.67,;4.58,-4.18,;3.1,-3.78,;6.47,-6.07,;6.87,-7.55,;8.36,-7.95,;5.78,-8.64,;4.29,-8.25,;3.2,-9.33,;-1.42,-2.53,;-2.75,-3.3,;-4.09,-2.53,;-4.09,-.99,;-2.75,-.22,;-1.42,-.99,)|

C[C@H](C1CCN(CC(F)(F)F)CC1)n1c(C)c(C(=O)NCc2c(SC(F)F)cc(C)[nH]c2=O)c2ccccc12

COC1CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cc(Cl)cnc12 |wU:12.14,9.9,(-7.98,8.49,;-6.47,8.81,;-5.44,7.67,;-5.52,6.13,;-3.98,6.05,;-3.9,7.59,;-2.95,4.9,;-3.43,3.44,;-2.4,2.3,;-.89,2.62,;-.41,4.08,;-1.45,5.22,;.14,1.47,;1.65,1.79,;-.34,.01,;.57,-1.24,;2.11,-1.24,;-.34,-2.49,;.14,-3.95,;-.95,-5.04,;1.63,-4.35,;2.03,-5.84,;3.51,-6.24,;4.6,-5.15,;4.2,-3.66,;2.72,-3.26,;6.09,-5.54,;6.49,-7.03,;7.98,-7.43,;5.4,-8.12,;3.91,-7.72,;2.82,-8.81,;-1.8,-2.01,;-3.13,-2.78,;-4.47,-2.01,;-5.8,-2.78,;-4.47,-.47,;-3.13,.3,;-1.8,-.47,)|

COC1CN(C1)C1CC[C@@H](CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cc(Cl)cnc12 |wU:12.14,wD:9.10,(-7.98,8.49,;-6.47,8.81,;-5.44,7.67,;-5.52,6.13,;-3.98,6.05,;-3.9,7.59,;-2.95,4.9,;-1.45,5.22,;-.41,4.08,;-.89,2.62,;-2.4,2.3,;-3.43,3.44,;.14,1.47,;1.65,1.79,;-.34,.01,;.57,-1.24,;2.11,-1.24,;-.34,-2.49,;.14,-3.95,;-.95,-5.04,;1.63,-4.35,;2.03,-5.84,;3.51,-6.24,;4.6,-5.15,;4.2,-3.66,;2.72,-3.26,;6.09,-5.54,;6.49,-7.03,;7.98,-7.43,;5.4,-8.12,;3.91,-7.72,;2.82,-8.81,;-1.8,-2.01,;-3.13,-2.78,;-4.47,-2.01,;-5.8,-2.78,;-4.47,-.47,;-3.13,.3,;-1.8,-.47,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC[C@@H](F)C2)c2ncc(Cl)cc12 |wU:18.19,wD:29.31,(2.55,-3.02,;4.04,-3.42,;4.44,-4.9,;5.92,-5.3,;6.32,-6.79,;7.81,-7.19,;5.23,-7.88,;3.75,-7.48,;2.66,-8.57,;3.35,-5.99,;1.86,-5.59,;1.46,-4.11,;-.03,-3.71,;-1.11,-4.8,;-.5,-2.24,;.4,-1,;1.94,-1,;-.5,.25,;-.03,1.71,;1.48,2.03,;-1.06,2.86,;-2.56,2.54,;-3.59,3.68,;-3.12,5.15,;-1.61,5.47,;-.58,4.32,;-4.15,6.29,;-3.83,7.8,;-5.16,8.57,;-6.3,7.54,;-7.81,7.86,;-5.68,6.13,;-1.97,-.23,;-3.3,.54,;-4.63,-.23,;-4.63,-1.77,;-5.97,-2.54,;-3.3,-2.54,;-1.97,-1.77,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OC(F)F)c2ncncc12 |wU:18.19,(3.23,-3.67,;4.72,-4.07,;5.12,-5.56,;6.61,-5.96,;7,-7.44,;8.49,-7.84,;5.91,-8.53,;4.43,-8.13,;3.34,-9.22,;4.03,-6.65,;2.54,-6.25,;2.14,-4.76,;.66,-4.36,;-.43,-5.45,;.18,-2.9,;1.08,-1.65,;2.62,-1.65,;.18,-.41,;.66,1.06,;2.16,1.38,;-.38,2.2,;-1.88,1.88,;-2.91,3.03,;-2.44,4.49,;-.93,4.81,;.1,3.67,;-3.47,5.64,;-5,5.72,;-4.92,7.25,;-3.39,7.17,;-5.95,8.4,;-7.46,8.08,;-7.94,6.61,;-8.49,9.22,;-1.29,-.88,;-2.62,-.11,;-3.95,-.88,;-3.95,-2.42,;-2.62,-3.19,;-1.29,-2.42,)|

C[C@H](C1CCN(CC(F)(F)F)CC1)n1c(C)c(C(=O)NCc2c(SC3CCC3)cc(C)[nH]c2=O)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)C(F)(F)F)c2ncccc12 |wU:18.19,(2.72,-3.99,;4.2,-4.39,;4.6,-5.88,;6.09,-6.28,;6.49,-7.76,;7.98,-8.16,;5.4,-8.85,;3.91,-8.45,;2.82,-9.54,;3.51,-6.97,;2.03,-6.57,;1.63,-5.08,;.14,-4.68,;-.95,-5.77,;-.34,-3.22,;.57,-1.97,;2.11,-1.97,;-.34,-.73,;.14,.74,;1.65,1.06,;-.89,1.88,;-2.4,1.56,;-3.43,2.71,;-2.95,4.17,;-1.45,4.49,;-.41,3.35,;-3.98,5.32,;-5.52,5.4,;-5.44,6.93,;-3.9,6.85,;-6.47,8.08,;-5.99,9.54,;-7.5,9.22,;-7.98,7.76,;-1.8,-1.2,;-3.13,-.43,;-4.47,-1.2,;-4.47,-2.74,;-3.13,-3.51,;-1.8,-2.74,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CCC(C2)OC2CC2)c2ncccc12 |wU:18.19,(3.36,-4.15,;4.85,-4.55,;5.25,-6.03,;6.74,-6.43,;7.13,-7.92,;8.62,-8.32,;6.04,-9.01,;4.56,-8.61,;3.47,-9.7,;4.16,-7.12,;2.67,-6.72,;2.27,-5.24,;.79,-4.84,;-.3,-5.93,;.31,-3.37,;1.21,-2.13,;2.75,-2.13,;.31,-.88,;.79,.58,;2.29,.9,;-.25,1.73,;-1.75,1.41,;-2.78,2.55,;-2.31,4.02,;-.8,4.34,;.23,3.19,;-3.34,5.16,;-3.02,6.67,;-4.35,7.44,;-5.49,6.41,;-4.87,5,;-7,6.73,;-7.48,8.19,;-8.62,9.22,;-7.16,9.7,;-1.16,-1.36,;-2.49,-.59,;-3.82,-1.36,;-3.82,-2.9,;-2.49,-3.67,;-1.16,-2.9,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC(C)(C)C)c2ncccc12 |wU:18.19,20.21,(3.47,-3.67,;4.96,-4.07,;5.36,-5.56,;6.84,-5.96,;7.24,-7.44,;8.73,-7.84,;6.15,-8.53,;4.67,-8.13,;3.58,-9.22,;4.27,-6.65,;2.78,-6.25,;2.38,-4.76,;.89,-4.36,;-.2,-5.45,;.42,-2.9,;1.32,-1.65,;2.86,-1.65,;.42,-.41,;.89,1.06,;2.4,1.38,;-.14,2.2,;-1.64,1.88,;-2.67,3.03,;-2.2,4.49,;-.69,4.81,;.34,3.67,;-3.23,5.64,;-4.77,5.72,;-4.69,7.25,;-3.15,7.17,;-5.72,8.4,;-7.22,8.08,;-7.7,6.61,;-8.73,7.76,;-8.25,9.22,;-1.05,-.88,;-2.38,-.11,;-3.71,-.88,;-3.71,-2.42,;-2.38,-3.19,;-1.05,-2.42,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC(C)(C)C)c2ncccc12 |wU:18.19,wD:20.26,(3.47,-3.67,;4.96,-4.07,;5.36,-5.56,;6.84,-5.96,;7.24,-7.44,;8.73,-7.84,;6.15,-8.53,;4.67,-8.13,;3.58,-9.22,;4.27,-6.65,;2.78,-6.25,;2.38,-4.76,;.89,-4.36,;-.2,-5.45,;.42,-2.9,;1.32,-1.65,;2.86,-1.65,;.42,-.41,;.89,1.06,;2.4,1.38,;-.14,2.2,;.34,3.67,;-.69,4.81,;-2.2,4.49,;-2.67,3.03,;-1.64,1.88,;-3.23,5.64,;-4.77,5.72,;-4.69,7.25,;-3.15,7.17,;-5.72,8.4,;-7.22,8.08,;-7.7,6.61,;-8.73,7.76,;-8.25,9.22,;-1.05,-.88,;-2.38,-.11,;-3.71,-.88,;-3.71,-2.42,;-2.38,-3.19,;-1.05,-2.42,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC2CC2)c2c(F)cccc12 |wU:18.19,20.21,(-1.78,7.51,;-.28,7.83,;.75,6.69,;2.26,7.01,;3.29,5.86,;4.8,6.18,;2.81,4.4,;1.31,4.08,;.83,2.62,;.28,5.22,;-1.23,4.9,;-1.7,3.44,;-3.21,3.12,;-4.24,4.26,;-3.69,1.65,;-2.78,.41,;-1.24,.41,;-3.69,-.84,;-3.21,-2.3,;-4.3,-3.39,;-1.72,-2.7,;-.63,-1.61,;.85,-2.01,;1.25,-3.5,;.16,-4.59,;-1.32,-4.19,;2.74,-3.9,;4.07,-3.13,;4.84,-4.46,;3.51,-5.23,;6.33,-4.86,;6.73,-6.35,;7.82,-7.43,;6.33,-7.83,;-5.15,-.36,;-6.48,-1.13,;-6.48,-2.67,;-7.82,-.36,;-7.82,1.18,;-6.48,1.95,;-5.15,1.18,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC2CC2)c2c(F)cccc12 |wU:18.19,wD:20.26,(-1.78,7.51,;-.28,7.83,;.75,6.69,;2.26,7.01,;3.29,5.86,;4.8,6.18,;2.81,4.4,;1.31,4.08,;.83,2.62,;.28,5.22,;-1.23,4.9,;-1.7,3.44,;-3.21,3.12,;-4.24,4.26,;-3.69,1.65,;-2.78,.41,;-1.24,.41,;-3.69,-.84,;-3.21,-2.3,;-4.3,-3.39,;-1.72,-2.7,;-1.32,-4.19,;.16,-4.59,;1.25,-3.5,;.85,-2.01,;-.63,-1.61,;2.74,-3.9,;4.07,-3.13,;4.84,-4.46,;3.51,-5.23,;6.33,-4.86,;6.73,-6.35,;7.82,-7.43,;6.33,-7.83,;-5.15,-.36,;-6.48,-1.13,;-6.48,-2.67,;-7.82,-.36,;-7.82,1.18,;-6.48,1.95,;-5.15,1.18,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2cccc(C(F)F)c12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OC(F)F)c2ncc(C)cc12 |wU:18.19,(3.23,-3.67,;4.72,-4.07,;5.12,-5.56,;6.61,-5.96,;7,-7.44,;8.49,-7.84,;5.91,-8.53,;4.43,-8.13,;3.34,-9.22,;4.03,-6.65,;2.54,-6.25,;2.14,-4.76,;.66,-4.36,;-.43,-5.45,;.18,-2.9,;1.08,-1.65,;2.62,-1.65,;.18,-.41,;.66,1.06,;2.16,1.38,;-.38,2.2,;-1.88,1.88,;-2.91,3.03,;-2.44,4.49,;-.93,4.81,;.1,3.67,;-3.47,5.64,;-5,5.72,;-4.92,7.25,;-3.39,7.17,;-5.95,8.4,;-7.46,8.08,;-7.94,6.61,;-8.49,9.22,;-1.29,-.88,;-2.62,-.11,;-3.95,-.88,;-3.95,-2.42,;-5.29,-3.19,;-2.62,-3.19,;-1.29,-2.42,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OCC(F)F)c2ncccc12 |wU:18.19,(3.98,-4.4,;5.47,-4.8,;5.87,-6.29,;7.36,-6.69,;7.76,-8.18,;9.24,-8.58,;6.67,-9.27,;5.18,-8.87,;4.09,-9.96,;4.78,-7.38,;3.29,-6.98,;2.9,-5.49,;1.41,-5.09,;.32,-6.18,;.93,-3.63,;1.84,-2.38,;3.38,-2.38,;.93,-1.14,;1.41,.33,;2.91,.65,;.38,1.47,;-1.13,1.15,;-2.16,2.3,;-1.68,3.76,;-.18,4.08,;.85,2.94,;-2.71,4.9,;-4.25,4.98,;-4.17,6.52,;-2.63,6.44,;-5.2,7.67,;-6.71,7.35,;-7.74,8.49,;-7.26,9.96,;-9.24,8.17,;-.53,-1.61,;-1.87,-.84,;-3.2,-1.61,;-3.2,-3.15,;-1.87,-3.92,;-.53,-3.15,)|

CC[C@@H](C1CCC(CC1)N1CC(C1)OC(F)F)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccnc12 |wD:2.18,(3.19,.23,;2.16,1.38,;.66,1.06,;-.38,2.2,;-1.88,1.88,;-2.91,3.03,;-2.44,4.49,;-.93,4.81,;.1,3.67,;-3.47,5.64,;-5,5.72,;-4.92,7.25,;-3.39,7.17,;-5.95,8.4,;-7.46,8.08,;-7.94,6.61,;-8.49,9.22,;.18,-.41,;1.08,-1.65,;2.62,-1.65,;.18,-2.9,;.66,-4.36,;-.43,-5.45,;2.14,-4.76,;2.54,-6.25,;4.03,-6.65,;5.12,-5.56,;4.72,-4.07,;3.23,-3.67,;6.61,-5.96,;7,-7.44,;8.49,-7.84,;5.91,-8.53,;4.43,-8.13,;3.34,-9.22,;-1.29,-2.42,;-2.62,-3.19,;-3.95,-2.42,;-3.95,-.88,;-2.62,-.11,;-1.29,-.88,)|

CC[C@H](C1CCC(CC1)N1CC(C1)OC(F)F)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccnc12 |wU:2.18,(3.19,.23,;2.16,1.38,;.66,1.06,;-.38,2.2,;-1.88,1.88,;-2.91,3.03,;-2.44,4.49,;-.93,4.81,;.1,3.67,;-3.47,5.64,;-5,5.72,;-4.92,7.25,;-3.39,7.17,;-5.95,8.4,;-7.46,8.08,;-7.94,6.61,;-8.49,9.22,;.18,-.41,;1.08,-1.65,;2.62,-1.65,;.18,-2.9,;.66,-4.36,;-.43,-5.45,;2.14,-4.76,;2.54,-6.25,;4.03,-6.65,;5.12,-5.56,;4.72,-4.07,;3.23,-3.67,;6.61,-5.96,;7,-7.44,;8.49,-7.84,;5.91,-8.53,;4.43,-8.13,;3.34,-9.22,;-1.29,-2.42,;-2.62,-3.19,;-3.95,-2.42,;-3.95,-.88,;-2.62,-.11,;-1.29,-.88,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC[C@H](C2)OC(F)F)c2ncccc12 |wU:18.19,wD:29.33,(3.84,-3.02,;5.33,-3.42,;5.73,-4.9,;7.21,-5.3,;7.61,-6.79,;9.1,-7.19,;6.52,-7.88,;5.04,-7.48,;3.95,-8.57,;4.64,-5.99,;3.15,-5.59,;2.75,-4.11,;1.26,-3.71,;.17,-4.8,;.79,-2.24,;1.69,-1,;3.23,-1,;.79,.25,;1.26,1.71,;2.77,2.03,;.23,2.86,;-1.27,2.54,;-2.3,3.68,;-1.83,5.15,;-.32,5.47,;.71,4.32,;-2.86,6.29,;-2.54,7.8,;-3.87,8.57,;-5.02,7.54,;-4.39,6.13,;-6.52,7.86,;-7.61,6.77,;-7.21,5.28,;-9.1,7.17,;-.68,-.23,;-2.01,.54,;-3.34,-.23,;-3.34,-1.77,;-2.01,-2.54,;-.68,-1.77,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC[C@@H](C2)OC(F)F)c2ncccc12 |wU:18.19,29.33,(3.84,-3.02,;5.33,-3.42,;5.73,-4.9,;7.21,-5.3,;7.61,-6.79,;9.1,-7.19,;6.52,-7.88,;5.04,-7.48,;3.95,-8.57,;4.64,-5.99,;3.15,-5.59,;2.75,-4.11,;1.26,-3.71,;.17,-4.8,;.79,-2.24,;1.69,-1,;3.23,-1,;.79,.25,;1.26,1.71,;2.77,2.03,;.23,2.86,;-1.27,2.54,;-2.3,3.68,;-1.83,5.15,;-.32,5.47,;.71,4.32,;-2.86,6.29,;-2.54,7.8,;-3.87,8.57,;-5.02,7.54,;-4.39,6.13,;-6.52,7.86,;-7.61,6.77,;-7.21,5.28,;-9.1,7.17,;-.68,-.23,;-2.01,.54,;-3.34,-.23,;-3.34,-1.77,;-2.01,-2.54,;-.68,-1.77,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OC(F)F)c2c(F)cccc12 |wU:18.19,(-2.33,6.21,;-.82,6.53,;.21,5.39,;1.72,5.71,;2.75,4.56,;4.25,4.88,;2.27,3.1,;.76,2.78,;.29,1.31,;-.27,3.92,;-1.77,3.6,;-2.25,2.14,;-3.75,1.82,;-4.79,2.96,;-4.23,.35,;-3.33,-.89,;-1.79,-.89,;-4.23,-2.14,;-3.75,-3.6,;-4.84,-4.69,;-2.27,-4,;-1.18,-2.91,;.31,-3.31,;.71,-4.8,;-.38,-5.89,;-1.87,-5.49,;2.2,-5.2,;3.53,-4.43,;4.3,-5.76,;2.97,-6.53,;5.79,-6.16,;6.88,-5.07,;6.48,-3.58,;8.36,-5.47,;-5.7,-1.66,;-7.03,-2.43,;-7.03,-3.97,;-8.36,-1.66,;-8.36,-.12,;-7.03,.65,;-5.7,-.12,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC(F)F)c2c(F)cccc12 |wU:18.19,wD:20.26,(-2.33,6.21,;-.82,6.53,;.21,5.39,;1.72,5.71,;2.75,4.56,;4.25,4.88,;2.27,3.1,;.76,2.78,;.29,1.31,;-.27,3.92,;-1.77,3.6,;-2.25,2.14,;-3.75,1.82,;-4.79,2.96,;-4.23,.35,;-3.33,-.89,;-1.79,-.89,;-4.23,-2.14,;-3.75,-3.6,;-4.84,-4.69,;-2.27,-4,;-1.87,-5.49,;-.38,-5.89,;.71,-4.8,;.31,-3.31,;-1.18,-2.91,;2.2,-5.2,;3.53,-4.43,;4.3,-5.76,;2.97,-6.53,;5.79,-6.16,;6.88,-5.07,;6.48,-3.58,;8.36,-5.47,;-5.7,-1.66,;-7.03,-2.43,;-7.03,-3.97,;-8.36,-1.66,;-8.36,-.12,;-7.03,.65,;-5.7,-.12,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OC(F)F)c2ncc(F)cc12 |wU:18.19,(3.23,-3.67,;4.72,-4.07,;5.12,-5.56,;6.61,-5.96,;7,-7.44,;8.49,-7.84,;5.91,-8.53,;4.43,-8.13,;3.34,-9.22,;4.03,-6.65,;2.54,-6.25,;2.14,-4.76,;.66,-4.36,;-.43,-5.45,;.18,-2.9,;1.08,-1.65,;2.62,-1.65,;.18,-.41,;.66,1.06,;2.16,1.38,;-.38,2.2,;-1.88,1.88,;-2.91,3.03,;-2.44,4.49,;-.93,4.81,;.1,3.67,;-3.47,5.64,;-5,5.72,;-4.92,7.25,;-3.39,7.17,;-5.95,8.4,;-7.46,8.08,;-7.94,6.61,;-8.49,9.22,;-1.29,-.88,;-2.62,-.11,;-3.95,-.88,;-3.95,-2.42,;-5.29,-3.19,;-2.62,-3.19,;-1.29,-2.42,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC(F)(F)F)c2ncncc12 |wU:18.19,20.21,(3.47,-3.67,;4.96,-4.07,;5.36,-5.56,;6.84,-5.96,;7.24,-7.44,;8.73,-7.84,;6.15,-8.53,;4.67,-8.13,;3.58,-9.22,;4.27,-6.65,;2.78,-6.25,;2.38,-4.76,;.89,-4.36,;-.2,-5.45,;.42,-2.9,;1.32,-1.65,;2.86,-1.65,;.42,-.41,;.89,1.06,;2.4,1.38,;-.14,2.2,;-1.64,1.88,;-2.67,3.03,;-2.2,4.49,;-.69,4.81,;.34,3.67,;-3.23,5.64,;-4.77,5.72,;-4.69,7.25,;-3.15,7.17,;-5.72,8.4,;-7.22,8.08,;-8.73,7.76,;-7.7,6.61,;-8.25,9.22,;-1.05,-.88,;-2.38,-.11,;-3.71,-.88,;-3.71,-2.42,;-2.38,-3.19,;-1.05,-2.42,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)OC(F)(F)F)c2ncncc12 |wU:18.19,wD:20.26,(3.47,-3.67,;4.96,-4.07,;5.36,-5.56,;6.84,-5.96,;7.24,-7.44,;8.73,-7.84,;6.15,-8.53,;4.67,-8.13,;3.58,-9.22,;4.27,-6.65,;2.78,-6.25,;2.38,-4.76,;.89,-4.36,;-.2,-5.45,;.42,-2.9,;1.32,-1.65,;2.86,-1.65,;.42,-.41,;.89,1.06,;2.4,1.38,;-.14,2.2,;.34,3.67,;-.69,4.81,;-2.2,4.49,;-2.67,3.03,;-1.64,1.88,;-3.23,5.64,;-4.77,5.72,;-4.69,7.25,;-3.15,7.17,;-5.72,8.4,;-7.22,8.08,;-8.73,7.76,;-7.7,6.61,;-8.25,9.22,;-1.05,-.88,;-2.38,-.11,;-3.71,-.88,;-3.71,-2.42,;-2.38,-3.19,;-1.05,-2.42,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OC2CC2)c2ncc(Cl)cc12 |wU:18.19,(3.45,-3.34,;4.94,-3.74,;5.33,-5.22,;6.82,-5.62,;7.22,-7.11,;8.71,-7.51,;6.13,-8.2,;4.64,-7.8,;3.56,-8.89,;4.25,-6.31,;2.76,-5.91,;2.36,-4.43,;.87,-4.03,;-.22,-5.12,;.4,-2.56,;1.3,-1.32,;2.84,-1.32,;.4,-.07,;.87,1.39,;2.38,1.71,;-.16,2.54,;-1.66,2.22,;-2.7,3.36,;-2.22,4.83,;-.71,5.15,;.32,4,;-3.25,5.97,;-4.79,6.05,;-4.71,7.59,;-3.17,7.51,;-5.74,8.73,;-7.24,8.41,;-8.39,7.38,;-8.71,8.89,;-1.07,-.55,;-2.4,.22,;-3.74,-.55,;-3.74,-2.09,;-5.07,-2.86,;-2.4,-2.86,;-1.07,-2.09,)|

COc1cnc2n([C@H](C)[C@H]3CCC(CC3)N3CC(C3)OC(F)F)c(C)c(C(=O)NCc3c(SC)cc(C)[nH]c3=O)c2c1 |wU:7.7,9.9,(-6.62,-2.42,;-5.29,-3.19,;-3.95,-2.42,;-3.95,-.88,;-2.62,-.11,;-1.29,-.88,;.18,-.41,;.66,1.06,;2.16,1.38,;-.38,2.2,;-1.88,1.88,;-2.91,3.03,;-2.44,4.49,;-.93,4.81,;.1,3.67,;-3.47,5.64,;-5,5.72,;-4.92,7.25,;-3.39,7.17,;-5.95,8.4,;-7.46,8.08,;-7.94,6.61,;-8.49,9.22,;1.08,-1.65,;2.62,-1.65,;.18,-2.9,;.66,-4.36,;-.43,-5.45,;2.14,-4.76,;2.54,-6.25,;4.03,-6.65,;5.12,-5.56,;4.72,-4.07,;3.23,-3.67,;6.61,-5.96,;7,-7.44,;8.49,-7.84,;5.91,-8.53,;4.43,-8.13,;3.34,-9.22,;-1.29,-2.42,;-2.62,-3.19,)|

COc1cnc2n([C@H](C)[C@H]3CCC(CC3)N3CC(C3)OC(F)F)c(C)c(C(=O)NCc3c(SC)cc(C)[nH]c3=O)c2c1 |wU:7.7,wD:9.14,(-6.62,-2.42,;-5.29,-3.19,;-3.95,-2.42,;-3.95,-.88,;-2.62,-.11,;-1.29,-.88,;.18,-.41,;.66,1.06,;2.16,1.38,;-.38,2.2,;.1,3.67,;-.93,4.81,;-2.44,4.49,;-2.91,3.03,;-1.88,1.88,;-3.47,5.64,;-5,5.72,;-4.92,7.25,;-3.39,7.17,;-5.95,8.4,;-7.46,8.08,;-7.94,6.61,;-8.49,9.22,;1.08,-1.65,;2.62,-1.65,;.18,-2.9,;.66,-4.36,;-.43,-5.45,;2.14,-4.76,;2.54,-6.25,;4.03,-6.65,;5.12,-5.56,;4.72,-4.07,;3.23,-3.67,;6.61,-5.96,;7,-7.44,;8.49,-7.84,;5.91,-8.53,;4.43,-8.13,;3.34,-9.22,;-1.29,-2.42,;-2.62,-3.19,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OC2CCC2)c2ncc(Cl)cc12 |wU:18.19,(3.78,-3.52,;5.27,-3.92,;5.67,-5.41,;7.16,-5.8,;7.55,-7.29,;9.04,-7.69,;6.46,-8.38,;4.98,-7.98,;3.89,-9.07,;4.58,-6.49,;3.09,-6.1,;2.69,-4.61,;1.2,-4.21,;.12,-5.3,;.73,-2.74,;1.63,-1.5,;3.17,-1.5,;.73,-.25,;1.2,1.21,;2.71,1.53,;.17,2.36,;-1.33,2.04,;-2.36,3.18,;-1.89,4.64,;-.38,4.96,;.65,3.82,;-2.92,5.79,;-4.45,5.87,;-4.37,7.41,;-2.84,7.33,;-5.4,8.55,;-6.91,8.23,;-7.75,6.94,;-9.04,7.78,;-8.2,9.07,;-.74,-.73,;-2.07,.04,;-3.4,-.73,;-3.4,-2.27,;-4.74,-3.04,;-2.07,-3.04,;-.74,-2.27,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2cc(Br)ccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2cccc(Br)c12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)OC(C)(C)C)c2ncc(Cl)cc12 |wU:18.19,(3.47,-3.67,;4.96,-4.07,;5.36,-5.56,;6.84,-5.96,;7.24,-7.44,;8.73,-7.84,;6.15,-8.53,;4.67,-8.13,;3.58,-9.22,;4.27,-6.65,;2.78,-6.25,;2.38,-4.76,;.89,-4.36,;-.2,-5.45,;.42,-2.9,;1.32,-1.65,;2.86,-1.65,;.42,-.41,;.89,1.06,;2.4,1.38,;-.14,2.2,;-1.64,1.88,;-2.67,3.03,;-2.2,4.49,;-.69,4.81,;.34,3.67,;-3.23,5.64,;-4.77,5.72,;-4.69,7.25,;-3.15,7.17,;-5.72,8.4,;-7.22,8.08,;-7.7,6.61,;-8.73,7.76,;-8.25,9.22,;-1.05,-.88,;-2.38,-.11,;-3.71,-.88,;-3.71,-2.42,;-5.05,-3.19,;-2.38,-3.19,;-1.05,-2.42,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)NC2(COC2)C(F)(F)F)c2ccccc12 |r,wD:18.19,(8.14,-24.02,;6.64,-24.34,;6.16,-25.81,;4.65,-26.13,;4.18,-27.59,;2.67,-27.91,;5.21,-28.74,;6.71,-28.42,;7.74,-29.56,;7.19,-26.95,;8.7,-26.63,;9.17,-25.17,;10.68,-24.85,;11.71,-25.99,;11.15,-23.38,;10.25,-22.14,;8.71,-22.14,;11.15,-20.89,;10.68,-19.43,;9.17,-19.11,;11.71,-18.28,;11.23,-16.82,;12.26,-15.67,;13.77,-15.99,;14.25,-17.46,;13.22,-18.6,;14.8,-14.85,;16.31,-15.17,;17.81,-15.49,;17.49,-17,;15.99,-16.68,;16.63,-13.66,;16.95,-12.16,;18.13,-13.98,;15.12,-13.34,;12.62,-21.37,;13.95,-20.6,;15.29,-21.37,;15.29,-22.91,;13.95,-23.68,;12.62,-22.91,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2(C)CC2)c2ncccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)OC2CC2)c2ccccc12 |wU:18.19,(-.53,5.89,;.97,6.21,;2.01,5.07,;3.51,5.39,;4.54,4.24,;6.05,4.56,;4.07,2.78,;2.56,2.46,;2.08,.99,;1.53,3.6,;.02,3.28,;-.45,1.82,;-1.96,1.5,;-2.99,2.64,;-2.44,.03,;-1.53,-1.21,;.01,-1.21,;-2.44,-2.46,;-1.96,-3.93,;-3.05,-5.01,;-.47,-4.32,;.62,-3.23,;2.1,-3.63,;2.5,-5.12,;1.41,-6.21,;-.07,-5.81,;3.99,-5.52,;5.08,-4.43,;5.48,-2.94,;6.57,-4.03,;-3.9,-1.98,;-5.23,-2.75,;-6.57,-1.98,;-6.57,-.44,;-5.23,.33,;-3.9,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2COC2)c2ccccc12 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC([O-])=O)CC2)c2ccccc12 |wU:18.19,wD:20.20,(-.53,5.89,;.97,6.21,;2.01,5.07,;3.51,5.39,;4.54,4.24,;6.05,4.56,;4.07,2.78,;2.56,2.46,;2.08,.99,;1.53,3.6,;.02,3.28,;-.45,1.82,;-1.96,1.5,;-2.99,2.64,;-2.44,.03,;-1.53,-1.21,;.01,-1.21,;-2.44,-2.46,;-1.96,-3.93,;-3.05,-5.01,;-.47,-4.32,;-.07,-5.81,;1.41,-6.21,;2.5,-5.12,;3.99,-5.52,;5.08,-4.43,;6.57,-4.83,;4.68,-2.94,;2.1,-3.63,;.62,-3.23,;-3.9,-1.98,;-5.23,-2.75,;-6.57,-1.98,;-6.57,-.44,;-5.23,.33,;-3.9,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC([O-])=O)CC2)c2ccccc12 |wU:18.19,20.20,(-.53,5.89,;.97,6.21,;2.01,5.07,;3.51,5.39,;4.54,4.24,;6.05,4.56,;4.07,2.78,;2.56,2.46,;2.08,.99,;1.53,3.6,;.02,3.28,;-.45,1.82,;-1.96,1.5,;-2.99,2.64,;-2.44,.03,;-1.53,-1.21,;.01,-1.21,;-2.44,-2.46,;-1.96,-3.93,;-3.05,-5.01,;-.47,-4.32,;.62,-3.23,;2.1,-3.63,;2.5,-5.12,;3.99,-5.52,;5.08,-4.43,;6.57,-4.83,;4.68,-2.94,;1.41,-6.21,;-.07,-5.81,;-3.9,-1.98,;-5.23,-2.75,;-6.57,-1.98,;-6.57,-.44,;-5.23,.33,;-3.9,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C(=O)CO)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(O)C2)c2ccccc12 |wU:18.19,(.01,.82,;1.52,1.14,;1.99,2.6,;3.5,2.92,;3.97,4.38,;5.48,4.71,;2.94,5.53,;1.44,5.21,;.41,6.35,;.96,3.74,;-.54,3.42,;-1.02,1.96,;-2.53,1.64,;-3.56,2.78,;-3,.17,;-2.1,-1.07,;-.56,-1.07,;-3,-2.32,;-2.53,-3.78,;-3.56,-4.93,;-1.02,-4.1,;.01,-2.96,;1.52,-3.28,;1.99,-4.74,;.96,-5.89,;-.54,-5.57,;3.5,-5.06,;4.79,-4.22,;5.63,-5.51,;7.13,-5.84,;4.34,-6.35,;-4.47,-1.84,;-5.8,-2.61,;-7.13,-1.84,;-7.13,-.3,;-5.8,.47,;-4.47,-.3,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)OC2COC2)c2ccccc12 |wU:18.19,20.21,(-.56,5.89,;.95,6.21,;1.98,5.07,;3.49,5.39,;4.52,4.24,;6.02,4.56,;4.04,2.78,;2.53,2.46,;2.06,.99,;1.5,3.6,;-0,3.28,;-.48,1.82,;-1.99,1.5,;-3.02,2.64,;-2.46,.03,;-1.56,-1.21,;-.02,-1.21,;-2.46,-2.46,;-1.99,-3.93,;-3.07,-5.01,;-.5,-4.32,;.59,-3.23,;2.08,-3.63,;2.48,-5.12,;1.39,-6.21,;-.1,-5.81,;3.96,-5.52,;5.05,-4.43,;6.59,-4.43,;6.59,-2.89,;5.05,-2.89,;-3.93,-1.98,;-5.26,-2.75,;-6.59,-1.98,;-6.59,-.44,;-5.26,.33,;-3.93,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)OC2COC2)c2ccccc12 |wU:18.19,wD:20.26,(-.56,5.89,;.95,6.21,;1.98,5.07,;3.49,5.39,;4.52,4.24,;6.02,4.56,;4.04,2.78,;2.53,2.46,;2.06,.99,;1.5,3.6,;-0,3.28,;-.48,1.82,;-1.99,1.5,;-3.02,2.64,;-2.46,.03,;-1.56,-1.21,;-.02,-1.21,;-2.46,-2.46,;-1.99,-3.93,;-3.07,-5.01,;-.5,-4.32,;-.1,-5.81,;1.39,-6.21,;2.48,-5.12,;2.08,-3.63,;.59,-3.23,;3.96,-5.52,;5.05,-4.43,;6.59,-4.43,;6.59,-2.89,;5.05,-2.89,;-3.93,-1.98,;-5.26,-2.75,;-6.59,-1.98,;-6.59,-.44,;-5.26,.33,;-3.93,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)C#N)c2ccccc12 |wU:18.19,20.21,(-1.78,6.22,;-.28,6.55,;.75,5.4,;2.26,5.72,;3.29,4.58,;4.8,4.9,;2.81,3.11,;1.31,2.79,;.83,1.33,;.28,3.94,;-1.23,3.62,;-1.7,2.15,;-3.21,1.83,;-4.24,2.98,;-3.69,.37,;-2.78,-.88,;-1.24,-.88,;-3.69,-2.13,;-3.21,-3.59,;-4.3,-4.68,;-1.72,-3.99,;-.63,-2.9,;.85,-3.3,;1.25,-4.79,;.16,-5.87,;-1.32,-5.48,;2.74,-5.18,;4.07,-4.41,;4.84,-5.75,;3.51,-6.52,;6.33,-6.15,;7.82,-6.55,;-5.15,-1.65,;-6.48,-2.42,;-7.82,-1.65,;-7.82,-.11,;-6.48,.66,;-5.15,-.11,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)C#N)c2ccccc12 |wU:18.19,wD:20.26,(-1.78,6.22,;-.28,6.55,;.75,5.4,;2.26,5.72,;3.29,4.58,;4.8,4.9,;2.81,3.11,;1.31,2.79,;.83,1.33,;.28,3.94,;-1.23,3.62,;-1.7,2.15,;-3.21,1.83,;-4.24,2.98,;-3.69,.37,;-2.78,-.88,;-1.24,-.88,;-3.69,-2.13,;-3.21,-3.59,;-4.3,-4.68,;-1.72,-3.99,;-1.32,-5.48,;.16,-5.87,;1.25,-4.79,;.85,-3.3,;-.63,-2.9,;2.74,-5.18,;4.07,-4.41,;4.84,-5.75,;3.51,-6.52,;6.33,-6.15,;7.82,-6.55,;-5.15,-1.65,;-6.48,-2.42,;-7.82,-1.65,;-7.82,-.11,;-6.48,.66,;-5.15,-.11,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC22COC2)c2ncccc12 |wU:18.19,20.21,(2.52,-2.63,;4,-3.03,;4.4,-4.52,;5.89,-4.92,;6.29,-6.4,;7.78,-6.8,;5.2,-7.49,;3.71,-7.09,;2.62,-8.18,;3.31,-5.61,;1.83,-5.21,;1.43,-3.72,;-.06,-3.32,;-1.15,-4.41,;-.54,-1.86,;.37,-.61,;1.91,-.61,;-.54,.63,;-.06,2.1,;1.45,2.42,;-1.09,3.24,;-2.6,2.92,;-3.63,4.07,;-3.15,5.53,;-1.64,5.85,;-.61,4.71,;-4.18,6.68,;-4.5,8.18,;-5.65,7.15,;-6.48,5.86,;-7.78,6.7,;-6.94,7.99,;-2,.16,;-3.33,.93,;-4.67,.16,;-4.67,-1.38,;-3.33,-2.15,;-2,-1.38,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC22COC2)c2ncccc12 |wU:18.19,wD:20.26,(2.52,-2.63,;4,-3.03,;4.4,-4.52,;5.89,-4.92,;6.29,-6.4,;7.78,-6.8,;5.2,-7.49,;3.71,-7.09,;2.62,-8.18,;3.31,-5.61,;1.83,-5.21,;1.43,-3.72,;-.06,-3.32,;-1.15,-4.41,;-.54,-1.86,;.37,-.61,;1.91,-.61,;-.54,.63,;-.06,2.1,;1.45,2.42,;-1.09,3.24,;-.61,4.71,;-1.64,5.85,;-3.15,5.53,;-3.63,4.07,;-2.6,2.92,;-4.18,6.68,;-4.5,8.18,;-5.65,7.15,;-6.48,5.86,;-7.78,6.7,;-6.94,7.99,;-2,.16,;-3.33,.93,;-4.67,.16,;-4.67,-1.38,;-3.33,-2.15,;-2,-1.38,)|

COC1CC(C1)N1CCC(CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |wU:12.14,(7.68,-4.75,;6.59,-5.84,;5.08,-5.51,;4.25,-4.22,;2.95,-5.06,;3.79,-6.35,;1.45,-4.74,;.42,-5.89,;-1.09,-5.57,;-1.57,-4.1,;-.53,-2.96,;.97,-3.28,;-3.07,-3.78,;-4.1,-4.93,;-3.55,-2.32,;-2.64,-1.07,;-1.1,-1.07,;-3.55,.17,;-3.07,1.64,;-4.1,2.78,;-1.57,1.96,;-1.09,3.42,;.42,3.74,;1.45,2.6,;.97,1.14,;-.53,.82,;2.95,2.92,;3.43,4.38,;4.94,4.71,;2.4,5.53,;.89,5.21,;-.14,6.35,;-5.01,-.3,;-6.35,.47,;-7.68,-.3,;-7.68,-1.84,;-6.35,-2.61,;-5.01,-1.84,)|

COC1CC(C1)N1CCC(CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccnc12 |wU:12.14,(-8.06,8.42,;-6.56,8.74,;-5.52,7.59,;-5.61,6.06,;-4.07,5.98,;-3.99,7.51,;-3.04,4.83,;-1.53,5.15,;-.5,4.01,;-.98,2.54,;-2.48,2.22,;-3.51,3.37,;.05,1.4,;1.56,1.72,;-.42,-.07,;.48,-1.31,;2.02,-1.31,;-.42,-2.56,;.05,-4.02,;-.98,-5.17,;1.56,-4.34,;2.04,-5.81,;3.54,-6.13,;4.02,-7.59,;2.99,-8.74,;1.48,-8.42,;5.52,-7.91,;6.56,-6.77,;8.06,-7.09,;6.08,-5.3,;4.57,-4.98,;4.1,-3.52,;-1.89,-2.08,;-3.22,-2.85,;-4.55,-2.08,;-4.55,-.54,;-3.22,.23,;-1.89,-.54,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C(=O)CN(C)C)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CCCC([O-])=O)CC2)c2ccccc12 |wU:18.19,20.20,(-1.82,5.89,;-.31,6.21,;.72,5.07,;2.22,5.39,;3.25,4.24,;4.76,4.56,;2.78,2.78,;1.27,2.46,;.8,.99,;.24,3.6,;-1.27,3.28,;-1.74,1.82,;-3.25,1.5,;-4.28,2.64,;-3.72,.03,;-2.82,-1.21,;-1.28,-1.21,;-3.72,-2.46,;-3.25,-3.93,;-4.34,-5.01,;-1.76,-4.32,;-.67,-3.23,;.82,-3.63,;1.22,-5.12,;2.7,-5.52,;3.79,-4.43,;5.28,-4.83,;6.37,-3.74,;7.86,-4.14,;5.97,-2.25,;.13,-6.21,;-1.36,-5.81,;-5.19,-1.98,;-6.52,-2.75,;-7.86,-1.98,;-7.86,-.44,;-6.52,.33,;-5.19,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CCCC([O-])=O)CC2)c2ccccc12 |wU:18.19,wD:20.20,(-1.82,5.89,;-.31,6.21,;.72,5.07,;2.22,5.39,;3.25,4.24,;4.76,4.56,;2.78,2.78,;1.27,2.46,;.8,.99,;.24,3.6,;-1.27,3.28,;-1.74,1.82,;-3.25,1.5,;-4.28,2.64,;-3.72,.03,;-2.82,-1.21,;-1.28,-1.21,;-3.72,-2.46,;-3.25,-3.93,;-4.34,-5.01,;-1.76,-4.32,;-1.36,-5.81,;.13,-6.21,;1.22,-5.12,;2.7,-5.52,;3.79,-4.43,;5.28,-4.83,;6.37,-3.74,;7.86,-4.14,;5.97,-2.25,;.82,-3.63,;-.67,-3.23,;-5.19,-1.98,;-6.52,-2.75,;-7.86,-1.98,;-7.86,-.44,;-6.52,.33,;-5.19,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC(C)C([O-])=O)CC2)c2ccccc12 |wU:18.19,20.20,(-1.08,5.94,;.43,6.26,;1.46,5.12,;2.97,5.44,;4,4.29,;5.5,4.61,;3.52,2.83,;2.02,2.51,;1.54,1.05,;.98,3.65,;-.52,3.33,;-1,1.87,;-2.5,1.55,;-3.53,2.69,;-2.98,.08,;-2.07,-1.16,;-.53,-1.16,;-2.98,-2.41,;-2.5,-3.87,;-3.59,-4.96,;-1.02,-4.27,;.07,-3.18,;1.56,-3.58,;1.96,-5.07,;3.45,-5.47,;4.54,-4.38,;4.14,-2.89,;6.02,-4.78,;7.11,-3.69,;6.42,-6.26,;.87,-6.16,;-.62,-5.76,;-4.44,-1.93,;-5.78,-2.7,;-7.11,-1.93,;-7.11,-.39,;-5.78,.38,;-4.44,-.39,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC(C)C([O-])=O)CC2)c2ccccc12 |wU:18.19,wD:20.20,(-1.08,5.94,;.43,6.26,;1.46,5.12,;2.97,5.44,;4,4.29,;5.5,4.61,;3.52,2.83,;2.02,2.51,;1.54,1.05,;.98,3.65,;-.52,3.33,;-1,1.87,;-2.5,1.55,;-3.53,2.69,;-2.98,.08,;-2.07,-1.16,;-.53,-1.16,;-2.98,-2.41,;-2.5,-3.87,;-3.59,-4.96,;-1.02,-4.27,;-.62,-5.76,;.87,-6.16,;1.96,-5.07,;3.45,-5.47,;4.54,-4.38,;4.14,-2.89,;6.02,-4.78,;7.11,-3.69,;6.42,-6.26,;1.56,-3.58,;.07,-3.18,;-4.44,-1.93,;-5.78,-2.7,;-7.11,-1.93,;-7.11,-.39,;-5.78,.38,;-4.44,-.39,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)OC2CN(C)C2)c2ncccc12 |wU:18.19,20.21,(3.29,-2.14,;4.78,-2.54,;5.18,-4.02,;6.66,-4.42,;7.06,-5.91,;8.55,-6.31,;5.97,-7,;4.49,-6.6,;3.4,-7.69,;4.09,-5.11,;2.6,-4.71,;2.2,-3.23,;.71,-2.83,;-.37,-3.92,;.24,-1.36,;1.14,-.12,;2.68,-.12,;.24,1.13,;.71,2.59,;2.22,2.91,;-.32,3.74,;-1.82,3.42,;-2.85,4.56,;-2.38,6.03,;-.87,6.35,;.16,5.2,;-3.41,7.17,;-4.91,6.85,;-6.21,7.69,;-7.04,6.4,;-8.55,6.08,;-5.75,5.56,;-1.23,.65,;-2.56,1.42,;-3.89,.65,;-3.89,-.89,;-2.56,-1.66,;-1.23,-.89,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)OC2CN(C)C2)c2ncccc12 |wU:18.19,wD:20.26,(3.29,-2.14,;4.78,-2.54,;5.18,-4.02,;6.66,-4.42,;7.06,-5.91,;8.55,-6.31,;5.97,-7,;4.49,-6.6,;3.4,-7.69,;4.09,-5.11,;2.6,-4.71,;2.2,-3.23,;.71,-2.83,;-.37,-3.92,;.24,-1.36,;1.14,-.12,;2.68,-.12,;.24,1.13,;.71,2.59,;2.22,2.91,;-.32,3.74,;.16,5.2,;-.87,6.35,;-2.38,6.03,;-2.85,4.56,;-1.82,3.42,;-3.41,7.17,;-4.91,6.85,;-6.21,7.69,;-7.04,6.4,;-8.55,6.08,;-5.75,5.56,;-1.23,.65,;-2.56,1.42,;-3.89,.65,;-3.89,-.89,;-2.56,-1.66,;-1.23,-.89,)|

CCS(=O)(=O)N1CCC(CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)Oc2cnn(C)c2)c2ncccc12 |wU:18.19,20.21,(3.41,-2.23,;4.9,-2.63,;5.3,-4.12,;6.79,-4.52,;7.19,-6.01,;8.67,-6.4,;6.1,-7.09,;4.61,-6.7,;3.52,-7.79,;4.21,-5.21,;2.72,-4.81,;2.33,-3.32,;.84,-2.92,;-.25,-4.01,;.36,-1.46,;1.27,-.21,;2.81,-.21,;.36,1.03,;.84,2.5,;2.34,2.82,;-.19,3.64,;-1.7,3.32,;-2.73,4.47,;-2.25,5.93,;-.75,6.25,;.28,5.11,;-3.28,7.07,;-4.79,6.75,;-5.42,5.35,;-6.95,5.51,;-7.27,7.02,;-8.67,7.64,;-5.93,7.79,;-1.1,.56,;-2.44,1.33,;-3.77,.56,;-3.77,-.98,;-2.44,-1.75,;-1.1,-.98,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)Oc2cnn(C)c2)c2ncccc12 |wU:18.19,wD:20.26,(3.41,-2.23,;4.9,-2.63,;5.3,-4.12,;6.79,-4.52,;7.19,-6.01,;8.67,-6.4,;6.1,-7.09,;4.61,-6.7,;3.52,-7.79,;4.21,-5.21,;2.72,-4.81,;2.33,-3.32,;.84,-2.92,;-.25,-4.01,;.36,-1.46,;1.27,-.21,;2.81,-.21,;.36,1.03,;.84,2.5,;2.34,2.82,;-.19,3.64,;.28,5.11,;-.75,6.25,;-2.25,5.93,;-2.73,4.47,;-1.7,3.32,;-3.28,7.07,;-4.79,6.75,;-5.42,5.35,;-6.95,5.51,;-7.27,7.02,;-8.67,7.64,;-5.93,7.79,;-1.1,.56,;-2.44,1.33,;-3.77,.56,;-3.77,-.98,;-2.44,-1.75,;-1.1,-.98,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)N(C)C)c2ccccc12 |wU:18.19,20.21,(-1.58,6.77,;-.08,7.09,;.95,5.95,;2.46,6.27,;3.49,5.12,;5,5.44,;3.01,3.66,;1.51,3.34,;1.03,1.87,;.48,4.48,;-1.03,4.16,;-1.5,2.7,;-3.01,2.38,;-4.04,3.52,;-3.49,.91,;-2.58,-.34,;-1.04,-.34,;-3.49,-1.58,;-3.01,-3.05,;-4.1,-4.13,;-1.52,-3.44,;-.43,-2.36,;1.05,-2.75,;1.45,-4.24,;.36,-5.33,;-1.13,-4.93,;2.94,-4.64,;4.27,-3.87,;5.04,-5.2,;3.71,-5.97,;6.53,-5.6,;6.93,-7.09,;7.62,-4.51,;-4.95,-1.11,;-6.29,-1.88,;-7.62,-1.11,;-7.62,.43,;-6.29,1.2,;-4.95,.43,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)N(C)C)c2ccccc12 |wU:18.19,wD:20.26,(-1.58,6.77,;-.08,7.09,;.95,5.95,;2.46,6.27,;3.49,5.12,;5,5.44,;3.01,3.66,;1.51,3.34,;1.03,1.87,;.48,4.48,;-1.03,4.16,;-1.5,2.7,;-3.01,2.38,;-4.04,3.52,;-3.49,.91,;-2.58,-.34,;-1.04,-.34,;-3.49,-1.58,;-3.01,-3.05,;-4.1,-4.13,;-1.52,-3.44,;-1.13,-4.93,;.36,-5.33,;1.45,-4.24,;1.05,-2.75,;-.43,-2.36,;2.94,-4.64,;4.27,-3.87,;5.04,-5.2,;3.71,-5.97,;6.53,-5.6,;6.93,-7.09,;7.62,-4.51,;-4.95,-1.11,;-6.29,-1.88,;-7.62,-1.11,;-7.62,.43,;-6.29,1.2,;-4.95,.43,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(C)CCOC2)c2ccccc12 |wU:18.19,20.21,(-1.03,5.89,;.47,6.21,;1.5,5.07,;3.01,5.39,;4.04,4.24,;5.55,4.56,;3.57,2.78,;2.06,2.46,;1.58,.99,;1.03,3.6,;-.48,3.28,;-.95,1.82,;-2.46,1.5,;-3.49,2.64,;-2.94,.03,;-2.03,-1.21,;-.49,-1.21,;-2.94,-2.46,;-2.46,-3.93,;-3.55,-5.01,;-.97,-4.32,;.12,-3.23,;1.6,-3.63,;2,-5.12,;.91,-6.21,;-.57,-5.81,;3.49,-5.52,;4.58,-4.43,;3.09,-4.03,;5.78,-5.4,;7.07,-4.56,;6.67,-3.07,;5.13,-2.99,;-4.4,-1.98,;-5.73,-2.75,;-7.07,-1.98,;-7.07,-.44,;-5.73,.33,;-4.4,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(C)CCOC2)c2ccccc12 |wU:18.19,wD:20.26,(-1.03,5.89,;.47,6.21,;1.5,5.07,;3.01,5.39,;4.04,4.24,;5.55,4.56,;3.57,2.78,;2.06,2.46,;1.58,.99,;1.03,3.6,;-.48,3.28,;-.95,1.82,;-2.46,1.5,;-3.49,2.64,;-2.94,.03,;-2.03,-1.21,;-.49,-1.21,;-2.94,-2.46,;-2.46,-3.93,;-3.55,-5.01,;-.97,-4.32,;-.57,-5.81,;.91,-6.21,;2,-5.12,;1.6,-3.63,;.12,-3.23,;3.49,-5.52,;4.58,-4.43,;3.09,-4.03,;5.78,-5.4,;7.07,-4.56,;6.67,-3.07,;5.13,-2.99,;-4.4,-1.98,;-5.73,-2.75,;-7.07,-1.98,;-7.07,-.44,;-5.73,.33,;-4.4,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@@H]2OC[C@@H](CO2)N2CCC22COC2)c2ccccc12 |wU:18.19,wD:20.26,23.27,(.81,2.05,;2.32,2.37,;2.8,3.83,;4.3,4.15,;4.78,5.61,;6.28,5.93,;3.75,6.76,;2.24,6.44,;1.21,7.58,;1.77,4.97,;.26,4.65,;-.22,3.19,;-1.72,2.87,;-2.75,4.01,;-2.2,1.4,;-1.29,.16,;.25,.16,;-2.2,-1.09,;-1.72,-2.55,;-2.81,-3.64,;-.24,-2.95,;.85,-1.86,;2.34,-2.26,;2.74,-3.75,;1.65,-4.84,;.16,-4.44,;4.23,-4.15,;5.56,-3.38,;6.33,-4.71,;5,-5.48,;5.77,-6.81,;4.43,-7.58,;3.66,-6.25,;-3.66,-.61,;-5,-1.38,;-6.33,-.61,;-6.33,.93,;-5,1.7,;-3.66,.93,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2OC[C@@H](CO2)N2CCC22COC2)c2ccccc12 |wU:18.19,20.26,wD:23.27,(.81,2.05,;2.32,2.37,;2.8,3.83,;4.3,4.15,;4.78,5.62,;6.28,5.93,;3.75,6.76,;2.24,6.44,;1.21,7.58,;1.77,4.97,;.26,4.65,;-.22,3.19,;-1.72,2.87,;-2.75,4.01,;-2.2,1.4,;-1.29,.16,;.25,.16,;-2.2,-1.09,;-1.72,-2.55,;-2.81,-3.64,;-.24,-2.95,;.85,-1.86,;2.34,-2.26,;2.74,-3.75,;1.65,-4.84,;.16,-4.44,;4.23,-4.15,;5.56,-3.38,;6.33,-4.71,;5,-5.48,;5.77,-6.81,;4.43,-7.58,;3.66,-6.25,;-3.66,-.61,;-5,-1.38,;-6.33,-.61,;-6.33,.93,;-5,1.7,;-3.66,.93,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@@H](C)[C@@H]2OC[C@@H](CO2)N2CCC22COC2)c2ccccc12 |wD:18.19,20.26,23.27,(.81,2.05,;2.32,2.37,;2.8,3.83,;4.3,4.15,;4.78,5.61,;6.28,5.93,;3.75,6.76,;2.24,6.44,;1.21,7.58,;1.77,4.97,;.26,4.65,;-.22,3.19,;-1.72,2.87,;-2.75,4.01,;-2.2,1.4,;-1.29,.16,;.25,.16,;-2.2,-1.09,;-1.72,-2.55,;-2.81,-3.64,;-.24,-2.95,;.85,-1.86,;2.34,-2.26,;2.74,-3.75,;1.65,-4.84,;.16,-4.44,;4.23,-4.15,;5.56,-3.38,;6.33,-4.71,;5,-5.48,;5.77,-6.81,;4.43,-7.58,;3.66,-6.25,;-3.66,-.61,;-5,-1.38,;-6.33,-.61,;-6.33,.93,;-5,1.7,;-3.66,.93,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@@H](C)[C@H]2OC[C@@H](CO2)N2CCC22COC2)c2ccccc12 |wU:23.27,wD:18.19,20.21,(.81,2.05,;2.32,2.37,;2.8,3.83,;4.3,4.15,;4.78,5.61,;6.28,5.93,;3.75,6.76,;2.24,6.44,;1.21,7.58,;1.77,4.97,;.26,4.65,;-.22,3.19,;-1.72,2.87,;-2.75,4.01,;-2.2,1.4,;-1.29,.16,;.25,.16,;-2.2,-1.09,;-1.72,-2.55,;-2.81,-3.64,;-.24,-2.95,;.16,-4.44,;1.65,-4.84,;2.74,-3.75,;2.34,-2.26,;.85,-1.86,;4.23,-4.15,;5.56,-3.38,;6.33,-4.71,;5,-5.48,;5.77,-6.81,;4.43,-7.58,;3.66,-6.25,;-3.66,-.61,;-5,-1.38,;-6.33,-.61,;-6.33,.93,;-5,1.7,;-3.66,.93,)|

COC1CC(C1)N1CC[C@H]([C@@H](C)n2c(C)c(C(=O)NCc3c(SC)cc(C)[nH]c3=O)c3ccccc23)[C@@H](F)C1 |wU:10.11,9.10,wD:36.40,(7.62,-5.05,;6.53,-6.14,;5.04,-5.74,;4.27,-4.4,;2.94,-5.17,;3.71,-6.51,;1.45,-4.78,;1.05,-3.29,;-.43,-2.89,;-1.52,-3.98,;-3.01,-3.58,;-4.1,-4.67,;-3.49,-2.12,;-2.58,-.87,;-1.04,-.87,;-3.49,.38,;-3.01,1.84,;-4.04,2.99,;-1.5,2.16,;-1.03,3.63,;.48,3.95,;.95,5.41,;-.08,6.55,;-1.58,6.23,;2.46,5.73,;3.49,4.59,;5,4.91,;3.01,3.12,;1.51,2.8,;1.03,1.34,;-4.95,-.1,;-6.29,.67,;-7.62,-.1,;-7.62,-1.64,;-6.29,-2.41,;-4.95,-1.64,;-1.13,-5.47,;-2.21,-6.55,;.36,-5.86,)|

COC1CC(C1)N1CC[C@H]([C@@H](C)n2c(C)c(C(=O)NCc3c(SC)cc(C)[nH]c3=O)c3ccccc23)[C@H](F)C1 |wU:10.11,36.40,9.10,(7.62,-5.05,;6.53,-6.14,;5.04,-5.74,;4.27,-4.4,;2.94,-5.17,;3.71,-6.51,;1.45,-4.78,;1.05,-3.29,;-.43,-2.89,;-1.52,-3.98,;-3.01,-3.58,;-4.1,-4.67,;-3.49,-2.12,;-2.58,-.87,;-1.04,-.87,;-3.49,.38,;-3.01,1.84,;-4.04,2.99,;-1.5,2.16,;-1.03,3.63,;.48,3.95,;.95,5.41,;-.08,6.55,;-1.58,6.23,;2.46,5.73,;3.49,4.59,;5,4.91,;3.01,3.12,;1.51,2.8,;1.03,1.34,;-4.95,-.1,;-6.29,.67,;-7.62,-.1,;-7.62,-1.64,;-6.29,-2.41,;-4.95,-1.64,;-1.13,-5.47,;-2.21,-6.55,;.36,-5.86,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(CF)COC2)c2ccccc12 |wU:18.19,20.21,(-.84,5.89,;.67,6.21,;1.7,5.07,;3.2,5.39,;4.23,4.24,;5.74,4.56,;3.76,2.78,;2.25,2.46,;1.78,.99,;1.22,3.6,;-.29,3.28,;-.76,1.82,;-2.27,1.5,;-3.3,2.64,;-2.74,.03,;-1.84,-1.21,;-.3,-1.21,;-2.74,-2.46,;-2.27,-3.93,;-3.36,-5.01,;-.78,-4.32,;.31,-3.23,;1.8,-3.63,;2.2,-5.12,;1.11,-6.21,;-.38,-5.81,;3.68,-5.52,;4.77,-4.43,;3.28,-4.03,;2.89,-2.54,;5.54,-3.1,;6.88,-3.87,;6.11,-5.2,;-4.21,-1.98,;-5.54,-2.75,;-6.88,-1.98,;-6.88,-.44,;-5.54,.33,;-4.21,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(CF)COC2)c2ccccc12 |wU:18.19,wD:20.26,(-.84,5.89,;.67,6.21,;1.7,5.07,;3.2,5.39,;4.23,4.24,;5.74,4.56,;3.76,2.78,;2.25,2.46,;1.78,.99,;1.22,3.6,;-.29,3.28,;-.76,1.82,;-2.27,1.5,;-3.3,2.64,;-2.74,.03,;-1.84,-1.21,;-.3,-1.21,;-2.74,-2.46,;-2.27,-3.93,;-3.36,-5.01,;-.78,-4.32,;-.38,-5.81,;1.11,-6.21,;2.2,-5.12,;1.8,-3.63,;.31,-3.23,;3.68,-5.52,;4.77,-4.43,;3.28,-4.03,;2.89,-2.54,;5.54,-3.1,;6.88,-3.87,;6.11,-5.2,;-4.21,-1.98,;-5.54,-2.75,;-6.88,-1.98,;-6.88,-.44,;-5.54,.33,;-4.21,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(CF)COC2)c2ncccc12 |wU:18.19,20.21,(2.51,-2.4,;4,-2.8,;4.39,-4.29,;5.88,-4.69,;6.28,-6.18,;7.77,-6.58,;5.19,-7.27,;3.7,-6.87,;2.61,-7.96,;3.31,-5.38,;1.82,-4.98,;1.42,-3.49,;-.07,-3.09,;-1.16,-4.18,;-.54,-1.63,;.36,-.38,;1.9,-.38,;-.54,.86,;-.07,2.33,;1.44,2.65,;-1.1,3.47,;-2.61,3.15,;-3.64,4.3,;-3.16,5.76,;-1.65,6.08,;-.62,4.94,;-4.19,6.9,;-5.7,6.58,;-4.67,5.44,;-5.14,3.97,;-6.4,7.96,;-7.77,7.26,;-7.07,5.88,;-2.01,.39,;-3.34,1.16,;-4.68,.39,;-4.68,-1.15,;-3.34,-1.92,;-2.01,-1.15,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(CF)COC2)c2ncccc12 |wU:18.19,wD:20.26,(2.51,-2.4,;4,-2.8,;4.39,-4.29,;5.88,-4.69,;6.28,-6.18,;7.77,-6.58,;5.19,-7.27,;3.7,-6.87,;2.61,-7.96,;3.31,-5.38,;1.82,-4.98,;1.42,-3.49,;-.07,-3.09,;-1.16,-4.18,;-.54,-1.63,;.36,-.38,;1.9,-.38,;-.54,.86,;-.07,2.33,;1.44,2.65,;-1.1,3.47,;-.62,4.94,;-1.65,6.08,;-3.16,5.76,;-3.64,4.3,;-2.61,3.15,;-4.19,6.9,;-5.7,6.58,;-4.67,5.44,;-5.14,3.97,;-6.4,7.96,;-7.77,7.26,;-7.07,5.88,;-2.01,.39,;-3.34,1.16,;-4.68,.39,;-4.68,-1.15,;-3.34,-1.92,;-2.01,-1.15,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(CF)COC2)c2ncncc12 |wU:18.19,20.21,(2.51,-2.4,;4,-2.8,;4.39,-4.29,;5.88,-4.69,;6.28,-6.18,;7.77,-6.58,;5.19,-7.27,;3.7,-6.87,;2.61,-7.96,;3.31,-5.38,;1.82,-4.98,;1.42,-3.49,;-.07,-3.09,;-1.16,-4.18,;-.54,-1.63,;.36,-.38,;1.9,-.38,;-.54,.86,;-.07,2.33,;1.44,2.65,;-1.1,3.47,;-2.61,3.15,;-3.64,4.3,;-3.16,5.76,;-1.65,6.08,;-.62,4.94,;-4.19,6.9,;-5.7,6.58,;-4.67,5.44,;-5.14,3.97,;-6.4,7.96,;-7.77,7.26,;-7.07,5.88,;-2.01,.39,;-3.34,1.16,;-4.68,.39,;-4.68,-1.15,;-3.34,-1.92,;-2.01,-1.15,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(CF)COC2)c2ncncc12 |wU:18.19,wD:20.26,(2.51,-2.4,;4,-2.8,;4.39,-4.29,;5.88,-4.69,;6.28,-6.18,;7.77,-6.58,;5.19,-7.27,;3.7,-6.87,;2.61,-7.96,;3.31,-5.38,;1.82,-4.98,;1.42,-3.49,;-.07,-3.09,;-1.16,-4.18,;-.54,-1.63,;.36,-.38,;1.9,-.38,;-.54,.86,;-.07,2.33,;1.44,2.65,;-1.1,3.47,;-.62,4.94,;-1.65,6.08,;-3.16,5.76,;-3.64,4.3,;-2.61,3.15,;-4.19,6.9,;-5.7,6.58,;-4.67,5.44,;-5.14,3.97,;-6.4,7.96,;-7.77,7.26,;-7.07,5.88,;-2.01,.39,;-3.34,1.16,;-4.68,.39,;-4.68,-1.15,;-3.34,-1.92,;-2.01,-1.15,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(F)(C2)C2CC2)c2ncccc12 |wU:18.19,(2.93,-3.5,;4.42,-3.9,;4.82,-5.38,;6.31,-5.78,;6.71,-7.27,;8.19,-7.67,;5.62,-8.36,;4.13,-7.96,;3.04,-9.05,;3.73,-6.47,;2.24,-6.07,;1.84,-4.59,;.36,-4.19,;-.73,-5.28,;-.12,-2.72,;.79,-1.48,;2.33,-1.48,;-.12,-.23,;.36,1.23,;1.86,1.55,;-.67,2.38,;-2.18,2.06,;-3.21,3.2,;-2.73,4.67,;-1.23,4.99,;-.2,3.84,;-3.76,5.81,;-5.3,5.89,;-5.22,7.43,;-5.54,8.94,;-3.68,7.35,;-6.69,7.9,;-8.19,7.58,;-7.72,9.05,;-1.58,-.71,;-2.92,.06,;-4.25,-.71,;-4.25,-2.25,;-2.92,-3.02,;-1.58,-2.25,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(O)(C2)C(C)C)c2ncccc12 |wU:18.19,(2.75,-3.68,;4.24,-4.08,;4.64,-5.56,;6.13,-5.96,;6.52,-7.45,;8.01,-7.85,;5.44,-8.54,;3.95,-8.14,;2.86,-9.23,;3.55,-6.65,;2.06,-6.26,;1.66,-4.77,;.18,-4.37,;-.91,-5.46,;-.3,-2.9,;.61,-1.66,;2.15,-1.66,;-.3,-.41,;.18,1.05,;1.68,1.37,;-.85,2.2,;-2.36,1.88,;-3.39,3.02,;-2.92,4.49,;-1.41,4.81,;-.38,3.66,;-3.95,5.63,;-5.48,5.71,;-5.4,7.25,;-5.72,8.75,;-3.87,7.17,;-6.87,7.72,;-7.19,9.23,;-8.01,6.69,;-1.76,-.89,;-3.1,-.12,;-4.43,-.89,;-4.43,-2.43,;-3.1,-3.2,;-1.76,-2.43,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(CO)COC2)c2cc(F)ccc12 |wU:18.19,20.21,(-.17,5.89,;1.33,6.21,;2.36,5.07,;3.87,5.39,;4.9,4.24,;6.41,4.56,;4.42,2.78,;2.92,2.46,;2.44,.99,;1.89,3.6,;.38,3.28,;-.09,1.82,;-1.6,1.5,;-2.63,2.64,;-2.08,.03,;-1.17,-1.21,;.37,-1.21,;-2.08,-2.46,;-1.6,-3.93,;-2.69,-5.01,;-.11,-4.32,;.98,-3.23,;2.46,-3.63,;2.86,-5.12,;1.77,-6.21,;.29,-5.81,;4.35,-5.52,;5.44,-4.43,;3.95,-4.03,;3.55,-2.54,;6.21,-3.1,;7.54,-3.87,;6.77,-5.2,;-3.54,-1.98,;-4.87,-2.75,;-6.21,-1.98,;-7.54,-2.75,;-6.21,-.44,;-4.87,.33,;-3.54,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(CO)COC2)c2cc(F)ccc12 |wU:18.19,wD:20.26,(-.17,5.89,;1.33,6.21,;2.36,5.07,;3.87,5.39,;4.9,4.24,;6.41,4.56,;4.42,2.78,;2.92,2.46,;2.44,.99,;1.89,3.6,;.38,3.28,;-.09,1.82,;-1.6,1.5,;-2.63,2.64,;-2.08,.03,;-1.17,-1.21,;.37,-1.21,;-2.08,-2.46,;-1.6,-3.93,;-2.69,-5.01,;-.11,-4.32,;.29,-5.81,;1.77,-6.21,;2.86,-5.12,;2.46,-3.63,;.98,-3.23,;4.35,-5.52,;5.44,-4.43,;3.95,-4.03,;3.55,-2.54,;6.21,-3.1,;7.54,-3.87,;6.77,-5.2,;-3.54,-1.98,;-4.87,-2.75,;-6.21,-1.98,;-7.54,-2.75,;-6.21,-.44,;-4.87,.33,;-3.54,-.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)N2CC(C2)n2ccnn2)c2ccccc12 |wU:18.19,(-2.28,6.74,;-.78,7.06,;.25,5.92,;1.76,6.24,;2.79,5.1,;4.3,5.42,;2.31,3.63,;.81,3.31,;.33,1.85,;-.22,4.46,;-1.73,4.14,;-2.2,2.67,;-3.71,2.35,;-4.74,3.5,;-4.19,.89,;-3.28,-.36,;-1.74,-.36,;-4.19,-1.61,;-3.71,-3.07,;-4.8,-4.16,;-2.22,-3.47,;-1.13,-2.38,;.35,-2.78,;.75,-4.27,;-.34,-5.36,;-1.82,-4.96,;2.24,-4.66,;3.57,-3.89,;4.34,-5.23,;3.01,-6,;5.83,-5.63,;6.38,-7.06,;7.92,-6.98,;8.32,-5.5,;7.03,-4.66,;-5.65,-1.13,;-6.99,-1.9,;-8.32,-1.13,;-8.32,.41,;-6.99,1.18,;-5.65,.41,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)NC2(CC2)C(F)(F)F)c2ncccc12 |wU:18.19,(2.23,-3.18,;3.71,-3.58,;4.11,-5.07,;5.6,-5.47,;6,-6.96,;7.49,-7.35,;4.91,-8.04,;3.42,-7.65,;2.33,-8.73,;3.02,-6.16,;1.54,-5.76,;1.14,-4.27,;-.35,-3.87,;-1.44,-4.96,;-.83,-2.41,;.08,-1.16,;1.62,-1.16,;-.83,.08,;-.35,1.55,;1.16,1.87,;-1.38,2.69,;-2.89,2.37,;-3.92,3.52,;-3.44,4.98,;-1.94,5.3,;-.91,4.16,;-4.47,6.13,;-5.98,5.81,;-6.45,4.34,;-7.49,5.49,;-5.5,7.27,;-6.53,8.41,;-5.03,8.73,;-4,7.59,;-2.29,-.39,;-3.63,.38,;-4.96,-.39,;-4.96,-1.93,;-3.63,-2.7,;-2.29,-1.93,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)S(C)(=O)=O)c2ccccc12 |wU:18.19,20.21,(-1.78,6.77,;-.28,7.09,;.75,5.95,;2.26,6.27,;3.29,5.12,;4.8,5.44,;2.81,3.66,;1.31,3.34,;.83,1.87,;.28,4.48,;-1.23,4.16,;-1.7,2.7,;-3.21,2.38,;-4.24,3.52,;-3.69,.91,;-2.78,-.34,;-1.24,-.34,;-3.69,-1.58,;-3.21,-3.05,;-4.3,-4.13,;-1.72,-3.44,;-.63,-2.36,;.85,-2.75,;1.25,-4.24,;.16,-5.33,;-1.32,-4.93,;2.74,-4.64,;4.07,-3.87,;4.84,-5.2,;3.51,-5.97,;6.33,-5.6,;7.82,-6,;5.93,-7.09,;6.73,-4.11,;-5.15,-1.11,;-6.48,-1.88,;-7.82,-1.11,;-7.82,.43,;-6.48,1.2,;-5.15,.43,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)N2CC(C2)S(C)(=O)=O)c2ccccc12 |wU:18.19,wD:20.26,(-1.78,6.77,;-.28,7.09,;.75,5.95,;2.26,6.27,;3.29,5.12,;4.8,5.44,;2.81,3.66,;1.31,3.34,;.83,1.87,;.28,4.48,;-1.23,4.16,;-1.7,2.7,;-3.21,2.38,;-4.24,3.52,;-3.69,.91,;-2.78,-.34,;-1.24,-.34,;-3.69,-1.58,;-3.21,-3.05,;-4.3,-4.13,;-1.72,-3.44,;-1.32,-4.93,;.16,-5.33,;1.25,-4.24,;.85,-2.75,;-.63,-2.36,;2.74,-4.64,;4.07,-3.87,;4.84,-5.2,;3.51,-5.97,;6.33,-5.6,;7.82,-6,;5.93,-7.09,;6.73,-4.11,;-5.15,-1.11,;-6.48,-1.88,;-7.82,-1.11,;-7.82,.43,;-6.48,1.2,;-5.15,.43,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(COC2)C(F)(F)F)c2ncccc12 |wU:18.19,20.21,(2.28,-3.18,;3.77,-3.58,;4.17,-5.07,;5.66,-5.47,;6.05,-6.96,;7.54,-7.35,;4.96,-8.04,;3.48,-7.65,;2.39,-8.73,;3.08,-6.16,;1.59,-5.76,;1.19,-4.27,;-.29,-3.87,;-1.38,-4.96,;-.77,-2.41,;.13,-1.16,;1.67,-1.16,;-.77,.08,;-.29,1.55,;1.21,1.87,;-1.33,2.69,;-2.83,2.37,;-3.86,3.52,;-3.39,4.98,;-1.88,5.3,;-.85,4.16,;-4.42,6.13,;-5.92,5.81,;-7.46,5.89,;-7.54,4.35,;-6,4.27,;-5.45,7.27,;-6.48,8.41,;-4.97,8.73,;-3.94,7.59,;-2.24,-.39,;-3.57,.38,;-4.9,-.39,;-4.9,-1.93,;-3.57,-2.7,;-2.24,-1.93,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)NC2(COC2)C(F)(F)F)c2ncccc12 |wU:18.19,(2.28,-3.18,;3.77,-3.58,;4.17,-5.07,;5.66,-5.47,;6.05,-6.96,;7.54,-7.35,;4.96,-8.04,;3.48,-7.65,;2.39,-8.73,;3.08,-6.16,;1.59,-5.76,;1.19,-4.27,;-.29,-3.87,;-1.38,-4.96,;-.77,-2.41,;.13,-1.16,;1.67,-1.16,;-.77,.08,;-.29,1.55,;1.21,1.87,;-1.33,2.69,;-2.83,2.37,;-3.86,3.52,;-3.39,4.98,;-1.88,5.3,;-.85,4.16,;-4.42,6.13,;-5.92,5.81,;-7.46,5.89,;-7.54,4.35,;-6,4.27,;-5.45,7.27,;-6.48,8.41,;-4.97,8.73,;-3.94,7.59,;-2.24,-.39,;-3.57,.38,;-4.9,-.39,;-4.9,-1.93,;-3.57,-2.7,;-2.24,-1.93,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(COC2)C(F)(F)F)c2ncncc12 |wU:18.19,20.21,(2.28,-3.18,;3.77,-3.58,;4.17,-5.07,;5.66,-5.47,;6.05,-6.96,;7.54,-7.35,;4.96,-8.04,;3.48,-7.65,;2.39,-8.73,;3.08,-6.16,;1.59,-5.76,;1.19,-4.27,;-.29,-3.87,;-1.38,-4.96,;-.77,-2.41,;.13,-1.16,;1.67,-1.16,;-.77,.08,;-.29,1.55,;1.21,1.87,;-1.33,2.69,;-2.83,2.37,;-3.86,3.52,;-3.39,4.98,;-1.88,5.3,;-.85,4.16,;-4.42,6.13,;-5.92,5.81,;-7.46,5.89,;-7.54,4.35,;-6,4.27,;-5.45,7.27,;-6.48,8.41,;-4.97,8.73,;-3.94,7.59,;-2.24,-.39,;-3.57,.38,;-4.9,-.39,;-4.9,-1.93,;-3.57,-2.7,;-2.24,-1.93,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)[C@H]2CCC(CC2)NC2(COC2)C(F)(F)F)c2ncncc12 |wU:18.19,wD:20.26,(2.28,-3.18,;3.77,-3.58,;4.17,-5.07,;5.66,-5.47,;6.05,-6.96,;7.54,-7.35,;4.96,-8.04,;3.48,-7.65,;2.39,-8.73,;3.08,-6.16,;1.59,-5.76,;1.19,-4.27,;-.29,-3.87,;-1.38,-4.96,;-.77,-2.41,;.13,-1.16,;1.67,-1.16,;-.77,.08,;-.29,1.55,;1.21,1.87,;-1.33,2.69,;-.85,4.16,;-1.88,5.3,;-3.39,4.98,;-3.86,3.52,;-2.83,2.37,;-4.42,6.13,;-5.92,5.81,;-7.46,5.89,;-7.54,4.35,;-6,4.27,;-5.45,7.27,;-6.48,8.41,;-4.97,8.73,;-3.94,7.59,;-2.24,-.39,;-3.57,.38,;-4.9,-.39,;-4.9,-1.93,;-3.57,-2.7,;-2.24,-1.93,)|

CN(C)C12CCC(CC1)(CC2)C1(C)Oc2c(O1)c(Cl)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C

COc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)c3OC(C)(Oc3c(C)c2C1=O)C12CCC(CC1)(CC2)N(C)C

CSc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)c3OC(C)(Oc3c(C)c2C1=O)C12CCC(CC1)(CC2)N(C)C

CN(C)C12CCC(CC1)(CC2)C1(C)Oc2c(O1)c(Br)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C

CN(C)C12CCC(CC1)(CC2)C1(C)Oc2c(O1)c(C)c1C(=O)N(Cc3c(C)cc(C)[nH]c3=O)CCc1c2C

CN(C)[C@H]1CC[C@@H](CC1)[C@]1(C)Oc2c(O1)c(-c1ccco1)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C |r,wU:9.10,3.2,wD:6.5,(10.11,2.58,;8.62,2.97,;8.22,4.46,;7.53,1.89,;7.93,.4,;6.84,-.69,;5.35,-.29,;4.96,1.19,;6.04,2.28,;4.26,-1.38,;5.35,-2.47,;3.36,-2.63,;1.9,-2.15,;1.9,-.61,;3.36,-.14,;.56,.16,;.56,1.7,;1.81,2.6,;1.33,4.07,;-.21,4.07,;-.68,2.6,;-.77,-.61,;-2.11,.16,;-3.44,-.61,;-3.44,-2.15,;-4.77,-2.92,;-6.11,-2.15,;-7.44,-2.92,;-7.44,-4.46,;-8.77,-2.15,;-8.77,-.61,;-10.11,.16,;-7.44,.16,;-6.11,-.61,;-4.77,.16,;-2.11,-2.92,;-2.11,-4.46,;-.77,-2.15,;.56,-2.92,;.56,-4.46,)|

CN(C)[C@H]1CC[C@@H](CC1)[C@]1(C)Oc2c(O1)c(-c1cccs1)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C |r,wU:9.10,3.2,wD:6.5,(10.11,2.58,;8.62,2.97,;8.22,4.46,;7.53,1.89,;7.93,.4,;6.84,-.69,;5.35,-.29,;4.96,1.19,;6.04,2.28,;4.26,-1.38,;5.35,-2.47,;3.36,-2.63,;1.9,-2.15,;1.9,-.61,;3.36,-.14,;.56,.16,;.56,1.7,;1.81,2.6,;1.33,4.07,;-.21,4.07,;-.68,2.6,;-.77,-.61,;-2.11,.16,;-3.44,-.61,;-3.44,-2.15,;-4.77,-2.92,;-6.11,-2.15,;-7.44,-2.92,;-7.44,-4.46,;-8.77,-2.15,;-8.77,-.61,;-10.11,.16,;-7.44,.16,;-6.11,-.61,;-4.77,.16,;-2.11,-2.92,;-2.11,-4.46,;-.77,-2.15,;.56,-2.92,;.56,-4.46,)|

CN(C)[C@H]1CC[C@@H](CC1)[C@]1(C)Oc2c(O1)c(-c1ccncc1)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C |r,wU:9.10,3.2,wD:6.6,(10.3,1.64,;8.9,2.26,;8.74,3.8,;7.65,1.36,;7.81,-.17,;6.57,-1.08,;5.16,-.45,;5,1.08,;6.24,1.99,;4.07,-1.54,;5.16,-2.63,;3.16,-2.79,;1.7,-2.31,;1.7,-.77,;3.16,-.29,;.37,,;.37,1.54,;1.7,2.31,;1.7,3.85,;.37,4.62,;-.97,3.85,;-.97,2.31,;-.97,-.77,;-2.3,,;-3.63,-.77,;-3.63,-2.31,;-4.97,-3.08,;-6.3,-2.31,;-7.64,-3.08,;-7.64,-4.62,;-8.97,-2.31,;-8.97,-.77,;-10.3,,;-7.64,,;-6.3,-.77,;-4.97,,;-2.3,-3.08,;-2.3,-4.62,;-.97,-2.31,;.37,-3.08,;.37,-4.62,)|

CN(C)[C@H]1CC[C@@H](CC1)[C@]1(C)Oc2c(O1)c(-c1ccc(C)o1)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C |r,wU:9.10,3.2,wD:6.6,(10.3,1.37,;8.9,2,;8.74,3.53,;7.65,1.09,;7.81,-.44,;6.57,-1.35,;5.16,-.72,;5,.81,;6.24,1.72,;4.07,-1.81,;5.16,-2.9,;3.16,-3.05,;1.7,-2.58,;1.7,-1.04,;3.16,-.56,;.37,-.27,;.37,1.27,;1.61,2.18,;1.14,3.64,;-.4,3.64,;-1.31,4.89,;-.88,2.18,;-.97,-1.04,;-2.3,-.27,;-3.63,-1.04,;-3.63,-2.58,;-4.97,-3.35,;-6.3,-2.58,;-7.64,-3.35,;-7.64,-4.89,;-8.97,-2.58,;-8.97,-1.04,;-10.3,-.27,;-7.64,-.27,;-6.3,-1.04,;-4.97,-.27,;-2.3,-3.35,;-2.3,-4.89,;-.97,-2.58,;.37,-3.35,;.37,-4.89,)|

CN(C)[C@H]1CC[C@@H](CC1)[C@]1(C)Oc2c(O1)c(-c1cccnc1)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C |r,wU:9.10,3.2,wD:6.6,(10.3,1.64,;8.9,2.26,;8.74,3.8,;7.65,1.36,;7.81,-.17,;6.57,-1.08,;5.16,-.45,;5,1.08,;6.24,1.99,;4.07,-1.54,;5.16,-2.63,;3.16,-2.79,;1.7,-2.31,;1.7,-.77,;3.16,-.29,;.37,,;.37,1.54,;-.97,2.31,;-.97,3.85,;.37,4.62,;1.7,3.85,;1.7,2.31,;-.97,-.77,;-2.3,,;-3.63,-.77,;-3.63,-2.31,;-4.97,-3.08,;-6.3,-2.31,;-7.64,-3.08,;-7.64,-4.62,;-8.97,-2.31,;-8.97,-.77,;-10.3,,;-7.64,,;-6.3,-.77,;-4.97,,;-2.3,-3.08,;-2.3,-4.62,;-.97,-2.31,;.37,-3.08,;.37,-4.62,)|

CN(C)[C@H]1CC[C@@H](CC1)[C@]1(C)Oc2c(O1)c(-c1cccn1C)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C |r,wU:9.10,3.2,wD:6.6,(10.3,1.99,;8.9,2.62,;8.74,4.15,;7.65,1.71,;7.81,.18,;6.57,-.72,;5.16,-.1,;5,1.44,;6.24,2.34,;4.07,-1.18,;5.16,-2.27,;3.16,-2.43,;1.7,-1.95,;1.7,-.41,;3.16,.06,;.37,.36,;.37,1.9,;1.61,2.8,;1.14,4.26,;-.4,4.26,;-.88,2.8,;-2.34,2.32,;-.97,-.41,;-2.3,.36,;-3.63,-.41,;-3.63,-1.95,;-4.97,-2.72,;-6.3,-1.95,;-7.64,-2.72,;-7.64,-4.26,;-8.97,-1.95,;-8.97,-.41,;-10.3,.36,;-7.64,.36,;-6.3,-.41,;-4.97,.36,;-2.3,-2.72,;-2.3,-4.26,;-.97,-1.95,;.37,-2.72,;.37,-4.26,)|

CN(C)[C@H]1CC[C@@H](CC1)[C@]1(C)Oc2c(O1)c(-c1ccsc1)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C |r,wU:9.10,3.2,wD:6.6,(10.3,1.99,;8.9,2.62,;8.74,4.15,;7.65,1.71,;7.81,.18,;6.57,-.72,;5.16,-.1,;5,1.44,;6.24,2.34,;4.07,-1.18,;5.16,-2.27,;3.16,-2.43,;1.7,-1.95,;1.7,-.41,;3.16,.06,;.37,.36,;.37,1.9,;1.61,2.8,;1.14,4.26,;-.4,4.26,;-.88,2.8,;-.97,-.41,;-2.3,.36,;-3.63,-.41,;-3.63,-1.95,;-4.97,-2.72,;-6.3,-1.95,;-7.64,-2.72,;-7.64,-4.26,;-8.97,-1.95,;-8.97,-.41,;-10.3,.36,;-7.64,.36,;-6.3,-.41,;-4.97,.36,;-2.3,-2.72,;-2.3,-4.26,;-.97,-1.95,;.37,-2.72,;.37,-4.26,)|

CN(C)[C@H]1CC[C@@H](CC1)[C@]1(C)Oc2c(O1)c(-c1cncs1)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C |r,wU:9.10,3.2,wD:6.6,(10.3,1.99,;8.9,2.62,;8.74,4.15,;7.65,1.71,;7.81,.18,;6.57,-.72,;5.16,-.1,;5,1.44,;6.24,2.34,;4.07,-1.18,;5.16,-2.27,;3.16,-2.43,;1.7,-1.95,;1.7,-.41,;3.16,.06,;.37,.36,;.37,1.9,;1.61,2.8,;1.14,4.26,;-.4,4.26,;-.88,2.8,;-.97,-.41,;-2.3,.36,;-3.63,-.41,;-3.63,-1.95,;-4.97,-2.72,;-6.3,-1.95,;-7.64,-2.72,;-7.64,-4.26,;-8.97,-1.95,;-8.97,-.41,;-10.3,.36,;-7.64,.36,;-6.3,-.41,;-4.97,.36,;-2.3,-2.72,;-2.3,-4.26,;-.97,-1.95,;.37,-2.72,;.37,-4.26,)|

CN(C)[C@H]1CC[C@@H](CC1)[C@@]1(C)Oc2c(O1)c(C)c(cc2Cl)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:6.6,wD:9.10,3.2,(5.78,-4.8,;4.69,-5.89,;5.09,-7.38,;3.2,-5.49,;2.8,-4.01,;1.32,-3.61,;.23,-4.7,;.63,-6.18,;2.11,-6.58,;-1.26,-4.3,;-2.03,-5.63,;-2.79,-4.14,;-3.11,-2.63,;-1.78,-1.86,;-.63,-2.89,;-1.78,-.32,;-.44,.45,;-3.11,.45,;-4.45,-.32,;-4.45,-1.86,;-5.78,-2.63,;-3.11,1.99,;-4.45,2.76,;-1.78,2.76,;-1.78,4.3,;-.44,5.07,;-.44,6.61,;-1.78,7.38,;.89,7.38,;2.22,6.61,;3.56,7.38,;2.22,5.07,;.89,4.3,;.89,2.76,)|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCC2)nc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCCC2)nc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1ccc(CN2CCC[C@H](O)C2)nc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(OC)nc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1ccc(COC)nc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC(O)C2)c(F)c1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1ccc(cc1)C(=O)NCCO

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCN(C)CC2)nc1

CCN(C1C[C@@H](C)N[C@H](C)C1)c1cc(F)cc(C(=O)NCc2c(C)c(F)c(C)n(C)c2=O)c1C |r|

CCN(C1C[C@@H](C)N[C@H](C)C1)c1cc(F)cc(C(=O)NCc2c(C)cc(C)n(C)c2=O)c1C |r|

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(F)cc(N(CC)C2C[C@@H](C)N[C@H](C)C2)c1C |r|

CCN(C1C[C@@H](C)N[C@H](C)C1)c1cc(F)cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C |r|

CCN(C1C[C@@H](C)N[C@H](C)C1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(C)CC1 |r|

CCN(C1C[C@@H](C)N(C)[C@H](C)C1)c1cc(F)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r|

CCN(C1C[C@@H](C)N[C@H](C)C1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(OC)nc1 |r|

CCN(C1C[C@@H](C)N[C@H](C)C1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCNCC2)nc1 |r|

CCN(C1C[C@@H](C)N[C@H](C)C1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1 |r|

CCN(C1C[C@@H](C)N[C@H](C)C1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(C)CC2)nc1 |r|

CCN(C1C[C@@H](C)N(CC)[C@H](C)C1)c1cc(F)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r|

CCN(C1CCN(C)CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(C)CC1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1cnc(OC)cn1

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCN(C)CC2)nc1 |r,wU:6.9,wD:3.2,(-8.48,1.54,;-7.15,.77,;-5.81,1.54,;-5.81,3.08,;-4.48,3.85,;-4.48,5.39,;-5.81,6.16,;-7.15,5.39,;-7.15,3.85,;-5.81,7.7,;-7.15,8.47,;-4.48,8.47,;-4.48,.77,;-3.15,1.54,;-1.81,.77,;-1.81,-.77,;-3.15,-1.54,;-3.15,-3.08,;-1.81,-3.85,;-4.48,-3.85,;-4.48,-5.39,;-5.81,-6.16,;-5.81,-7.7,;-4.48,-8.47,;-7.15,-8.47,;-8.48,-7.7,;-9.81,-8.47,;-8.48,-6.16,;-7.15,-5.39,;-7.15,-3.85,;-4.48,-.77,;-5.81,-1.54,;-.48,1.54,;.85,.77,;2.19,1.54,;2.19,3.08,;3.52,3.85,;4.86,3.08,;4.98,1.54,;6.25,.68,;7.72,1.14,;8.28,2.58,;9.81,2.7,;7.5,3.91,;5.98,4.13,;.85,3.85,;-.48,3.08,)|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnc(cn1)C(F)(F)F

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnc(OC(C)C)cn1

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1ccc(CN2CC[C@H](O)C2)nc1 |r,wU:6.9,wD:3.2,42.45,(-7.22,2.31,;-5.89,1.54,;-4.55,2.31,;-4.55,3.85,;-3.22,4.62,;-3.22,6.16,;-4.55,6.93,;-5.89,6.16,;-5.89,4.62,;-4.55,8.47,;-5.89,9.24,;-3.22,9.24,;-3.22,1.54,;-1.89,2.31,;-.55,1.54,;-.55,,;-1.89,-.77,;-1.89,-2.31,;-.55,-3.08,;-3.22,-3.08,;-3.22,-4.62,;-4.55,-5.39,;-4.55,-6.93,;-5.89,-7.7,;-7.22,-6.93,;-8.55,-7.7,;-7.22,-5.39,;-5.89,-4.62,;-5.89,-3.08,;-3.22,-7.7,;-1.89,-6.93,;-3.22,-9.24,;-3.22,,;-4.55,-.77,;.78,2.31,;2.12,1.54,;3.45,2.31,;3.45,3.85,;4.78,4.62,;6.12,3.85,;7.52,4.48,;8.55,3.33,;7.78,2,;8.41,.59,;6.28,2.32,;2.12,4.62,;.78,3.85,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)nc1 |r,wU:6.9,wD:3.2,(-7.34,1.54,;-6,.77,;-4.67,1.54,;-4.67,3.08,;-3.33,3.85,;-3.33,5.39,;-4.67,6.16,;-6,5.39,;-6,3.85,;-4.67,7.7,;-6,8.47,;-3.33,8.47,;-3.33,.77,;-2,1.54,;-.67,.77,;-.67,-.77,;-2,-1.54,;-2,-3.08,;-.67,-3.85,;-3.33,-3.85,;-3.33,-5.39,;-4.67,-6.16,;-4.67,-7.7,;-3.33,-8.47,;-6,-8.47,;-7.34,-7.7,;-8.67,-8.47,;-7.34,-6.16,;-6,-5.39,;-6,-3.85,;-3.33,-.77,;-4.67,-1.54,;.67,1.54,;2,.77,;3.33,1.54,;3.33,3.08,;4.67,3.85,;6,3.08,;6,1.54,;7.34,.77,;8.67,1.54,;8.67,3.08,;7.34,3.85,;2,3.85,;.67,3.08,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCC[C@H](O)C2)nc1 |r,wU:6.9,wD:3.2,41.44,(-7.34,1.54,;-6.01,.77,;-4.68,1.54,;-4.68,3.08,;-3.34,3.85,;-3.34,5.39,;-4.68,6.16,;-6.01,5.39,;-6.01,3.85,;-4.68,7.7,;-6.01,8.47,;-3.34,8.47,;-3.34,.77,;-2.01,1.54,;-.68,.77,;-.68,-.77,;-2.01,-1.54,;-2.01,-3.08,;-.68,-3.85,;-3.34,-3.85,;-3.34,-5.39,;-4.68,-6.16,;-4.68,-7.7,;-3.34,-8.47,;-6.01,-8.47,;-7.34,-7.7,;-8.68,-8.47,;-7.34,-6.16,;-6.01,-5.39,;-6.01,-3.85,;-3.34,-.77,;-4.68,-1.54,;.66,1.54,;1.99,.77,;3.33,1.54,;3.33,3.08,;4.66,3.85,;5.99,3.08,;7.34,3.85,;8.68,3.08,;8.68,1.54,;7.34,.77,;7.34,-.77,;6.01,1.54,;1.99,3.85,;.66,3.08,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC[C@H](O)C2)nc1 |r,wU:6.9,wD:3.2,40.43,(-7.22,1.54,;-5.89,.77,;-4.55,1.54,;-4.55,3.08,;-3.22,3.85,;-3.22,5.39,;-4.55,6.16,;-5.89,5.39,;-5.89,3.85,;-4.55,7.7,;-5.89,8.47,;-3.22,8.47,;-3.22,.77,;-1.89,1.54,;-.55,.77,;-.55,-.77,;-1.89,-1.54,;-1.89,-3.08,;-.55,-3.85,;-3.22,-3.85,;-3.22,-5.39,;-4.55,-6.16,;-4.55,-7.7,;-3.22,-8.47,;-5.89,-8.47,;-7.22,-7.7,;-8.55,-8.47,;-7.22,-6.16,;-5.89,-5.39,;-5.89,-3.85,;-3.22,-.77,;-4.55,-1.54,;.78,1.54,;2.12,.77,;3.45,1.54,;3.45,3.08,;4.78,3.85,;6.12,3.08,;7.52,3.71,;8.55,2.56,;7.78,1.23,;8.41,-.18,;6.28,1.55,;2.12,3.85,;.78,3.08,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC(O)C2)nc1 |r,wU:6.9,wD:3.2,(-7.61,1.54,;-6.28,.77,;-4.94,1.54,;-4.94,3.08,;-3.61,3.85,;-3.61,5.39,;-4.94,6.16,;-6.28,5.39,;-6.28,3.85,;-4.94,7.7,;-6.28,8.47,;-3.61,8.47,;-3.61,.77,;-2.28,1.54,;-.94,.77,;-.94,-.77,;-2.28,-1.54,;-2.28,-3.08,;-.94,-3.85,;-3.61,-3.85,;-3.61,-5.39,;-4.94,-6.16,;-4.94,-7.7,;-3.61,-8.47,;-6.28,-8.47,;-7.61,-7.7,;-8.95,-8.47,;-7.61,-6.16,;-6.28,-5.39,;-6.28,-3.85,;-3.61,-.77,;-4.94,-1.54,;.39,1.54,;1.72,.77,;3.06,1.54,;3.06,3.08,;4.39,3.85,;5.73,3.08,;6.12,1.59,;7.61,1.99,;8.95,1.22,;7.21,3.48,;1.72,3.85,;.39,3.08,)|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnc(OC2CN(C)C2)cn1

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(COC)nc1 |r,wU:6.9,wD:3.2,(-6.67,1.54,;-5.33,.77,;-4,1.54,;-4,3.08,;-2.67,3.85,;-2.67,5.39,;-4,6.16,;-5.33,5.39,;-5.33,3.85,;-4,7.7,;-5.33,8.47,;-2.67,8.47,;-2.67,.77,;-1.33,1.54,;,.77,;,-.77,;-1.33,-1.54,;-1.33,-3.08,;,-3.85,;-2.67,-3.85,;-2.67,-5.39,;-4,-6.16,;-4,-7.7,;-2.67,-8.47,;-5.33,-8.47,;-6.67,-7.7,;-8,-8.47,;-6.67,-6.16,;-5.33,-5.39,;-5.33,-3.85,;-2.67,-.77,;-4,-1.54,;1.33,1.54,;2.67,.77,;4,1.54,;4,3.08,;5.33,3.85,;6.67,3.08,;8,3.85,;2.67,3.85,;1.33,3.08,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCC(O)CC1 |r,wU:6.9,wD:3.2,(-7.34,1.54,;-6,.77,;-4.67,1.54,;-4.67,3.08,;-3.33,3.85,;-3.33,5.39,;-4.67,6.16,;-6,5.39,;-6,3.85,;-4.67,7.7,;-6,8.47,;-3.33,8.47,;-3.33,.77,;-2,1.54,;-.67,.77,;-.67,-.77,;-2,-1.54,;-2,-3.08,;-.67,-3.85,;-3.33,-3.85,;-3.33,-5.39,;-4.67,-6.16,;-4.67,-7.7,;-3.33,-8.47,;-6,-8.47,;-7.34,-7.7,;-8.67,-8.47,;-7.34,-6.16,;-6,-5.39,;-6,-3.85,;-3.33,-.77,;-4.67,-1.54,;.67,1.54,;2,.77,;3.33,1.54,;3.33,3.08,;2,3.85,;.67,3.08,;4.67,3.85,;6,3.08,;7.34,3.85,;7.34,5.39,;8.67,6.16,;6,6.16,;4.67,5.39,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CC(O)C1 |r,wU:6.9,wD:3.2,(-6.94,1.54,;-5.61,.77,;-4.28,1.54,;-4.28,3.08,;-2.94,3.85,;-2.94,5.39,;-4.28,6.16,;-5.61,5.39,;-5.61,3.85,;-4.28,7.7,;-5.61,8.47,;-2.94,8.47,;-2.94,.77,;-1.61,1.54,;-.28,.77,;-.28,-.77,;-1.61,-1.54,;-1.61,-3.08,;-.28,-3.85,;-2.94,-3.85,;-2.94,-5.39,;-4.28,-6.16,;-4.28,-7.7,;-2.94,-8.47,;-5.61,-8.47,;-6.94,-7.7,;-8.28,-8.47,;-6.94,-6.16,;-5.61,-5.39,;-5.61,-3.85,;-2.94,-.77,;-4.28,-1.54,;1.06,1.54,;2.39,.77,;3.72,1.54,;3.72,3.08,;2.39,3.85,;1.06,3.08,;5.06,3.85,;6.55,3.45,;6.94,4.94,;8.28,5.71,;5.46,5.34,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnc(cn1)N1CCN(C)CC1 |r,wU:6.9,wD:3.2,(-7.34,1.54,;-6,.77,;-4.67,1.54,;-4.67,3.08,;-3.33,3.85,;-3.33,5.39,;-4.67,6.16,;-6,5.39,;-6,3.85,;-4.67,7.7,;-6,8.47,;-3.33,8.47,;-3.33,.77,;-2,1.54,;-.67,.77,;-.67,-.77,;-2,-1.54,;-2,-3.08,;-.67,-3.85,;-3.33,-3.85,;-3.33,-5.39,;-4.67,-6.16,;-4.67,-7.7,;-3.33,-8.47,;-6,-8.47,;-7.34,-7.7,;-8.67,-8.47,;-7.34,-6.16,;-6,-5.39,;-6,-3.85,;-3.33,-.77,;-4.67,-1.54,;.67,1.54,;.67,3.08,;2,3.85,;3.33,3.08,;3.33,1.54,;2,.77,;4.67,3.85,;6,3.08,;7.34,3.85,;7.34,5.39,;8.67,6.16,;6,6.16,;4.67,5.39,)|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnc(OC2CCN(C)CC2)cn1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C#CCN1CCCCC1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C#CCN1CCCC1

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CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N1CC(C1)C#N |r,wU:29.35,wD:26.28,(6.8,-28.32,;6.8,-26.78,;5.47,-26.01,;4.13,-26.78,;2.8,-26.01,;1.46,-26.78,;2.8,-24.47,;4.13,-23.7,;4.13,-22.16,;5.47,-24.47,;6.8,-23.7,;8.13,-24.47,;9.47,-23.7,;9.47,-22.16,;10.8,-24.47,;10.8,-26.01,;12.13,-26.78,;12.13,-28.32,;13.47,-26.01,;14.93,-26.48,;15.84,-25.24,;16.93,-26.32,;14.93,-23.99,;13.47,-24.47,;12.13,-23.7,;12.13,-22.16,;17.17,-24.47,;18.51,-25.24,;19.84,-24.47,;19.84,-22.93,;18.51,-22.16,;17.17,-22.93,;21.17,-22.16,;22.66,-22.55,;23.41,-20.86,;21.57,-20.67,;24.99,-19.95,;26.57,-19.04,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)N1CC(C1)C#N |r,wU:26.28,29.35,(6.8,-28.32,;6.8,-26.78,;5.47,-26.01,;4.13,-26.78,;2.8,-26.01,;1.46,-26.78,;2.8,-24.47,;4.13,-23.7,;4.13,-22.16,;5.47,-24.47,;6.8,-23.7,;8.13,-24.47,;9.47,-23.7,;9.47,-22.16,;10.8,-24.47,;10.8,-26.01,;12.13,-26.78,;12.13,-28.32,;13.47,-26.01,;14.93,-26.48,;15.84,-25.24,;16.93,-26.32,;14.93,-23.99,;13.47,-24.47,;12.13,-23.7,;12.13,-22.16,;17.17,-24.47,;18.51,-25.24,;19.84,-24.47,;19.84,-22.93,;18.51,-22.16,;17.17,-22.93,;21.17,-22.16,;22.66,-22.55,;23.41,-20.86,;21.57,-20.67,;24.99,-19.95,;26.57,-19.04,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)NCC1(C)COC1 |r,wU:26.28,29.35,(6.67,-27.07,;6.67,-25.53,;5.34,-24.76,;4,-25.53,;2.67,-24.76,;1.33,-25.53,;2.67,-23.22,;4,-22.45,;4,-20.91,;5.34,-23.22,;6.67,-22.45,;8,-23.22,;9.34,-22.45,;9.34,-20.91,;10.67,-23.22,;10.67,-24.76,;12,-25.53,;12,-27.07,;13.34,-24.76,;14.8,-25.24,;15.71,-23.99,;16.8,-25.08,;14.8,-22.74,;13.34,-23.22,;12,-22.45,;12,-20.91,;17.04,-23.22,;18.37,-23.99,;19.71,-23.22,;19.71,-21.68,;18.37,-20.91,;17.04,-21.68,;21.04,-20.91,;22.38,-21.68,;23.71,-20.91,;22.38,-20.14,;24.8,-22,;25.89,-20.91,;24.8,-19.82,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)NCC1(C)COC1 |r,wU:29.35,wD:26.28,(6.67,-27.07,;6.67,-25.53,;5.34,-24.76,;4,-25.53,;2.67,-24.76,;1.33,-25.53,;2.67,-23.22,;4,-22.45,;4,-20.91,;5.34,-23.22,;6.67,-22.45,;8,-23.22,;9.34,-22.45,;9.34,-20.91,;10.67,-23.22,;10.67,-24.76,;12,-25.53,;12,-27.07,;13.34,-24.76,;14.8,-25.24,;15.71,-23.99,;16.8,-25.08,;14.8,-22.74,;13.34,-23.22,;12,-22.45,;12,-20.91,;17.04,-23.22,;18.37,-23.99,;19.71,-23.22,;19.71,-21.68,;18.37,-20.91,;17.04,-21.68,;21.04,-20.91,;22.38,-21.68,;23.71,-20.91,;22.38,-20.14,;24.8,-22,;25.89,-20.91,;24.8,-19.82,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)NC1CC(F)(F)C1 |r,wU:26.28,wD:29.35,(6.57,-23.57,;6.57,-22.03,;5.23,-21.26,;3.9,-22.03,;2.56,-21.26,;1.23,-22.03,;2.56,-19.72,;3.9,-18.95,;3.9,-17.41,;5.23,-19.72,;6.57,-18.95,;7.9,-19.72,;9.23,-18.95,;9.23,-17.41,;10.57,-19.72,;10.57,-21.26,;11.9,-22.03,;11.9,-23.57,;13.23,-21.26,;14.7,-21.73,;15.6,-20.49,;16.69,-21.58,;14.7,-19.24,;13.23,-19.72,;11.9,-18.95,;11.9,-17.41,;16.94,-19.72,;16.94,-18.18,;18.27,-17.41,;19.6,-18.18,;19.6,-19.72,;18.27,-20.49,;20.94,-17.41,;22.27,-18.18,;22.67,-19.67,;24.16,-19.27,;25.7,-19.27,;24.93,-20.6,;23.76,-17.78,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)NC1CC(F)(F)C1 |r,wD:26.28,29.35,(6.56,-23.56,;6.56,-22.02,;5.23,-21.25,;3.89,-22.02,;2.56,-21.25,;1.23,-22.02,;2.56,-19.71,;3.89,-18.94,;3.89,-17.4,;5.23,-19.71,;6.56,-18.94,;7.9,-19.71,;9.23,-18.94,;9.23,-17.4,;10.56,-19.71,;10.56,-21.25,;11.9,-22.02,;11.9,-23.56,;13.23,-21.25,;14.69,-21.73,;15.6,-20.48,;16.69,-21.57,;14.69,-19.24,;13.23,-19.71,;11.9,-18.94,;11.9,-17.4,;16.93,-19.71,;16.93,-18.17,;18.27,-17.4,;19.6,-18.17,;19.6,-19.71,;18.27,-20.48,;20.93,-17.4,;22.27,-18.17,;22.67,-19.66,;24.15,-19.26,;25.69,-19.26,;24.92,-20.6,;23.76,-17.78,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2O[C@](C)(Oc2c1C)C1CCN(CC1)C(=O)C1CC(F)(F)C1 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)NC(=O)C1CC(F)(F)C1 |r,wD:26.28,29.35,(6.39,-31.25,;6.39,-29.71,;5.06,-28.94,;3.73,-29.71,;2.39,-28.94,;1.06,-29.71,;2.39,-27.4,;3.73,-26.63,;3.73,-25.09,;5.06,-27.4,;6.39,-26.63,;7.73,-27.4,;9.06,-26.63,;9.06,-25.09,;10.4,-27.4,;10.4,-28.94,;11.73,-29.71,;11.73,-31.25,;13.06,-28.94,;14.53,-29.42,;15.43,-28.17,;16.52,-29.26,;14.53,-26.93,;13.06,-27.4,;11.73,-26.63,;11.73,-25.09,;16.77,-27.4,;16.77,-25.86,;18.1,-25.09,;19.43,-25.86,;19.43,-27.4,;18.1,-28.17,;20.77,-25.09,;22.1,-25.86,;22.1,-27.4,;23.43,-25.09,;24.92,-25.49,;25.32,-24,;26.86,-24,;26.09,-22.67,;23.83,-23.61,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)NC(=O)C1CC(F)(F)C1 |r,wU:26.28,wD:29.35,(6.39,-31.25,;6.39,-29.71,;5.06,-28.94,;3.73,-29.71,;2.39,-28.94,;1.06,-29.71,;2.39,-27.4,;3.73,-26.63,;3.73,-25.09,;5.06,-27.4,;6.39,-26.63,;7.73,-27.4,;9.06,-26.63,;9.06,-25.09,;10.4,-27.4,;10.4,-28.94,;11.73,-29.71,;11.73,-31.25,;13.06,-28.94,;14.53,-29.42,;15.43,-28.17,;16.52,-29.26,;14.53,-26.93,;13.06,-27.4,;11.73,-26.63,;11.73,-25.09,;16.77,-27.4,;16.77,-25.86,;18.1,-25.09,;19.43,-25.86,;19.43,-27.4,;18.1,-28.17,;20.77,-25.09,;22.1,-25.86,;22.1,-27.4,;23.43,-25.09,;24.92,-25.49,;25.32,-24,;26.86,-24,;26.09,-22.67,;23.83,-23.61,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2O[C@@](C)(Oc2c1C)C1CCN(CC1)C(=O)C1CC1 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CCC(CC1)c1cnn(C)c1 |r,wD:26.28,(7.22,-24.92,;7.22,-23.38,;5.89,-22.61,;4.55,-23.38,;3.22,-22.61,;1.89,-23.38,;3.22,-21.07,;4.55,-20.3,;4.55,-18.76,;5.89,-21.07,;7.22,-20.3,;8.56,-21.07,;9.89,-20.3,;9.89,-18.76,;11.22,-21.07,;11.22,-22.61,;12.56,-23.38,;12.56,-24.92,;13.89,-22.61,;15.35,-23.09,;16.26,-21.84,;17.35,-22.93,;15.35,-20.6,;13.89,-21.07,;12.56,-20.3,;12.56,-18.76,;17.59,-21.07,;18.93,-21.84,;20.26,-21.07,;20.26,-19.53,;18.93,-18.76,;17.59,-19.53,;21.59,-18.76,;23,-19.39,;24.03,-18.24,;23.26,-16.91,;23.89,-15.5,;21.76,-17.23,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CCC(CC1)c1cnn(C)c1 |r,wU:26.28,(7.22,-24.92,;7.22,-23.38,;5.89,-22.61,;4.55,-23.38,;3.22,-22.61,;1.89,-23.38,;3.22,-21.07,;4.55,-20.3,;4.55,-18.76,;5.89,-21.07,;7.22,-20.3,;8.56,-21.07,;9.89,-20.3,;9.89,-18.76,;11.22,-21.07,;11.22,-22.61,;12.56,-23.38,;12.56,-24.92,;13.89,-22.61,;15.35,-23.09,;16.26,-21.84,;17.35,-22.93,;15.35,-20.6,;13.89,-21.07,;12.56,-20.3,;12.56,-18.76,;17.59,-21.07,;17.59,-19.53,;18.93,-18.76,;20.26,-19.53,;20.26,-21.07,;18.93,-21.84,;21.59,-18.76,;23,-19.39,;24.03,-18.24,;23.26,-16.91,;23.89,-15.5,;21.76,-17.23,)|

CO[C@H]1C[C@@H](C1)N[C@H]1CC[C@@H](CC1)C1(C)Oc2c(O1)c(C)c(cc2Cl)C(=O)NCc1c(SC)cc(C)[nH]c1=O |r,wU:7.7,4.6,wD:10.14,2.1,(-.82,-22.62,;-2.15,-23.39,;-3.49,-22.62,;-3.88,-21.14,;-5.37,-21.54,;-4.97,-23.02,;-6.71,-20.77,;-8.04,-21.54,;-8.04,-23.08,;-9.37,-23.85,;-10.71,-23.08,;-10.71,-21.54,;-9.37,-20.77,;-12.04,-23.85,;-10.95,-24.93,;-12.95,-25.09,;-14.41,-24.62,;-14.41,-23.08,;-12.95,-22.6,;-15.74,-22.31,;-15.74,-20.77,;-17.08,-23.08,;-17.08,-24.62,;-15.74,-25.39,;-15.74,-26.93,;-18.41,-22.31,;-18.41,-20.77,;-19.74,-23.08,;-21.08,-22.31,;-22.41,-23.08,;-22.41,-24.62,;-21.08,-25.39,;-21.08,-26.93,;-23.75,-25.39,;-25.08,-24.62,;-26.41,-25.39,;-25.08,-23.08,;-23.75,-22.31,;-23.75,-20.77,)|

CO[C@H]1C[C@@H](C1)N[C@H]1CC[C@H](CC1)C1(C)Oc2c(O1)c(C)c(cc2Cl)C(=O)NCc1c(SC)cc(C)[nH]c1=O |r,wU:10.14,7.7,4.6,wD:2.1,(-.82,-22.62,;-2.15,-23.39,;-3.49,-22.62,;-3.88,-21.14,;-5.37,-21.54,;-4.97,-23.02,;-6.71,-20.77,;-8.04,-21.54,;-8.04,-23.08,;-9.37,-23.85,;-10.71,-23.08,;-10.71,-21.54,;-9.37,-20.77,;-12.04,-23.85,;-10.95,-24.93,;-12.95,-25.09,;-14.41,-24.62,;-14.41,-23.08,;-12.95,-22.6,;-15.74,-22.31,;-15.74,-20.77,;-17.08,-23.08,;-17.08,-24.62,;-15.74,-25.39,;-15.74,-26.93,;-18.41,-22.31,;-18.41,-20.77,;-19.74,-23.08,;-21.08,-22.31,;-22.41,-23.08,;-22.41,-24.62,;-21.08,-25.39,;-21.08,-26.93,;-23.75,-25.39,;-25.08,-24.62,;-26.41,-25.39,;-25.08,-23.08,;-23.75,-22.31,;-23.75,-20.77,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2O[C@](C)(Oc2c1C)C1CCN(CC1)C(=O)C1CC1 |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2O[C@@](C)(Oc2c1C)C1CCN(CC1)C1CC(F)(F)C1 |r|

CNC(=O)N1CCC(CC1)C1(C)Oc2c(O1)c(C)c(cc2Cl)C(=O)NCc1c(SC)cc(C)[nH]c1=O

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC1)S(C)(=O)=O

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)N1CCC2(CNC(=O)C2)C1 |r,wD:26.28,29.35,(7.69,-26.73,;7.69,-25.19,;6.36,-24.42,;5.03,-25.19,;3.69,-24.42,;2.36,-25.19,;3.69,-22.88,;5.03,-22.11,;5.03,-20.57,;6.36,-22.88,;7.69,-22.11,;9.01,-22.88,;10.35,-22.11,;10.35,-20.57,;11.68,-22.88,;11.68,-24.42,;13.01,-25.19,;13.01,-26.73,;14.35,-24.42,;15.81,-24.9,;16.72,-23.65,;18.05,-24.42,;15.81,-22.41,;14.35,-22.88,;13.01,-22.11,;13.01,-20.57,;18.05,-22.88,;18.05,-21.34,;19.39,-20.57,;20.72,-21.34,;20.72,-22.88,;19.39,-23.65,;22.05,-20.57,;22.21,-19.04,;23.72,-18.72,;24.49,-20.06,;25.52,-18.91,;26.93,-19.54,;26.77,-21.07,;27.91,-22.1,;25.26,-21.39,;23.46,-21.2,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC1)C(=O)c1csc(C)n1

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC1)C1CC1

CNS(=O)(=O)N1CCC(CC1)C1(C)Oc2c(O1)c(C)c(cc2Cl)C(=O)NCc1c(SC)cc(C)[nH]c1=O

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC2CC2)CC1

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC2CC(F)(F)C2)CC1

COC(=O)N1CCC(CC1)C1(C)Oc2c(O1)c(C)c(cc2Cl)C(=O)NCc1c(SC)cc(C)[nH]c1=O

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC2(CC2)C#N)CC1

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC2CC2(F)F)CC1

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC2(F)CC2)CC1

COC1CC(C1)N1CCC(CC1)C1(C)Oc2c(O1)c(C)c(cc2Cl)C(=O)NCc1c(SC)cc(C)[nH]c1=O |(12.73,-20.4,;11.4,-19.63,;10.06,-20.4,;9.66,-21.88,;8.18,-21.49,;8.57,-20,;6.84,-22.26,;6.84,-23.8,;5.51,-24.57,;4.17,-23.8,;4.17,-22.26,;5.51,-21.49,;2.84,-24.57,;3.75,-25.81,;1.94,-25.81,;.47,-25.34,;.47,-23.8,;1.94,-23.32,;-.86,-23.03,;-.86,-21.49,;-2.2,-23.8,;-2.2,-25.34,;-.86,-26.11,;-.86,-27.65,;-3.53,-23.03,;-3.53,-21.49,;-4.86,-23.8,;-6.2,-23.03,;-7.53,-23.8,;-7.53,-25.34,;-6.2,-26.11,;-6.2,-27.65,;-8.86,-26.11,;-10.2,-25.34,;-11.53,-26.11,;-10.2,-23.8,;-8.86,-23.03,;-8.86,-21.49,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)N[C@H]1C[C@H](F)C1 |r,wU:33.36,wD:26.28,35.39,29.35,(-8.49,-30.05,;-8.49,-28.51,;-9.83,-27.74,;-11.16,-28.51,;-12.5,-27.74,;-13.83,-28.51,;-12.5,-26.2,;-11.16,-25.43,;-11.16,-23.89,;-9.83,-26.2,;-8.49,-25.43,;-7.16,-26.2,;-5.83,-25.43,;-5.83,-23.89,;-4.49,-26.2,;-4.49,-27.74,;-3.16,-28.51,;-3.16,-30.05,;-1.83,-27.74,;-.36,-28.21,;.54,-26.97,;1.88,-27.74,;-.36,-25.72,;-1.83,-26.2,;-3.16,-25.43,;-3.16,-23.89,;1.88,-26.2,;1.88,-24.66,;3.21,-23.89,;4.54,-24.66,;4.54,-26.2,;3.21,-26.97,;5.88,-23.89,;7.21,-24.66,;8.7,-24.26,;9.1,-25.75,;10.43,-26.52,;7.61,-26.14,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N[C@H]1C[C@H](F)C1 |r,wU:29.35,33.36,wD:26.28,35.39,(-6.68,-36.74,;-6.68,-35.2,;-8.01,-34.43,;-9.34,-35.2,;-10.68,-34.43,;-12.01,-35.2,;-10.68,-32.89,;-9.34,-32.12,;-9.34,-30.58,;-8.01,-32.89,;-6.68,-32.12,;-5.34,-32.89,;-4.01,-32.12,;-4.01,-30.58,;-2.68,-32.89,;-2.68,-34.43,;-1.34,-35.2,;-1.34,-36.74,;-.01,-34.43,;1.46,-34.9,;2.36,-33.66,;3.7,-34.43,;1.46,-32.41,;-.01,-32.89,;-1.34,-32.12,;-1.34,-30.58,;3.7,-32.89,;5.03,-33.66,;6.36,-32.89,;6.36,-31.35,;5.03,-30.58,;3.7,-31.35,;7.7,-30.58,;9.03,-31.35,;10.52,-30.95,;10.92,-32.44,;12.25,-33.21,;9.43,-32.84,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCC(CC1)N(C)C1CC(F)(F)C1 |(-6.3,-25.05,;-6.3,-23.51,;-7.63,-22.74,;-8.97,-23.51,;-10.3,-22.74,;-11.64,-23.51,;-10.3,-21.2,;-8.97,-20.43,;-8.97,-18.89,;-7.63,-21.2,;-6.3,-20.43,;-4.98,-21.2,;-3.65,-20.43,;-3.65,-18.89,;-2.31,-21.2,;-2.31,-22.74,;-.98,-23.51,;-.98,-25.05,;.35,-22.74,;1.82,-23.21,;2.72,-21.97,;4.06,-22.74,;1.82,-20.72,;.35,-21.2,;-.98,-20.43,;-.98,-18.89,;4.06,-21.2,;5.39,-21.97,;6.72,-21.2,;6.72,-19.66,;5.39,-18.89,;4.06,-19.66,;8.06,-18.89,;8.06,-17.35,;9.39,-19.66,;9.79,-21.14,;11.28,-20.75,;12.82,-20.75,;12.05,-22.08,;10.88,-19.26,)|

CNC(=O)N1CC2CCC(C1)C2[C@@]1(C)Oc2c(O1)c(C)c(cc2Cl)C(=O)NCc1c(SC)cc(C)[nH]c1=O |r|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC2CCC2)CC1

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)C1CCN(CC2COC2)CC1

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)c1ccccn1 |r,wU:26.28,wD:29.35,(-6.18,-37.37,;-6.18,-35.83,;-7.51,-35.06,;-8.85,-35.83,;-10.18,-35.06,;-11.51,-35.83,;-10.18,-33.52,;-8.85,-32.75,;-8.85,-31.21,;-7.51,-33.52,;-6.18,-32.75,;-4.84,-33.52,;-3.51,-32.75,;-3.51,-31.21,;-2.18,-33.52,;-2.18,-35.06,;-.84,-35.83,;-.84,-37.37,;.49,-35.06,;1.96,-35.54,;2.86,-34.29,;3.95,-35.38,;1.96,-33.05,;.49,-33.52,;-.84,-32.75,;-.84,-31.21,;3.95,-33.21,;3.55,-31.72,;4.64,-30.63,;6.13,-31.03,;6.53,-32.52,;5.44,-33.6,;7.22,-29.94,;6.82,-28.45,;7.91,-27.36,;9.39,-27.76,;9.79,-29.25,;8.7,-30.34,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)c1ccccn1 |r,wU:26.28,29.35,(-6.18,-37.37,;-6.18,-35.83,;-7.51,-35.06,;-8.85,-35.83,;-10.18,-35.06,;-11.51,-35.83,;-10.18,-33.52,;-8.85,-32.75,;-8.85,-31.21,;-7.51,-33.52,;-6.18,-32.75,;-4.84,-33.52,;-3.51,-32.75,;-3.51,-31.21,;-2.18,-33.52,;-2.18,-35.06,;-.84,-35.83,;-.84,-37.37,;.49,-35.06,;1.96,-35.54,;2.86,-34.29,;3.95,-35.38,;1.96,-33.05,;.49,-33.52,;-.84,-32.75,;-.84,-31.21,;3.95,-33.21,;5.44,-33.6,;6.53,-32.52,;6.13,-31.03,;4.64,-30.63,;3.55,-31.72,;7.22,-29.94,;6.82,-28.45,;7.91,-27.36,;9.39,-27.76,;9.79,-29.25,;8.7,-30.34,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@H](CNC2CC(F)(F)C2)CC1 |r,wU:26.28,wD:29.32,(-7.47,-18.93,;-7.47,-17.39,;-8.8,-16.62,;-10.13,-17.39,;-11.47,-16.62,;-12.8,-17.39,;-11.47,-15.08,;-10.13,-14.31,;-10.13,-12.77,;-8.8,-15.08,;-7.47,-14.31,;-6.13,-15.08,;-4.8,-14.31,;-4.8,-12.77,;-3.47,-15.08,;-3.47,-16.62,;-2.13,-17.39,;-2.13,-18.93,;-.8,-16.62,;.67,-17.1,;1.57,-15.85,;2.91,-16.62,;.67,-14.61,;-.8,-15.08,;-2.13,-14.31,;-2.13,-12.77,;2.91,-15.08,;2.91,-13.54,;4.24,-12.77,;5.57,-13.54,;6.91,-12.77,;8.24,-13.54,;9.57,-12.77,;11.06,-13.17,;11.46,-11.69,;13,-11.69,;12.23,-10.35,;9.97,-11.29,;5.57,-15.08,;4.24,-15.85,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@H](CNC2CC(F)(F)C2)CC1 |r,wU:26.28,29.32,(-7.47,-18.93,;-7.47,-17.39,;-8.8,-16.62,;-10.13,-17.39,;-11.47,-16.62,;-12.8,-17.39,;-11.47,-15.08,;-10.13,-14.31,;-10.13,-12.77,;-8.8,-15.08,;-7.47,-14.31,;-6.13,-15.08,;-4.8,-14.31,;-4.8,-12.77,;-3.47,-15.08,;-3.47,-16.62,;-2.13,-17.39,;-2.13,-18.93,;-.8,-16.62,;.67,-17.1,;1.57,-15.85,;2.91,-16.62,;.67,-14.61,;-.8,-15.08,;-2.13,-14.31,;-2.13,-12.77,;2.91,-15.08,;4.24,-15.85,;5.57,-15.08,;5.57,-13.54,;6.91,-12.77,;8.24,-13.54,;9.57,-12.77,;11.06,-13.17,;11.46,-11.69,;13,-11.69,;12.23,-10.35,;9.97,-11.29,;4.24,-12.77,;2.91,-13.54,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N[C@@H]1C[C@H](F)C1 |r,wU:26.28,wD:29.35,33.36,35.39,(-16.15,-22.58,;-16.15,-21.04,;-17.49,-20.27,;-18.82,-21.04,;-20.16,-20.27,;-21.49,-21.04,;-20.16,-18.73,;-18.82,-17.96,;-18.82,-16.42,;-17.49,-18.73,;-16.15,-17.96,;-14.82,-18.73,;-13.49,-17.96,;-13.49,-16.42,;-12.15,-18.73,;-12.15,-20.27,;-10.82,-21.04,;-10.82,-22.58,;-9.49,-20.27,;-8.02,-20.74,;-7.12,-19.5,;-5.78,-20.27,;-8.02,-18.25,;-9.49,-18.73,;-10.82,-17.96,;-10.82,-16.42,;-5.78,-18.73,;-5.78,-17.19,;-4.45,-16.42,;-3.12,-17.19,;-3.12,-18.73,;-4.45,-19.5,;-1.78,-16.42,;-.45,-17.19,;1.04,-16.79,;1.44,-18.28,;2.77,-19.05,;-.05,-18.68,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)N[C@@H]1C[C@H](F)C1 |r,wU:26.28,29.35,wD:33.36,35.39,(-16.15,-22.58,;-16.15,-21.04,;-17.49,-20.27,;-18.82,-21.04,;-20.16,-20.27,;-21.49,-21.04,;-20.16,-18.73,;-18.82,-17.96,;-18.82,-16.42,;-17.49,-18.73,;-16.15,-17.96,;-14.82,-18.73,;-13.49,-17.96,;-13.49,-16.42,;-12.15,-18.73,;-12.15,-20.27,;-10.82,-21.04,;-10.82,-22.58,;-9.49,-20.27,;-8.02,-20.74,;-7.12,-19.5,;-5.78,-20.27,;-8.02,-18.25,;-9.49,-18.73,;-10.82,-17.96,;-10.82,-16.42,;-5.78,-18.73,;-4.45,-19.5,;-3.12,-18.73,;-3.12,-17.19,;-4.45,-16.42,;-5.78,-17.19,;-1.78,-16.42,;-.45,-17.19,;1.04,-16.79,;1.44,-18.28,;2.77,-19.05,;-.05,-18.68,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N1CC2CN(C)CC2C1 |r,wU:26.28,wD:29.35,(-9.14,-19.26,;-9.14,-17.72,;-10.48,-16.95,;-11.81,-17.72,;-13.15,-16.95,;-14.48,-17.72,;-13.15,-15.41,;-11.81,-14.64,;-11.81,-13.1,;-10.48,-15.41,;-9.14,-14.64,;-7.81,-15.41,;-6.48,-14.64,;-6.48,-13.1,;-5.14,-15.41,;-5.14,-16.95,;-3.81,-17.72,;-3.81,-19.26,;-2.48,-16.95,;-1.01,-17.43,;-.11,-16.18,;.98,-17.27,;-1.01,-14.94,;-2.48,-15.41,;-3.81,-14.64,;-3.81,-13.1,;1.23,-15.41,;1.23,-13.87,;2.56,-13.1,;3.89,-13.87,;3.89,-15.41,;2.56,-16.18,;5.23,-13.1,;6.64,-13.73,;7.67,-12.59,;9.17,-12.27,;9.33,-10.73,;10.67,-9.96,;7.93,-10.11,;6.9,-11.25,;5.39,-11.57,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)N1CC2CN(C)CC2C1 |r,wU:26.28,29.35,(-9.14,-19.26,;-9.14,-17.72,;-10.48,-16.95,;-11.81,-17.72,;-13.15,-16.95,;-14.48,-17.72,;-13.15,-15.41,;-11.81,-14.64,;-11.81,-13.1,;-10.48,-15.41,;-9.14,-14.64,;-7.81,-15.41,;-6.48,-14.64,;-6.48,-13.1,;-5.14,-15.41,;-5.14,-16.95,;-3.81,-17.72,;-3.81,-19.26,;-2.48,-16.95,;-1.01,-17.43,;-.11,-16.18,;.98,-17.27,;-1.01,-14.94,;-2.48,-15.41,;-3.81,-14.64,;-3.81,-13.1,;1.23,-15.41,;2.56,-16.18,;3.89,-15.41,;3.89,-13.87,;2.56,-13.1,;1.23,-13.87,;5.23,-13.1,;6.64,-13.73,;7.67,-12.59,;9.17,-12.27,;9.33,-10.73,;10.67,-9.96,;7.93,-10.11,;6.9,-11.25,;5.39,-11.57,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N1CC(C1)N1CCCC1 |r,wU:29.35,wD:26.28,(-5.2,-36.99,;-5.2,-35.45,;-6.53,-34.68,;-7.87,-35.45,;-9.2,-34.68,;-10.53,-35.45,;-9.2,-33.14,;-7.87,-32.37,;-7.87,-30.83,;-6.53,-33.14,;-5.2,-32.37,;-3.87,-33.14,;-2.53,-32.37,;-2.53,-30.83,;-1.2,-33.14,;-1.2,-34.68,;.14,-35.45,;.14,-36.99,;1.47,-34.68,;2.93,-35.16,;3.84,-33.91,;4.93,-35,;2.93,-32.66,;1.47,-33.14,;.14,-32.37,;.14,-30.83,;5.17,-33.14,;6.51,-33.91,;7.84,-33.14,;7.84,-31.6,;6.51,-30.83,;5.17,-31.6,;9.17,-30.83,;10.66,-31.23,;11.06,-29.74,;9.57,-29.34,;12.39,-28.97,;13.8,-29.6,;14.83,-28.45,;14.06,-27.12,;12.55,-27.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)N1CC(C1)N1CCCC1 |r,wU:26.28,29.35,(-5.2,-36.99,;-5.2,-35.45,;-6.53,-34.68,;-7.87,-35.45,;-9.2,-34.68,;-10.53,-35.45,;-9.2,-33.14,;-7.87,-32.37,;-7.87,-30.83,;-6.53,-33.14,;-5.2,-32.37,;-3.87,-33.14,;-2.53,-32.37,;-2.53,-30.83,;-1.2,-33.14,;-1.2,-34.68,;.13,-35.45,;.13,-36.99,;1.47,-34.68,;2.93,-35.15,;3.84,-33.91,;4.93,-34.99,;2.93,-32.66,;1.47,-33.14,;.13,-32.37,;.13,-30.83,;5.17,-33.14,;6.51,-33.91,;7.84,-33.14,;7.84,-31.6,;6.51,-30.83,;5.17,-31.6,;9.17,-30.83,;10.66,-31.22,;11.06,-29.74,;9.57,-29.34,;12.39,-28.97,;13.8,-29.59,;14.83,-28.45,;14.06,-27.12,;12.55,-27.44,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)NC1CC(F)(F)C1 |r,wU:29.35,wD:26.28,(-6.57,-12.84,;-6.57,-11.3,;-7.91,-10.53,;-9.24,-11.3,;-10.58,-10.53,;-11.91,-11.3,;-10.58,-8.99,;-9.24,-8.22,;-9.24,-6.68,;-7.91,-8.99,;-6.57,-8.22,;-5.24,-8.99,;-3.91,-8.22,;-3.91,-6.68,;-2.57,-8.99,;-2.57,-10.53,;-1.24,-11.3,;-1.24,-12.84,;.09,-10.53,;1.56,-11.01,;2.46,-9.76,;3.55,-10.85,;1.56,-8.51,;.09,-8.99,;-1.24,-8.22,;-1.24,-6.68,;3.8,-8.99,;5.13,-9.76,;6.46,-8.99,;6.46,-7.45,;5.13,-6.68,;3.8,-7.45,;7.8,-6.68,;9.13,-7.45,;9.53,-8.94,;11.02,-8.54,;12.56,-8.54,;11.79,-9.87,;10.62,-7.05,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)NC1CC(F)(F)C1 |r,wU:26.28,29.35,(-6.57,-12.84,;-6.57,-11.3,;-7.91,-10.53,;-9.24,-11.3,;-10.58,-10.53,;-11.91,-11.3,;-10.58,-8.99,;-9.24,-8.22,;-9.24,-6.68,;-7.91,-8.99,;-6.57,-8.22,;-5.24,-8.99,;-3.91,-8.22,;-3.91,-6.68,;-2.57,-8.99,;-2.57,-10.53,;-1.24,-11.3,;-1.24,-12.84,;.09,-10.53,;1.56,-11.01,;2.46,-9.76,;3.55,-10.85,;1.56,-8.51,;.09,-8.99,;-1.24,-8.22,;-1.24,-6.68,;3.8,-8.99,;5.13,-9.76,;6.46,-8.99,;6.46,-7.45,;5.13,-6.68,;3.8,-7.45,;7.8,-6.68,;9.13,-7.45,;9.53,-8.94,;11.02,-8.54,;12.56,-8.54,;11.79,-9.87,;10.62,-7.05,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N[C@H]1C[C@H](O)C1 |r,wU:26.28,33.36,wD:29.35,35.39,(-6.8,22.49,;-6.8,24.03,;-8.13,24.8,;-9.46,24.03,;-10.8,24.8,;-12.13,24.03,;-10.8,26.34,;-9.46,27.11,;-9.46,28.65,;-8.13,26.34,;-6.8,27.11,;-5.46,26.34,;-4.13,27.11,;-4.13,28.65,;-2.79,26.34,;-2.79,24.8,;-1.46,24.03,;-1.46,22.49,;-.13,24.8,;1.34,24.32,;2.24,25.57,;3.58,24.8,;1.34,26.81,;-.13,26.34,;-1.46,27.11,;-1.46,28.65,;3.58,26.34,;3.58,27.88,;4.91,28.65,;6.24,27.88,;6.24,26.34,;4.91,25.57,;7.58,28.65,;8.91,27.88,;10.4,28.27,;10.8,26.79,;12.13,26.02,;9.31,26.39,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)N[C@H]1C[C@H](O)C1 |r,wU:26.28,29.35,33.36,wD:35.39,(-6.8,22.49,;-6.8,24.03,;-8.13,24.8,;-9.46,24.03,;-10.8,24.8,;-12.13,24.03,;-10.8,26.34,;-9.46,27.11,;-9.46,28.65,;-8.13,26.34,;-6.8,27.11,;-5.46,26.34,;-4.13,27.11,;-4.13,28.65,;-2.79,26.34,;-2.79,24.8,;-1.46,24.03,;-1.46,22.49,;-.13,24.8,;1.34,24.32,;2.24,25.57,;3.58,24.8,;1.34,26.81,;-.13,26.34,;-1.46,27.11,;-1.46,28.65,;3.58,26.34,;4.91,25.57,;6.24,26.34,;6.24,27.88,;4.91,28.65,;3.58,27.88,;7.58,28.65,;8.91,27.88,;10.4,28.27,;10.8,26.79,;12.13,26.02,;9.31,26.39,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)C(=O)N1CC(F)(F)C1 |r,wU:29.35,wD:26.28,(-6.86,-17.49,;-6.86,-15.95,;-8.2,-15.18,;-9.53,-15.95,;-10.86,-15.18,;-12.2,-15.95,;-10.86,-13.64,;-9.53,-12.87,;-9.53,-11.33,;-8.2,-13.64,;-6.86,-12.87,;-5.53,-13.64,;-4.2,-12.87,;-4.2,-11.33,;-2.86,-13.64,;-2.86,-15.18,;-1.53,-15.95,;-1.53,-17.49,;-.2,-15.18,;1.27,-15.66,;2.17,-14.41,;3.51,-15.18,;1.27,-13.16,;-.2,-13.64,;-1.53,-12.87,;-1.53,-11.33,;3.51,-13.64,;4.84,-14.41,;6.18,-13.64,;6.18,-12.1,;4.84,-11.33,;3.51,-12.1,;7.51,-11.33,;7.51,-9.79,;8.84,-12.1,;9.24,-13.59,;10.73,-13.19,;12.27,-13.19,;11.5,-14.52,;10.33,-11.7,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)C(=O)N1CC(F)(F)C1 |r,wU:26.28,29.35,(-6.86,-17.49,;-6.86,-15.95,;-8.2,-15.18,;-9.53,-15.95,;-10.86,-15.18,;-12.2,-15.95,;-10.86,-13.64,;-9.53,-12.87,;-9.53,-11.33,;-8.2,-13.64,;-6.86,-12.87,;-5.53,-13.64,;-4.2,-12.87,;-4.2,-11.33,;-2.86,-13.64,;-2.86,-15.18,;-1.53,-15.95,;-1.53,-17.49,;-.2,-15.18,;1.27,-15.66,;2.17,-14.41,;3.51,-15.18,;1.27,-13.17,;-.2,-13.64,;-1.53,-12.87,;-1.53,-11.33,;3.51,-13.64,;4.84,-14.41,;6.18,-13.64,;6.18,-12.1,;4.84,-11.33,;3.51,-12.1,;7.51,-11.33,;7.51,-9.79,;8.84,-12.1,;9.24,-13.59,;10.73,-13.19,;12.27,-13.19,;11.5,-14.52,;10.33,-11.7,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)N1CC[Si](C)(C)CC1 |r,wD:26.28,29.35,(-19.84,-4.8,;-19.84,-3.26,;-21.17,-2.49,;-22.51,-3.26,;-23.84,-2.49,;-25.18,-3.26,;-23.84,-.95,;-22.51,-.18,;-22.51,1.36,;-21.17,-.95,;-19.84,-.18,;-18.51,-.95,;-17.17,-.18,;-17.17,1.36,;-15.84,-.95,;-15.84,-2.49,;-14.51,-3.26,;-14.51,-4.8,;-13.17,-2.49,;-11.71,-2.97,;-10.8,-1.72,;-9.87,-2.78,;-11.71,-.48,;-13.17,-.95,;-14.51,-.18,;-14.51,1.36,;-9.47,-.95,;-9.47,.59,;-8.14,1.36,;-6.8,.59,;-6.8,-.95,;-8.14,-1.72,;-5.47,1.36,;-5.47,2.9,;-4.13,3.67,;-2.8,2.9,;-1.47,3.67,;-2.8,4.44,;-2.8,1.36,;-4.13,.59,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N1CC[Si](C)(C)CC1 |r,wU:29.35,wD:26.28,(5.74,-4.62,;5.74,-3.08,;4.41,-2.31,;3.07,-3.08,;1.74,-2.31,;.41,-3.08,;1.74,-.77,;3.07,,;3.07,1.54,;4.41,-.77,;5.74,,;7.07,-.77,;8.41,,;8.41,1.54,;9.74,-.77,;9.74,-2.31,;11.07,-3.08,;11.07,-4.62,;12.41,-2.31,;13.87,-2.79,;14.78,-1.54,;15.73,-2.58,;13.87,-.29,;12.41,-.77,;11.07,,;11.07,1.54,;16.11,-.77,;17.45,-1.54,;18.78,-.77,;18.78,.77,;17.45,1.54,;16.11,.77,;20.11,1.54,;20.11,3.08,;21.45,3.85,;22.78,3.08,;24.11,3.85,;22.78,4.62,;22.78,1.54,;21.45,.77,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N[C@H]1C[C@H](F)C1 |r,wU:29.35,33.36,wD:26.28,35.39,(1.04,-17.42,;1.04,-15.88,;-.3,-15.11,;-1.63,-15.88,;-2.96,-15.11,;-4.3,-15.88,;-2.96,-13.57,;-1.63,-12.8,;-1.63,-11.26,;-.3,-13.57,;1.04,-12.8,;2.37,-13.57,;3.7,-12.8,;3.7,-11.26,;5.04,-13.57,;5.04,-15.11,;6.37,-15.88,;6.37,-17.42,;7.7,-15.11,;9.17,-15.59,;10.07,-14.34,;11.41,-15.11,;9.17,-13.1,;7.7,-13.57,;6.37,-12.8,;6.37,-11.26,;11.41,-13.57,;12.74,-14.34,;14.08,-13.57,;14.08,-12.03,;12.74,-11.26,;11.41,-12.03,;15.41,-11.26,;16.74,-12.03,;18.23,-11.63,;18.63,-13.12,;19.96,-13.89,;17.14,-13.52,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@H](CN2CCOCC2)CC1 |r,wU:29.32,wD:26.28,(-5.9,-26.5,;-5.9,-24.96,;-7.23,-24.19,;-8.57,-24.96,;-9.9,-24.19,;-11.24,-24.96,;-9.9,-22.65,;-8.57,-21.88,;-8.57,-20.34,;-7.23,-22.65,;-5.9,-21.88,;-4.57,-22.65,;-3.23,-21.88,;-3.23,-20.34,;-1.9,-22.65,;-1.9,-24.19,;-.57,-24.96,;-.57,-26.5,;.77,-24.19,;2.23,-24.66,;3.14,-23.42,;4.47,-24.19,;2.23,-22.17,;.77,-22.65,;-.57,-21.88,;-.57,-20.34,;4.47,-22.65,;5.8,-23.42,;7.14,-22.65,;7.14,-21.11,;8.47,-20.34,;9.81,-21.11,;9.81,-22.65,;11.14,-23.42,;12.47,-22.65,;12.47,-21.11,;11.14,-20.34,;5.8,-20.34,;4.47,-21.11,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@H](CN2CCOCC2)CC1 |r,wU:26.28,29.32,(-5.9,-26.5,;-5.9,-24.96,;-7.23,-24.19,;-8.57,-24.96,;-9.9,-24.19,;-11.24,-24.96,;-9.9,-22.65,;-8.57,-21.88,;-8.57,-20.34,;-7.23,-22.65,;-5.9,-21.88,;-4.57,-22.65,;-3.23,-21.88,;-3.23,-20.34,;-1.9,-22.65,;-1.9,-24.19,;-.57,-24.96,;-.57,-26.5,;.77,-24.19,;2.23,-24.66,;3.14,-23.42,;4.47,-24.19,;2.23,-22.17,;.77,-22.65,;-.57,-21.88,;-.57,-20.34,;4.47,-22.65,;5.8,-23.42,;7.14,-22.65,;7.14,-21.11,;8.47,-20.34,;9.81,-21.11,;9.81,-22.65,;11.14,-23.42,;12.47,-22.65,;12.47,-21.11,;11.14,-20.34,;5.8,-20.34,;4.47,-21.11,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)NC1COC1 |r,wU:26.28,29.35,(14.26,6.69,;12.93,5.92,;12.93,4.38,;14.26,3.61,;14.26,2.07,;15.59,1.3,;12.93,1.3,;11.59,2.07,;10.26,1.3,;11.59,3.61,;10.26,4.38,;8.93,3.61,;7.59,4.38,;7.59,5.92,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;3.59,2.07,;2.13,1.6,;1.22,2.84,;.08,3.87,;2.13,4.09,;3.59,3.61,;4.92,4.38,;4.92,5.92,;.08,1.81,;-1.39,2.29,;-2.53,1.26,;-2.21,-.25,;-.75,-.72,;.4,.31,;-3.36,-1.28,;-4.82,-.8,;-6.19,-1.5,;-6.89,-.13,;-5.52,.57,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)NC1COC1 |r,wU:29.35,wD:26.28,(14.26,6.69,;12.93,5.92,;12.93,4.38,;14.26,3.61,;14.26,2.07,;15.59,1.3,;12.93,1.3,;11.59,2.07,;10.26,1.3,;11.59,3.61,;10.26,4.38,;8.93,3.61,;7.59,4.38,;7.59,5.92,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;3.59,2.07,;2.13,1.6,;1.22,2.84,;.08,3.87,;2.13,4.09,;3.59,3.61,;4.92,4.38,;4.92,5.92,;.08,1.81,;-1.39,2.29,;-2.53,1.26,;-2.21,-.25,;-.75,-.72,;.4,.31,;-3.36,-1.28,;-4.82,-.8,;-6.19,-1.5,;-6.89,-.13,;-5.52,.57,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)N1CC2COCC2C1 |r,wU:29.35,wD:26.28,(-6.03,-23.5,;-6.03,-21.96,;-7.36,-21.19,;-8.7,-21.96,;-10.03,-21.19,;-11.36,-21.96,;-10.03,-19.65,;-8.7,-18.88,;-8.7,-17.34,;-7.36,-19.65,;-6.03,-18.88,;-4.7,-19.65,;-3.36,-18.88,;-3.36,-17.34,;-2.03,-19.65,;-2.03,-21.19,;-.69,-21.96,;-.69,-23.5,;.64,-21.19,;2.1,-21.67,;3.01,-20.42,;4.34,-21.19,;2.1,-19.18,;.64,-19.65,;-.69,-18.88,;-.69,-17.34,;4.34,-19.65,;5.68,-20.42,;7.01,-19.65,;7.01,-18.11,;5.68,-17.34,;4.34,-18.11,;8.34,-17.34,;9.81,-17.82,;10.71,-16.57,;12.18,-16.09,;12.18,-14.55,;10.71,-14.08,;9.81,-15.32,;8.34,-15.8,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)N1CC2COCC2C1 |r,wU:26.28,29.35,(-6.03,-23.5,;-6.03,-21.96,;-7.36,-21.19,;-8.7,-21.96,;-10.03,-21.19,;-11.36,-21.96,;-10.03,-19.66,;-8.7,-18.89,;-8.7,-17.35,;-7.36,-19.66,;-6.03,-18.89,;-4.7,-19.66,;-3.36,-18.89,;-3.36,-17.35,;-2.03,-19.66,;-2.03,-21.2,;-.69,-21.97,;-.69,-23.51,;.64,-21.2,;2.1,-21.67,;3.01,-20.43,;4.34,-21.2,;2.1,-19.18,;.64,-19.66,;-.69,-18.89,;-.69,-17.35,;4.34,-19.66,;5.68,-20.42,;7.01,-19.66,;7.01,-18.12,;5.68,-17.35,;4.34,-18.12,;8.34,-17.35,;9.81,-17.82,;10.71,-16.58,;12.18,-16.1,;12.18,-14.56,;10.71,-14.08,;9.81,-15.33,;8.34,-15.81,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@H]1CC[C@@H](CC1)NC1COC1 |r,wU:26.28,wD:29.35,(-8.52,-6.52,;-8.52,-4.98,;-9.85,-4.21,;-11.19,-4.98,;-12.52,-4.21,;-13.85,-4.98,;-12.52,-2.67,;-11.19,-1.9,;-11.19,-.36,;-9.85,-2.67,;-8.52,-1.9,;-7.19,-2.67,;-5.85,-1.9,;-5.85,-.36,;-4.52,-2.67,;-4.52,-4.21,;-3.19,-4.98,;-3.19,-6.52,;-1.85,-4.21,;-.39,-4.68,;.52,-3.44,;1.85,-4.21,;-.39,-2.19,;-1.85,-2.67,;-3.19,-1.9,;-3.19,-.36,;1.85,-2.67,;1.85,-1.13,;3.19,-.36,;4.52,-1.13,;4.52,-2.67,;3.19,-3.44,;5.85,-.36,;7.19,-1.13,;7.59,-2.62,;9.07,-2.22,;8.67,-.73,)|

CSc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)c2OC(C)(Oc2c1C)[C@@H]1CC[C@@H](CC1)NC1COC1 |r,wU:26.28,29.35,(-8.52,-6.52,;-8.52,-4.98,;-9.85,-4.21,;-11.19,-4.98,;-12.52,-4.21,;-13.85,-4.98,;-12.52,-2.67,;-11.19,-1.9,;-11.19,-.36,;-9.85,-2.67,;-8.52,-1.9,;-7.19,-2.67,;-5.85,-1.9,;-5.85,-.36,;-4.52,-2.67,;-4.52,-4.21,;-3.19,-4.98,;-3.19,-6.52,;-1.85,-4.21,;-.39,-4.68,;.52,-3.44,;1.85,-4.21,;-.39,-2.19,;-1.85,-2.67,;-3.19,-1.9,;-3.19,-.36,;1.85,-2.67,;3.19,-3.44,;4.52,-2.67,;4.52,-1.13,;3.19,-.36,;1.85,-1.13,;5.85,-.36,;7.19,-1.13,;7.59,-2.62,;9.07,-2.22,;8.67,-.73,)|

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2)cc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(COc2ccccc2)cc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(OCc2ccccc2)cc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Sc2ccccc2)cc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(cc1)[S+]([O-])c1ccccc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(cc1)S(=O)(=O)c1ccccc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(cc1)C(=O)c1ccccc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(cc1)C(O)c1ccccc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Nc2ccccc2)cc1

CN(c1ccccc1)c1ccc(cc1)C(=O)NC1CC(C)(C)NC(C)(C)C1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Cc2ccccc2)cc1

CC(c1ccccc1)c1ccc(cc1)C(=O)NC1CC(C)(C)NC(C)(C)C1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(cc1)C1(CC1)c1ccccc1

Cc1ccccc1Oc1ccc(cc1)C(=O)NC1CC(C)(C)NC(C)(C)C1

Cc1cccc(Oc2ccc(cc2)C(=O)NC2CC(C)(C)NC(C)(C)C2)c1

Cc1ccc(Oc2ccc(cc2)C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2Cl)cc1

COc1ccccc1Oc1ccc(cc1)C(=O)NC1CC(C)(C)NC(C)(C)C1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2OCc2ccccc2)cc1

CC(C)(C)c1ccccc1Oc1ccc(cc1)C(=O)NC1CC(C)(C)NC(C)(C)C1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2C#C)cc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2C#N)cc1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2C#N)cc1F

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2C#N)cc1Cl

COc1cc(Oc2ccccc2C#N)ccc1C(=O)NC1CC(C)(C)NC(C)(C)C1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2C#N)c2ccccc12

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2C#N)c(F)c1

Cc1cc(ccc1Oc1ccccc1C#N)C(=O)NC1CC(C)(C)NC(C)(C)C1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2C#N)c(c1)C#N

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2C#N)c(c1)C1CC1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2ccccc2C#N)c(Br)c1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1cc(F)c(Oc2ccccc2C#N)c(Br)c1

Cc1cc(cc(C)c1Oc1ccccc1C#N)C(=O)NC1CC(C)(C)NC(C)(C)C1

Cc1cccc(Oc2ccc(cc2Cl)C(=O)NC2CC(C)(C)NC(C)(C)C2)c1C#N

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2cccc(Cl)c2C#N)c(Cl)c1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2cccc(-c3cn[nH]c3)c2C#N)c(Cl)c1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2cccc(-c3ccncc3)c2C#N)c(Cl)c1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2cccc(-c3ccnnc3)c2C#N)c(Cl)c1

CC1(C)CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2cccc(-c3ccncn3)c2C#N)c(Cl)c1

CC1(C)CC(CC(C)(C)N1CCO)NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1

CC1(C)CC(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)C(F)(F)C(C)(C)N1

CC1(C)CC(CC(C)(C)O1)NC(=O)c1ccc(Oc2cccc(-c3ccnnc3)c2C#N)c(Cl)c1

CC1CC(CC(C)(C)N1)NC(=O)c1ccc(Oc2cccc(-c3ccnnc3)c2C#N)c(Cl)c1

CC1CC(CC(C)N1)NC(=O)c1ccc(Oc2cccc(-c3ccnnc3)c2C#N)c(Cl)c1

CC1(C)CC(CC(C)(C)N1)OC(=O)c1ccc(Oc2cccc(-c3ccnnc3)c2C#N)c(Cl)c1

CC1(C)CC(COc2ccc(Oc3cccc(-c4ccncn4)c3C#N)c(Cl)c2)CC(C)(C)N1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccnc(c1)N1CCN(C)CC1

CC(C)n1ncc2c(cc(cc12)-c1ccc(nc1)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc2CC\C=C\Cc3c(O[C@H]4CC[C@H](N)CC4)cc(Cl)cc3C(=O)NCc2c(=O)[nH]1 |r,wU:12.11,wD:15.15,t:6,(6.34,-.86,;5.12,-.66,;4.14,-1.85,;2.63,-1.6,;1.78,-2.88,;.28,-3.15,;-.93,-2.21,;-.84,-.68,;-2.18,.02,;-2.72,1.46,;-4.26,1.53,;-5.09,.23,;-6.63,.31,;-7.46,-.99,;-9,-.91,;-9.7,.46,;-10.93,.52,;-8.87,1.75,;-7.33,1.68,;-4.97,2.9,;-4.14,4.19,;-4.7,5.29,;-2.6,4.13,;-1.89,2.76,;-.34,2.93,;.08,4.09,;.77,1.82,;.59,.29,;2.08,-.15,;3.06,1.04,;2.63,2.19,;4.58,.78,)|

CCN(C1CCNCC1)c1cccc2c1C\C=C\CCc1cc(C)[nH]c(=O)c1CNC2=O |t:18|

CCN(C1CCOCC1)c1cccc2c1CCCCCCc1cc(C)[nH]c(=O)c1CNC2=O

CN(C)[C@H]1CC[C@@H](CC1)Oc1cc(Cl)cc2c1C\C=C\CCCc1cc(C)[nH]c(=O)c1CNC2=O |r,wU:6.9,wD:3.2,t:20,(-10.79,-6.94,;-9.75,-7.55,;-9.76,-8.76,;-8.44,-6.81,;-7.14,-7.56,;-5.83,-6.81,;-5.82,-5.31,;-7.13,-4.55,;-8.44,-5.3,;-4.52,-4.55,;-4.51,-3.05,;-5.85,-2.26,;-5.85,-.72,;-6.89,-.12,;-4.51,.04,;-3.18,-.72,;-3.18,-2.26,;-1.83,-3.05,;-.46,-2.25,;.86,-3.03,;2.2,-2.25,;2.2,-.71,;3.56,.07,;3.56,1.61,;4.91,2.38,;4.91,3.93,;5.95,4.54,;3.56,4.7,;2.22,3.93,;1.18,4.53,;2.22,2.38,;.86,1.6,;.12,-.35,;-1.81,.05,;-2,1.24,)|

CCCCNC(=O)[C@@H](N)CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|

CCCCNC(=O)C(N)CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|

N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)NCc1cc([nH]n1)-c1ccccc1 |r|

Cn1nc(CNC(=O)[C@@H](N)CCSC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cc1C1CCC1 |r|

N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)NCc1cc2CN(Cc3ccccc3)CCn2n1 |r|

CN1CCn2nc(CNC(=O)[C@@H](N)CCSC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)cc2C1 |r|

N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)NCc1cnn(c1)-c1ccc(F)cc1 |r|

Cc1ccccc1-n1cc(CNC(=O)[C@@H](N)CCSC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cn1 |r|

N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)NCc1cnn(Cc2ccccc2)c1 |r|

CCn1cc(CNC(=O)[C@@H](N)CCSC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cn1 |r|

Cc1cc(CNC(=O)[C@@H](N)CCSC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)n(C)n1 |r|

N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)NCc1ccccc1 |r|

N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)NCC1CC1 |r|

COCc1cc(CNC(=O)[C@@H](N)CCSC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)n[nH]1 |r|

CC(C)(C)c1cc(CNC(=O)[C@@H](N)CCSC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)n[nH]1 |r|

N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)NCc1cc([nH]n1)C1CCC1 |r|

CC[C@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CCC(CC)n1ccc2c(cc(cc12)C#N)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(CCCCc2cn(CCN3C(=O)N(CC)C(=O)\C(=C\C=C\C=C4\N(CCC(=O)OCOC(C)=O)c5ccc(cc5C4(C)C)C(=O)OCOC(C)=O)C3=O)nn2)CC1

[H][C@]12CS[C@@H](CCCCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)N3CCN(CC3)c3ccc(cn3)-c3cc(C(=O)NCc4c(CCC)cc(C)[nH]c4=O)c4cnn(C(C)C)c4c3)[C@@]1([H])NC(=O)N2

C[C@H](c1ccccc1)n1c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccccc12 |r|

CCS(=O)(=O)N1CCC(CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(OCC(F)(F)F)cc(C)[nH]c2=O)c2ccccc12 |r|

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)S(=O)(=O)CC)c2ccccc12 |r|

CCS(=O)(=O)N1CCC(CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(OC)cc(C)[nH]c2=O)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCOCC2)c2ccccc12 |r|

CCS(=O)(=O)N1CCC(CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccccc12 |r|

C[C@H](C1CCN(C)CC1)n1c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccccc12 |r|

C[C@H](C1CCOCC1)n1c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccccc12 |r|

COC[C@@H](C)n1c(C)c(C(=O)NCc2c(C)cc(C)nc2O)c2ccccc12 |r|

CC(C(=O)N1CCCC1)n1c(C)c(C(=O)NCc2c(C)cc(C)nc2O)c2ccccc12

CCC(C)n1c(C)c(C(=O)NCc2c(C)cc(C)nc2O)c2ccccc12

CC(C)n1c(C)c(C(=O)NCc2c(C)cc(C)nc2O)c2ccccc12

CC(c1ccccn1)n1c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccccc12

CC(c1cnn(C)c1)n1c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccccc12

C[C@@H](c1ccccc1)n1c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccccc12 |r|

CC(c1ccccc1)n1c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccccc12

CC(c1ccccc1)n1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccccc12

CC(c1ccccc1)n1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)n1

CC(c1ccccc1)n1ccc(cc1=O)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(c1ccccc1)c1ccc(cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2ccc(Oc3ccccc3)cc2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2ccc(Oc3cccc(-c4ccncn4)c3C#N)c(Cl)c2)c(=O)[nH]1

COc1cc(cc2OCCOc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)nc2OC)c1C

CC(C)n1cnc2c(cccc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1nnc2c(cccc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2cc(ccc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2ccc(cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(Br)nc3n(ncc23)C2CCCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)nc3n(ncc23)C2CCN(CC2)C(=O)OC(C)(C)C)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)nc3n(ncc23)C2CCN(CC2)C(=O)C(C)(C)C)c(=O)[nH]1

CN(C)C(=O)N1CCC(CC1)n1ncc2c(cc(Br)nc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(Br)nc3n(ncc23)C2CCNCC2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(Br)nc3n(ncc23)C2CCOCC2)c(=O)[nH]1

CN(C1CCCC1)c1cc(Br)cc(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CN(C1CCCC1)c1cc(Br)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

Cc1cc(C)c(CNC(=O)c2cc(Br)cc(NC3CCOCC3)c2C)c(=O)[nH]1

CN(C1CCOCC1)c1cc(Br)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CNc1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CN(C)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1cc(Br)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CN(C1CCNCC1)c1cc(Br)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2ccc[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2ccc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2c(CO)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(F)(F)F)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2c(CC)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2c(CN(C)C)cc(C)[nH]c2=O)c1C

Cc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)n1C1CCCCC1

Cc1cc(C)c(CNC(=O)c2ccc3cnn(C4CCCC4)c3c2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2ccc3cnn(C4CCCC4)c3c2C)c(=O)[nH]1

CCN(C1CCOCC1)c1ccc(Cl)c(C(=O)N(C)Cc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NC(C)c2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)n(C)c2=O)c1C

Cc1nc(Nc2nc(=O)cc(CSc3nnnn3-c3ccccc3)[nH]2)nc2ccccc12

COc1ccc2nc(Nc3nc(O)cc(CSc4nnnn4-c4ccccc4)n3)nc(C)c2c1

Cc1[nH]ncc1-c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(C)Oc1ccc2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C

Cc1cc(C)c(CN2CCc3c(F)cc(O[C@@H]4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1 |r|

COc1cccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1F

CC(C)Oc1ccc2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CC(C)Oc1ccc2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1

Cc1cc(C)c(CN2CCc3c(Cl)cc(-c4cn[nH]c4)c(Cl)c3C2=O)c(=O)[nH]1

Cc1noc(C)c1-c1ccc2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |(62.09,-40.24,;61.77,-41.75,;62.8,-42.89,;62.03,-44.22,;60.52,-43.9,;59.38,-44.93,;60.36,-42.37,;59.02,-41.6,;57.69,-42.37,;56.37,-41.6,;56.38,-40.08,;55.05,-39.32,;55.05,-37.78,;56.38,-37,;56.38,-35.46,;55.04,-34.69,;55.05,-33.15,;56.38,-32.38,;53.72,-32.38,;52.38,-33.14,;51.05,-32.37,;52.38,-34.68,;53.71,-35.46,;53.71,-37,;57.7,-37.78,;59.04,-37.01,;57.7,-39.32,;59.02,-40.08,;60.35,-39.31,)|

COc1cccc(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCOc1cccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CC(C)Oc1cccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl

COc1ccc2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

CCOc1ccc2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

Cc1cc(C)c(CN2CCc3ccc(O[C@@H]4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1 |r|

Cc1nn(C)c(C)c1-c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |(56.67,-10.92,;56.34,-12.43,;57.37,-13.57,;56.6,-14.91,;57.23,-16.31,;55.1,-14.59,;53.95,-15.62,;54.94,-13.06,;53.6,-12.29,;52.27,-13.05,;50.95,-12.28,;49.61,-13.05,;50.95,-10.76,;49.62,-10,;49.62,-8.46,;50.95,-7.68,;50.95,-6.14,;49.62,-5.37,;49.63,-3.83,;50.96,-3.07,;48.3,-3.06,;46.96,-3.83,;45.63,-3.05,;46.96,-5.37,;48.29,-6.15,;48.29,-7.69,;52.28,-8.46,;53.62,-7.7,;52.28,-10,;53.6,-10.77,;54.93,-10,)|

Cc1cc(C)c(CN2CCc3c(Cl)cc(O[C@@H]4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1 |r|

Cc1noc(C)c1-c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |(59.06,-26.01,;58.74,-27.52,;59.77,-28.66,;59,-30,;57.5,-29.68,;56.35,-30.71,;57.33,-28.15,;55.99,-27.38,;54.66,-28.14,;53.34,-27.37,;52.01,-28.14,;53.35,-25.85,;52.02,-25.09,;52.02,-23.55,;53.35,-22.77,;53.35,-21.23,;52.02,-20.46,;52.02,-18.92,;53.36,-18.16,;50.7,-18.15,;49.36,-18.92,;48.03,-18.14,;49.35,-20.46,;50.69,-21.24,;50.69,-22.78,;54.68,-23.55,;56.01,-22.79,;54.68,-25.09,;55.99,-25.86,;57.33,-25.09,)|

COc1cccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1O

COc1cccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

Cc1n[nH]c(C)c1-c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |(45.66,-39.4,;45.34,-40.91,;46.37,-42.05,;45.6,-43.38,;44.09,-43.06,;42.95,-44.09,;43.93,-41.53,;42.59,-40.76,;41.26,-41.53,;39.94,-40.76,;38.61,-41.53,;39.95,-39.24,;38.62,-38.48,;38.62,-36.94,;39.95,-36.16,;39.95,-34.62,;38.61,-33.85,;38.62,-32.31,;39.96,-31.54,;37.29,-31.54,;35.96,-32.3,;34.63,-31.53,;35.95,-33.84,;37.29,-34.62,;37.29,-36.16,;41.28,-36.94,;42.61,-36.17,;41.28,-38.48,;42.59,-39.24,;43.93,-38.47,)|

COc1cccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1OC

COc1ccc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

Cc1cc(C)c(CNC(=O)c2ccccc2C)c(=O)[nH]1

CC(C)Oc1cccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

Cc1cc(C)c(CN2CCc3c(C)cc(O[C@@H]4CCOC4)c(Cl)c3C2=O)c(=O)[nH]1 |r|

COc1ccc2OCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl

COc1cccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl

CC1CN(C2CCOCC2)c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)-c1ccc(nc1)N1CCNCC1

CC(C)N1CC(C)c2c1cc(cc2C(=O)NCc1c(C)cc(C)[nH]c1=O)C#N

CC(C)N1CC(C)c2c1cc(cc2C(=O)NCc1c(C)cc(C)[nH]c1=O)-c1ccc(CN2CCOCC2)cc1

Cc1cc(C)c(CNC(=O)c2cc(cc3N(CCc23)C2CCOCC2)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

CC1CN(C2CCOCC2)c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)-c1cnc(N2CCNCC2)c2ccccc12

CC(C)N1CCc2c1cc(cc2C(=O)NCc1c(C)cc(C)[nH]c1=O)C#N

CC(C)N1CC(C)c2c1cc(cc2C(=O)NCc1c(C)cc(C)[nH]c1=O)-c1ccc(nc1)N1CCNCC1

CC1CN(C2CCOCC2)c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)-c1cnc(nc1)N1CCNCC1

CC1CN(C2CCCC2)c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)-c1ccc(nc1)N1CCNCC1

CC1CN(C2CCCC2)c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)-c1ccc(CN2CCOCC2)cc1

CC1CN(CC2CC2)c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)-c1ccc(CN2CCOCC2)cc1

CC1CN(C2CCCC2)c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)C#N

Cc1cc(C)c(CNC(=O)c2cc(cc3N(CCc23)C2CCOCC2)C#N)c(=O)[nH]1

CC1CN(C2CCOCC2)c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)-c1ccc(CN2CCOCC2)cc1

Cc1cc(C)c(CNC(=O)c2cc(cc3N(CCc23)C2CCCC2)C#N)c(=O)[nH]1

COc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)cc([C@@H](O)C3COC3)c(Cl)c2C1=O |r|

COC(c1cc(Cl)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl)C1(C)COC1

COc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(36.87,-43.31,;36.88,-41.77,;38.22,-41.01,;39.54,-41.78,;40.88,-41.02,;42.21,-41.8,;40.89,-39.48,;39.56,-38.7,;39.56,-37.16,;38.23,-39.47,;36.9,-38.69,;35.57,-39.46,;35.57,-41,;34.24,-41.76,;32.91,-41,;31.59,-41.76,;31.59,-43.3,;30.26,-41,;30.26,-39.46,;28.91,-38.69,;27.51,-39.32,;27.19,-40.82,;26.48,-38.17,;27.25,-36.84,;28.75,-37.16,;29.9,-36.13,;31.59,-38.69,;31.59,-37.15,;32.91,-39.46,;34.24,-38.68,;34.24,-37.14,)|

COc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)cc([C@H](O)C3COC3)c(Cl)c2C1=O |r|

CC(C)n1ncc2c(cc(cc12)-c1ccnc(c1)N1CCN(C)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(C)CC1

CC(C)n1ncc2c(cc(cc12)C1CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1cc2oc(cc2c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1CC)C1CCN(CC1)C(C)C

CC(CNC(=O)Nc1ccc(cc1)C(C)(C)C)CN(C)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)c(C)c(C)[nH]c2=O)c2cnn(C(C)C)c2c1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccccc1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(-c2ccc(nc2)N2CCN(CC2)C(C)C)c2cnn(C(C)C)c2c1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C1CCCCCC1)-c1ccc(nc1)N1CCN(CC1)C(C)C

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c2cnn(C(C)C)c2c1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(cc(C)[nH]c2=O)C2CCCC2)c2cnn(C(C)C)c2c1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc([nH]c2=O)C(C)(C)C)c2cnn(C(C)C)c2c1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc([nH]c2=O)-c2ccccc2)c2cnn(C(C)C)c2c1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2ccc[nH]c2=O)c2cnn(C(C)C)c2c1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c3CCCc3c(C)[nH]c2=O)c2cnn(C(C)C)c2c1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(O)cc(C)[nH]c2=O)c2cnn(C(C)C)c2c1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2cnc[nH]c2=O)c2cnn(C(C)C)c2c1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)[nH]c(=O)[nH]c2=O)c2cnn(C(C)C)c2c1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NC2CC(C)(C)NC(C)(C)C2)c2cnn(C(C)C)c2c1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cccn2c(cnc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cnn2c(cccc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)(C)C)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C1CCCC1)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C1CCCCC1)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(CC3CCC3)ncc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(CC3CCCCC3)ncc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCCC(CC)Cn1ncc2c(cc(cc12)-c1ccc(nc1)N1CCN(CC1)C(C)C)C(=O)NCc1c(CCC)cc(C)[nH]c1=O

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(CCCCCCO)ncc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(CC)CC1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(cc1)C(F)(F)F

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccccn1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(F)cn1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)N1CCNCC1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)N1CCCNCC1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2c1

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c2cnn(C(C)C)c2c1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1nn(C(C)C)c2cc(ccc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(CC)CC)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(F)cc1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(NC2CCNCC2)cc2n(ncc12)C(C)C

CCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCC(C)c1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C(C)C)-c2ccc(nc2)N2CCN(CC2)C(C)C)c(=O)[nH]1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2nn(cc12)C(C)C)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(CC3CCCC3)ncc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)C1CCNCC1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(cn1)C(F)(F)F

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Br)cc2n(ncc12)C(C)C

CCCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(CC1)C(C)C

CC(C)Cc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCc1c(C)c[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(CC1)C(C)C

CC(C)N1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2cnc(C)[nH]c2=O)c2cnn(C(C)C)c2c1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1nn(C(C)C)c2ccc(cc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cn2ccc(cc2n1)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(C)ncc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(CCC3CCCCC3)ncc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCNCC1

CCc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C(C)C)-c2ccc(nc2)N2CCN(CC2)C(C)C)c(=O)[nH]1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(Cc3ccccc3)ncc12)-c1ccc(nc1)N1CCN(CC1)C(C)C

Cc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)n1-c1cccc(NC(=O)CCCCCCC(=O)NO)c1

Cc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)n1-c1ccccc1

Cc1c(cnn1-c1ccccc1)C(=O)NCc1c(C)cc(C)[nH]c1=O

N[C@@H](CCSP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O |r|

C[C@H](C1CCN(CC(F)(F)F)CC1)n1c(C)c(C(=O)NCc2c(Sc3ccccc3)cc(C)[nH]c2=O)c2ccccc12 |r|

C[C@H](C1CCN(CC(F)(F)F)CC1)n1c(C)c(C(=O)NCc2c(SCc3ccccc3)cc(C)[nH]c2=O)c2ccccc12 |r|

C[C@H](C1CCN(CC(F)(F)F)CC1)n1c(C)c(C(=O)NCc2c(cc(C)[nH]c2=O)[S+](C)[O-])c2ccccc12 |r|

C[C@H](C1CCN(CC(F)(F)F)CC1)n1c(C)c(C(=O)NCc2c(cc(C)[nH]c2=O)S(C)(=O)=O)c2ccccc12 |r|

[H][C@]1(CC[C@@H](CC1)N1CC(F)(F)C1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:4.7,wD:13.15,1.0,(60.93,-34.76,;60.18,-36.1,;59.4,-37.43,;60.17,-38.76,;61.71,-38.76,;62.48,-37.42,;61.71,-36.08,;62.48,-40.09,;62.08,-41.58,;63.57,-41.97,;64.34,-43.31,;62.47,-43.05,;63.97,-40.49,;59.4,-34.77,;60.17,-33.43,;57.87,-34.77,;56.84,-33.62,;57.16,-32.12,;55.43,-34.25,;54.1,-33.48,;54.11,-31.94,;52.76,-34.25,;51.43,-33.47,;50.09,-34.24,;50.09,-35.78,;51.43,-36.55,;51.43,-38.09,;48.76,-36.54,;47.43,-35.78,;46.1,-36.55,;47.43,-34.24,;48.76,-33.46,;48.76,-31.92,;55.6,-35.78,;54.56,-36.91,;55.03,-38.37,;56.54,-38.7,;57.56,-37.56,;57.1,-36.1,)|

[H][C@@]1(CC[C@@H](CC1)NC1COC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:4.7,1.0,wD:12.14,(81.15,-34.89,;80.4,-36.23,;79.62,-37.56,;80.39,-38.88,;81.93,-38.89,;82.7,-37.56,;81.93,-36.22,;82.7,-40.21,;84.24,-40.21,;85.33,-41.3,;86.42,-40.2,;85.33,-39.12,;79.62,-34.9,;80.39,-33.56,;78.08,-34.9,;77.06,-33.75,;77.38,-32.25,;75.65,-34.39,;74.32,-33.61,;74.32,-32.07,;72.98,-34.38,;71.65,-33.6,;70.31,-34.37,;70.31,-35.91,;71.64,-36.68,;71.64,-38.22,;68.98,-36.67,;67.66,-35.91,;66.32,-36.68,;67.66,-34.37,;68.98,-33.59,;68.98,-32.05,;75.81,-35.91,;74.78,-37.04,;75.26,-38.5,;76.76,-38.82,;77.78,-37.69,;77.31,-36.24,)|

[H][C@@]1(OC[C@@H](CO1)N(C)C)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:4.7,1.0,wD:10.11,(18.83,-46.14,;18.07,-47.47,;17.3,-48.81,;18.07,-50.14,;19.61,-50.14,;20.38,-48.8,;19.61,-47.46,;20.38,-51.47,;19.61,-52.8,;21.92,-51.46,;17.3,-46.15,;18.06,-44.81,;15.77,-46.15,;14.73,-45,;15.06,-43.5,;13.32,-45.63,;11.99,-44.86,;12,-43.32,;10.65,-45.62,;9.33,-44.85,;7.99,-45.61,;7.99,-47.15,;9.32,-47.93,;9.32,-49.47,;6.66,-47.92,;5.33,-47.15,;3.99,-47.93,;5.33,-45.61,;6.66,-44.84,;6.66,-43.3,;13.49,-47.15,;12.46,-48.29,;12.93,-49.75,;14.44,-50.07,;15.46,-48.93,;14.99,-47.48,)|

[H][C@@]1(CC[C@@H](CC1)N1CC(C1)OC)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:4.7,1.0,wD:13.15,(41.43,-46.36,;40.68,-47.69,;39.9,-49.03,;40.67,-50.36,;42.21,-50.36,;42.98,-49.02,;42.21,-47.68,;42.98,-51.69,;42.58,-53.18,;44.07,-53.57,;44.47,-52.08,;44.84,-54.91,;44.07,-56.24,;39.9,-46.37,;40.66,-45.03,;38.36,-46.38,;37.33,-45.23,;37.66,-43.72,;35.92,-45.85,;34.59,-45.08,;34.6,-43.54,;33.26,-45.84,;31.92,-45.07,;30.59,-45.84,;30.59,-47.38,;31.92,-48.15,;31.92,-49.69,;29.25,-48.14,;27.92,-47.38,;26.59,-48.15,;27.92,-45.84,;29.25,-45.06,;29.25,-43.52,;36.09,-47.38,;35.06,-48.51,;35.52,-49.98,;37.03,-50.29,;38.06,-49.15,;37.59,-47.7,)|

[H][C@@]1(CC[C@@H](CC1)N1CC(C1)OC(F)(F)F)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:4.7,1.0,wD:16.18,(20.18,-7.04,;19.43,-8.38,;18.65,-9.71,;19.42,-11.04,;20.96,-11.04,;21.73,-9.7,;20.96,-8.36,;21.73,-12.37,;21.33,-13.86,;22.82,-14.25,;23.22,-12.76,;23.59,-15.59,;22.82,-16.92,;23.59,-18.26,;21.28,-16.92,;22.04,-18.25,;18.65,-7.04,;19.42,-5.71,;17.11,-7.05,;16.08,-5.9,;16.41,-4.39,;14.67,-6.53,;13.35,-5.75,;13.35,-4.21,;12.01,-6.53,;10.68,-5.75,;9.34,-6.52,;9.34,-8.06,;10.67,-8.83,;10.67,-10.37,;8.01,-8.82,;6.68,-8.06,;5.35,-8.83,;6.68,-6.52,;8.01,-5.74,;8.01,-4.2,;14.84,-8.06,;13.81,-9.19,;14.28,-10.66,;15.78,-10.97,;16.81,-9.84,;16.34,-8.38,)|

[H][C@@]1(CC[C@@H](CC1)N1CC(C1)OC(F)F)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:4.7,1.0,wD:15.17,(46.23,-8.08,;45.48,-9.42,;44.7,-10.75,;45.48,-12.08,;47.02,-12.08,;47.78,-10.75,;47.01,-9.41,;47.78,-13.41,;47.39,-14.9,;48.88,-15.3,;49.27,-13.81,;49.64,-16.63,;48.88,-17.97,;47.34,-17.97,;49.64,-19.3,;44.7,-8.09,;45.47,-6.75,;43.17,-8.09,;42.14,-6.94,;42.47,-5.44,;40.73,-7.58,;39.4,-6.8,;39.41,-5.26,;38.07,-7.57,;36.74,-6.79,;35.4,-7.56,;35.4,-9.1,;36.73,-9.87,;36.73,-11.41,;34.07,-9.86,;32.74,-9.1,;31.4,-9.87,;32.74,-7.56,;34.07,-6.78,;34.07,-5.24,;40.9,-9.1,;39.87,-10.24,;40.33,-11.7,;41.84,-12.02,;42.87,-10.88,;42.4,-9.43,)|

[H][C@@]1(CC[C@@H](CC1)N1CC(C1)OC1CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:4.7,1.0,wD:15.18,(67.36,-7.96,;66.6,-9.3,;65.83,-10.63,;66.6,-11.96,;68.14,-11.96,;68.9,-10.62,;68.14,-9.28,;68.91,-13.29,;68.51,-14.78,;70,-15.17,;70.39,-13.68,;70.76,-16.51,;70,-17.84,;68.67,-18.61,;70,-19.38,;65.82,-7.96,;66.59,-6.63,;64.29,-7.97,;63.26,-6.82,;63.59,-5.31,;61.85,-7.45,;60.53,-6.68,;60.53,-5.14,;59.19,-7.45,;57.86,-6.67,;56.52,-7.44,;56.52,-8.98,;57.85,-9.75,;57.85,-11.29,;55.19,-9.74,;53.86,-8.98,;52.52,-9.75,;53.86,-7.44,;55.19,-6.66,;55.19,-5.12,;62.02,-8.98,;60.99,-10.11,;61.45,-11.58,;62.96,-11.89,;63.99,-10.76,;63.52,-9.3,)|

[H][C@@]1(CC[C@@H](CC1)N1CC(C1)OC1CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccnc12 |r,wU:4.7,1.0,wD:15.18,(20.04,-23.33,;19.28,-24.67,;18.51,-26.01,;19.28,-27.33,;20.82,-27.34,;21.58,-26,;20.82,-24.66,;21.59,-28.66,;21.19,-30.15,;22.68,-30.55,;23.07,-29.06,;23.44,-31.88,;22.68,-33.22,;21.35,-33.98,;22.68,-34.76,;18.5,-23.34,;19.27,-22,;16.97,-23.35,;15.94,-22.2,;16.27,-20.69,;14.53,-22.83,;13.21,-22.05,;13.21,-20.51,;11.87,-22.82,;10.54,-22.04,;9.2,-22.81,;9.2,-24.35,;10.53,-25.12,;10.53,-26.66,;7.87,-25.11,;6.54,-24.35,;5.21,-25.12,;6.54,-22.81,;7.87,-22.03,;7.87,-20.49,;14.7,-24.35,;13.67,-25.49,;14.14,-26.95,;15.64,-27.27,;16.67,-26.13,;16.2,-24.68,)|

[H][C@@]1(CC[C@@H](CC1)N1CC(C1)OC1CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cccc(F)c12 |r,wU:4.7,1.0,wD:15.18,(42.35,-24.8,;41.6,-26.14,;40.82,-27.47,;41.6,-28.8,;43.14,-28.8,;43.9,-27.47,;43.13,-26.13,;43.9,-30.13,;43.51,-31.62,;45,-32.02,;45.39,-30.53,;45.76,-33.35,;45,-34.69,;43.67,-35.45,;45,-36.23,;40.82,-24.81,;41.59,-23.47,;39.29,-24.81,;38.26,-23.66,;38.59,-22.16,;36.85,-24.3,;35.52,-23.52,;35.53,-21.98,;34.19,-24.29,;32.85,-23.51,;31.52,-24.28,;31.52,-25.82,;32.85,-26.59,;32.85,-28.13,;30.19,-26.58,;28.86,-25.82,;27.52,-26.59,;28.86,-24.28,;30.19,-23.5,;30.19,-21.96,;37.02,-25.82,;35.99,-26.96,;36.45,-28.42,;37.96,-28.74,;38.98,-27.6,;39.74,-28.93,;38.52,-26.15,)|

[H][C@@]1(CC[C@@H](CC1)N1CC(C1)OC1CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cncnc12 |r,wU:4.7,1.0,wD:15.18,(62.3,-23.46,;61.54,-24.8,;60.77,-26.14,;61.54,-27.47,;63.08,-27.47,;63.85,-26.13,;63.08,-24.79,;63.85,-28.8,;63.45,-30.28,;64.94,-30.68,;65.34,-29.19,;65.71,-32.01,;64.94,-33.35,;63.61,-34.12,;64.94,-34.89,;60.77,-23.47,;61.53,-22.13,;59.23,-23.48,;58.2,-22.33,;58.53,-20.82,;56.79,-22.96,;55.47,-22.18,;55.47,-20.64,;54.13,-22.95,;52.8,-22.18,;51.46,-22.95,;51.46,-24.49,;52.8,-25.25,;52.79,-26.79,;50.13,-25.24,;48.8,-24.49,;47.47,-25.25,;48.8,-22.95,;50.13,-22.16,;50.13,-20.62,;56.96,-24.49,;55.93,-25.62,;56.4,-27.08,;57.9,-27.4,;58.93,-26.26,;58.46,-24.81,)|

[H][C@@]1(CC[C@@H](CC1)N1CC(C1)OC1CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cc(Cl)cnc12 |r,wU:4.7,1.0,wD:15.18,(83.23,-24.16,;82.48,-25.5,;81.7,-26.84,;82.48,-28.16,;84.02,-28.16,;84.78,-26.83,;84.01,-25.49,;84.78,-29.49,;84.39,-30.98,;85.88,-31.38,;86.27,-29.89,;86.64,-32.71,;85.88,-34.05,;84.54,-34.81,;85.88,-35.59,;81.7,-24.17,;82.47,-22.83,;80.17,-24.18,;79.14,-23.03,;79.47,-21.52,;77.73,-23.66,;76.4,-22.88,;76.41,-21.34,;75.07,-23.65,;73.73,-22.87,;72.4,-23.64,;72.4,-25.18,;73.73,-25.95,;73.73,-27.49,;71.07,-25.94,;69.74,-25.18,;68.4,-25.95,;69.74,-23.64,;71.07,-22.86,;71.07,-21.32,;77.9,-25.18,;76.87,-26.32,;77.33,-27.78,;76.31,-28.92,;78.84,-28.1,;79.87,-26.96,;79.4,-25.51,)|

[H][C@@]1(CC[C@@H](CC1)N1CC(C1)OC1CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2cc(F)cnc12 |r,wU:4.7,1.0,wD:15.18,(19.9,-39.41,;19.14,-40.75,;18.37,-42.08,;19.14,-43.41,;20.68,-43.41,;21.45,-42.07,;20.68,-40.73,;21.45,-44.74,;21.05,-46.23,;22.54,-46.62,;22.93,-45.14,;23.3,-47.96,;22.54,-49.29,;21.21,-50.06,;22.54,-50.83,;18.36,-39.42,;19.13,-38.08,;16.83,-39.42,;15.8,-38.27,;16.13,-36.77,;14.39,-38.9,;13.07,-38.13,;13.07,-36.59,;11.73,-38.9,;10.4,-38.12,;9.06,-38.89,;9.06,-40.43,;10.39,-41.2,;10.39,-42.74,;7.73,-41.19,;6.4,-40.43,;5.07,-41.2,;6.4,-38.89,;7.73,-38.11,;7.73,-36.57,;14.56,-40.43,;13.53,-41.57,;14,-43.03,;12.97,-44.16,;15.5,-43.35,;16.53,-42.21,;16.06,-40.75,)|

C[C@H](C1CCN(CC(F)(F)F)CC1)n1c(C)c(C(=O)NCc2c(C)cc(Cl)[nH]c2=O)c2ccccc12 |r|

COc1cc(C)c(CNC(=O)c2c(C)n([C@H](C)C3CCN(CC(F)(F)F)CC3)c3ccccc23)c(=O)[nH]1 |r|

C[C@H](C1CCN(CC(F)(F)F)CC1)n1c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccccc12 |r|

C[C@H](C1CCN(CC(F)(F)F)CC1)n1c(C)c(C(=O)NCc2c(Cl)cc(C)[nH]c2=O)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)F)CC2)c2ccccc12

CCN(C1CCOCC1)c1cc(\C=C\c2cccc(CN(C)C)c2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(C)CC2)cc1

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(\C=C\C(=O)OC)cc2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(\C=C\C(=O)OC)cc2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(cc2)S(=O)(=O)N2CCOCC2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(cc2)S(=O)(=O)N2CCOCC2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(nc2)N2CCOCC2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(nc2)N2CCOCC2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(CN3CCN(C)CC3)cc2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(CN3CCN(C)CC3)cc2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C

[H][C@@]12CN(Cc3ccc(\C=C\c4cc(N(CC)C5CCOCC5)c(C)c(c4)C(=O)NCc4c(C)c5CCCCc5[nH]c4=O)cc3F)[C@@]([H])(CO1)C2 |r|

[H][C@@]12CN(Cc3ccc(\C=C\c4cc(N(CC)C5CCOCC5)c(C)c(c4)C(=O)NCc4c5CCCCc5c(C)[nH]c4=O)cc3F)[C@@]([H])(CO1)C2 |r|

[H][C@]12CN(Cc3ccc(\C=C\c4cc(N(CC)C5CCOCC5)c(C)c(c4)C(=O)NCc4c(C)c5CCCCc5[nH]c4=O)cc3F)[C@]([H])(CO1)C2 |r|

[H][C@]12CN(Cc3ccc(\C=C\c4cc(N(CC)C5CCOCC5)c(C)c(c4)C(=O)NCc4c5CCCCc5c(C)[nH]c4=O)cc3F)[C@]([H])(CO1)C2 |r|

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(CN3C[C@H](C)O[C@H](C)C3)c(F)c2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C |r|

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(CN3C[C@H](C)O[C@H](C)C3)c(F)c2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C |r|

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(CN3CCOCC3)cc2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(CN3CCOCC3)cc2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2cccc(CN3CCOCC3)c2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2cccc(CN3CCOCC3)c2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(CN3CCC4(CC3)OCCO4)cc2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(CN3CCC4(CC3)OCCO4)cc2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(CN3C[C@H](C)O[C@H](C)C3)cc2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C |r|

CCN(C1CCOCC1)c1cc(\C=C\c2ccc(CN3C[C@H](C)O[C@H](C)C3)cc2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C |r|

CCN(C1CCOCC1)c1cc(\C=C\c2cccc(CN(C)C)c2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc3OCC(=O)Nc3c2)cc(C(=O)NCc2c(C)c3CCCCc3[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(\C=C\c2ccc3OCC(=O)Nc3c2)cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C

[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2-[#8]C34[#6]5-[#6]-[#6](-[#6]=[#6]3-[#6](=O)-c2c1-[#8])-[#6](=O)C4([#6]\[#6]=[#6](/[#6])-[#6](-[#8])=O)[#8]C5([#6])[#6] |c:25,TLB:33:32:26.25:22.23,THB:43:22:26.25:32.34,35:34:26.25:22.23,27:26:32.34:22.23|

[#6]-[#6]-[#8]-[#6]-[#6]-[#7]-[#6](=O)-[#6](\[#6])=[#6]\[#6]C12[#8]C([#6])([#6])[#6]3-[#6]-[#6](-[#6]=[#6]4-[#6](=O)-c5c(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c5-[#8]C134)-[#6]2=O |t:20,TLB:50:49:21.20:17.18,THB:14:17:21.20:49.12,11:12:21.20:17.18,22:21:49.12:17.18|

CC(C)(C)c1ccc(NC(=O)c2ncn(CC(=O)NCc3ccc4[nH]ncc4c3)n2)cc1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(nc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(C)CC1

CC(C)n1cc(C)c2c(cc(cc12)-c1ccc(cc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(cc12)-c1ccc(nc1)N1CCN(CCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |TLB:27:28:31:35.34.33,THB:29:30:33:37.28.36,29:28:31.30.35:33,36:28:31:35.34.33,36:34:31:37.29.28|

Cc1nnn(C)c1-c1cc(Br)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |(30.21,-10.38,;29.89,-11.89,;30.92,-13.04,;30.16,-14.37,;28.65,-14.05,;27.51,-15.09,;28.48,-12.52,;27.14,-11.76,;25.8,-12.53,;24.47,-11.76,;23.14,-12.52,;24.48,-10.22,;23.14,-9.45,;23.14,-7.92,;24.48,-7.16,;24.48,-5.61,;23.14,-4.84,;23.14,-3.29,;24.47,-2.52,;21.8,-2.53,;20.47,-3.3,;19.13,-2.53,;20.47,-4.84,;21.8,-5.62,;21.8,-7.16,;25.82,-7.91,;27.15,-7.14,;25.81,-9.45,;27.14,-10.22,;28.46,-9.45,)|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCNCC2)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(C)CC2)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C(=O)C(C)C)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C(=O)OC(C)C)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C(=O)N(C)C)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC2)C2COC2)c2ccccc12 |r|

CCOC(=O)CN1CCC(CC1)[C@@H](C)n1c(C)c(C(=O)NCc2c(OC)cc(C)[nH]c2=O)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CCC(F)(F)F)CC2)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(C)(F)F)CC2)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)(F)C(F)F)CC2)c2ccccc12 |r|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(CC(F)F)CC2)c2ccccc12 |r|

Nc1cccc2c(cccc12)S(=O)(=O)NCc1ccccc1

CN1CCN(CC1)c1ccc(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)NCCCN1CCOCC1

CCN(C(=O)CC)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F

CCN(C(=O)C(C)=C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F

CC(=O)Nc1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F

CCC(=O)Nc1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F

CC(C)CC(=O)Nc1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F

CC[C@H](C)n1nc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CCN(C(=O)C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C(=O)c1ccccc1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C(=O)C1CCCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C(=O)C1CCCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C(=O)C1CCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C(=O)C(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C(=O)CC)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C(C)=O)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

Cc1cc(C)c(CNC(=O)c2cc(cc3N(CCc23)C(=O)C2CC2)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3N(CCc23)C(=O)C2CCCC2)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3N(CCc23)C(=O)c2ccco2)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3N(CCc23)C(=O)C2CCOCC2)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(N)cc1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(NC(=O)c2cccs2)cc1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(NC(=O)c2cccnc2)cc1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(NC(=O)C2CCOCC2)cc1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(NC(=O)CCN(C)C)cc1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(cc1)N1CCOCC1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(cc1)N1CCNCC1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(cc1)N1CCN(CC2CC2)CC1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(cc1)N1CCN(CC)CC1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(CC2CC2)CC1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1C)N1CCN(CC2CC2)CC1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnc(N2CCN(CC3CC3)CC2)c(C)c1

CCN(C(=O)C1CC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnc(cc1C)N1CCN(CC2CC2)CC1

CN(C)C(=O)c1ccc(cc1)-c1cc(Nc2ncnc(Cl)c2N)c(cc1F)N1CCN(C)CC1

CC[C@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(CCCCOc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CC[C@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(CCCCCOc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CC[C@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(CCCCCCOc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CC[C@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(CCCCCCCOc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CC[C@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(CCCCCCCCOc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CC[C@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(CCCCCCCCCOc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CC[C@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(CCCCCCCCCCOc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CC[C@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(CCCCCCCCCCCOc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CC[C@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCN(CCCCCCCCCCCCOc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CCCCOc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CCCCCOc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CCCCCCOc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CCCCCCCOc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CCCCCCCCOc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CCCCCCCCCOc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CCCCCCCCCCOc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CCCCCCCCCCCOc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CCCCCCCCCCCCOc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CCCCCCCOc3cccc4C(=O)N(C5CCC(=O)N(C)C5=O)C(=O)c34)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)n(C)c2=O)c1C)-c1ccc(CN2CCN(CCCCCCCOc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)CC2)cc1

Cc1noc(C)c1-c1cc(Cl)c2CCN(Cc3c(C)cc(C)n(C)c3=O)C(=O)c2c1Cl |(-7.25,-1.11,;-6.85,.37,;-7.88,1.52,;-7.11,2.85,;-5.61,2.53,;-4.52,3.62,;-5.45,1,;-4.11,.23,;-4.11,-1.32,;-2.78,-2.08,;-2.78,-3.62,;-1.45,-1.31,;-.12,-2.08,;1.22,-1.31,;1.22,.23,;2.55,1,;3.88,.23,;3.88,-1.31,;2.55,-2.08,;5.22,-2.08,;6.55,-1.31,;7.88,-2.08,;6.55,.23,;7.88,1,;5.22,1,;5.22,2.54,;-.12,1,;-.12,2.54,;-1.45,.23,;-2.78,1,;-2.78,2.54,)|

CCc1cc(C)n(C)c(=O)c1CN1CCc2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(2.55,-3.62,;2.55,-2.08,;3.88,-1.31,;5.22,-2.08,;6.55,-1.31,;7.88,-2.08,;6.55,.23,;7.88,1,;5.22,1,;5.22,2.54,;3.88,.23,;2.55,1,;1.22,.23,;1.22,-1.31,;-.12,-2.08,;-1.45,-1.31,;-2.78,-2.08,;-2.78,-3.62,;-4.11,-1.32,;-4.11,.23,;-5.45,1,;-6.85,.37,;-7.25,-1.11,;-7.88,1.52,;-7.11,2.85,;-5.61,2.53,;-4.52,3.62,;-2.78,1,;-2.78,2.54,;-1.45,.23,;-.12,1,;-.12,2.54,)|

Cc1noc(C)c1-c1cc(Cl)c2CCN(Cc3c(cc(C)n(C)c3=O)C3CC3)C(=O)c2c1Cl |(-7.25,-1.11,;-6.85,.37,;-7.88,1.52,;-7.11,2.85,;-5.61,2.53,;-4.52,3.62,;-5.45,1,;-4.11,.23,;-4.11,-1.32,;-2.78,-2.08,;-2.78,-3.62,;-1.45,-1.31,;-.12,-2.08,;1.22,-1.31,;1.22,.23,;2.55,1,;3.88,.23,;3.88,-1.31,;5.22,-2.08,;6.55,-1.31,;7.88,-2.08,;6.55,.23,;7.88,1,;5.22,1,;5.22,2.54,;2.55,-2.08,;1.01,-2.08,;1.78,-3.41,;-.12,1,;-.12,2.54,;-1.45,.23,;-2.78,1,;-2.78,2.54,)|

Cc1noc(C)c1-c1cc(Cl)c2CCN(Cc3c(cc(C)n(C)c3=O)C(F)(F)F)C(=O)c2c1Cl |(-7.25,-1.11,;-6.85,.37,;-7.88,1.52,;-7.11,2.85,;-5.61,2.53,;-4.52,3.62,;-5.45,1,;-4.11,.23,;-4.11,-1.32,;-2.78,-2.08,;-2.78,-3.62,;-1.45,-1.31,;-.12,-2.08,;1.22,-1.31,;1.22,.23,;2.55,1,;3.88,.23,;3.88,-1.31,;5.22,-2.08,;6.55,-1.31,;7.88,-2.08,;6.55,.23,;7.88,1,;5.22,1,;5.22,2.54,;2.55,-2.08,;2.55,-3.62,;1.78,-.74,;1.01,-2.08,;-.12,1,;-.12,2.54,;-1.45,.23,;-2.78,1,;-2.78,2.54,)|

COc1cc(C)n(C)c(=O)c1CN1CCc2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(2.55,-3.62,;2.55,-2.08,;3.88,-1.31,;5.22,-2.08,;6.55,-1.31,;7.88,-2.08,;6.55,.23,;7.88,1,;5.22,1,;5.22,2.54,;3.88,.23,;2.55,1,;1.22,.23,;1.22,-1.31,;-.12,-2.08,;-1.45,-1.31,;-2.78,-2.08,;-2.78,-3.62,;-4.11,-1.32,;-4.11,.23,;-5.45,1,;-6.85,.37,;-7.25,-1.11,;-7.88,1.52,;-7.11,2.85,;-5.61,2.53,;-4.52,3.62,;-2.78,1,;-2.78,2.54,;-1.45,.23,;-.12,1,;-.12,2.54,)|

CSc1cc(C)n(C)c(=O)c1CN1CCc2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(2.55,-3.62,;2.55,-2.08,;3.88,-1.31,;5.22,-2.08,;6.55,-1.31,;7.88,-2.08,;6.55,.23,;7.88,1,;5.22,1,;5.22,2.54,;3.88,.23,;2.55,1,;1.22,.23,;1.22,-1.31,;-.12,-2.08,;-1.45,-1.31,;-2.78,-2.08,;-2.78,-3.62,;-4.11,-1.32,;-4.11,.23,;-5.45,1,;-6.85,.37,;-7.25,-1.11,;-7.88,1.52,;-7.11,2.85,;-5.61,2.53,;-4.52,3.62,;-2.78,1,;-2.78,2.54,;-1.45,.23,;-.12,1,;-.12,2.54,)|

COc1cc(C)[nH]c(=O)c1CN1CCNc2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(3.33,-2.78,;2.93,-1.29,;4.02,-.2,;5.51,-.6,;6.6,.49,;8.09,.09,;6.2,1.98,;4.71,2.37,;4.31,3.86,;3.62,1.29,;2.14,1.68,;1.05,.6,;1.72,-.78,;1.05,-2.15,;-.45,-2.51,;-1.65,-1.55,;-2.98,-2.32,;-2.98,-3.86,;-4.32,-1.56,;-4.32,-.01,;-5.65,.76,;-7.06,.13,;-7.45,-1.36,;-8.09,1.27,;-7.32,2.61,;-5.81,2.29,;-4.72,3.38,;-2.98,.75,;-2.98,2.29,;-1.65,-.01,;-.46,.94,;-.85,2.42,)|

COc1cc(C)[nH]c(=O)c1CN1CCN(C)c2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(3.33,-2.71,;2.93,-1.22,;4.02,-.13,;5.51,-.53,;6.6,.56,;8.09,.16,;6.2,2.05,;4.71,2.44,;4.31,3.93,;3.62,1.35,;2.14,1.75,;1.05,.66,;1.72,-.71,;1.05,-2.09,;-.45,-2.44,;-.85,-3.93,;-1.65,-1.48,;-2.98,-2.25,;-2.98,-3.79,;-4.32,-1.49,;-4.32,.05,;-5.65,.82,;-7.06,.2,;-7.45,-1.29,;-8.09,1.34,;-7.32,2.68,;-5.81,2.36,;-4.72,3.44,;-2.98,.82,;-2.98,2.36,;-1.65,.06,;-.46,1.01,;-.85,2.49,)|

CCN1CCN(Cc2c(OC)cc(C)[nH]c2=O)C(=O)c2c(Cl)c(cc(Cl)c12)-c1c(C)noc1C |(.24,-4.48,;-.85,-3.39,;-.45,-1.9,;1.05,-1.54,;1.72,-.17,;1.05,1.21,;2.14,2.3,;3.62,1.9,;4.02,.41,;2.93,-.68,;3.33,-2.17,;5.51,.01,;6.6,1.1,;8.09,.7,;6.2,2.59,;4.71,2.99,;4.31,4.48,;-.46,1.55,;-.85,3.04,;-1.65,.6,;-2.98,1.37,;-2.98,2.91,;-4.32,.6,;-4.32,-.95,;-2.98,-1.71,;-2.98,-3.25,;-1.65,-.94,;-5.65,1.37,;-7.06,.74,;-7.45,-.74,;-8.09,1.89,;-7.32,3.22,;-5.81,2.9,;-4.72,3.99,)|

COc1cc(C)[nH]c(=O)c1CN1CCN(C)c2ccc(-c3c(C)noc3C)c(Cl)c2C1=O |(3.33,-2.71,;2.93,-1.22,;4.02,-.13,;5.51,-.53,;6.6,.56,;8.09,.16,;6.2,2.05,;4.71,2.44,;4.31,3.93,;3.62,1.35,;2.14,1.75,;1.05,.66,;1.72,-.71,;1.05,-2.08,;-.45,-2.44,;-.85,-3.93,;-1.65,-1.48,;-2.98,-2.25,;-4.32,-1.49,;-4.32,.05,;-5.65,.82,;-7.06,.2,;-7.45,-1.29,;-8.09,1.34,;-7.32,2.68,;-5.81,2.36,;-4.72,3.44,;-2.98,.82,;-2.98,2.36,;-1.65,.06,;-.46,1.01,;-.85,2.49,)|

CCN1CCN(Cc2c(OC)cc(C)[nH]c2=O)C(=O)c2c(Cl)c(ccc12)-c1c(C)noc1C |(.24,-4.48,;-.85,-3.39,;-.45,-1.9,;1.05,-1.54,;1.72,-.17,;1.05,1.21,;2.14,2.3,;3.62,1.9,;4.02,.41,;2.93,-.68,;3.33,-2.17,;5.51,.01,;6.6,1.1,;8.09,.7,;6.2,2.59,;4.71,2.99,;4.31,4.48,;-.46,1.55,;-.85,3.04,;-1.65,.6,;-2.98,1.37,;-2.98,2.91,;-4.32,.6,;-4.32,-.95,;-2.98,-1.71,;-1.65,-.94,;-5.65,1.37,;-7.06,.74,;-7.45,-.74,;-8.09,1.89,;-7.32,3.22,;-5.81,2.9,;-4.72,3.99,)|

COc1cc(C)[nH]c(=O)c1CN1CCN(C)c2c(Cl)cc(OC(C)C)c(Cl)c2C1=O

COc1cc(C)[nH]c(=O)c1CN1CCN(C)c2c(Cl)cc(C(C)C3CCOCC3)c(Cl)c2C1=O

COc1cc(C)[nH]c(=O)c1CN1CCN(C)c2c(Cl)cc(C(O)C3CCOCC3)c(Cl)c2C1=O

CCN(C1CCOCC1)c1cc(Cl)c2N(C)CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl

COc1cc(C)[nH]c(=O)c1CN1CCN(C)c2c(Cl)cc(c(Cl)c2C1=O)-c1ccc(cc1)N1CCOCC1

COc1cc(C)[nH]c(=O)c1CN1CCN(C)c2c(Cl)cc(c(Cl)c2C1=O)-c1ccc(Cl)cc1F

COc1cc(C)[nH]c(=O)c1CN1CCN(C)c2c(Cl)cc(c(Cl)c2C1=O)-c1ccc(CN2CCOCC2)cc1

CCc1cc(C)[nH]c(=O)c1CN1CCN(C)c2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(3.33,-2.71,;2.93,-1.22,;4.02,-.13,;5.51,-.53,;6.6,.56,;8.09,.16,;6.2,2.04,;4.71,2.44,;4.31,3.93,;3.62,1.35,;2.14,1.75,;1.05,.66,;1.72,-.72,;1.05,-2.09,;-.45,-2.44,;-.85,-3.93,;-1.65,-1.48,;-2.98,-2.25,;-2.98,-3.79,;-4.32,-1.49,;-4.32,.05,;-5.65,.82,;-7.06,.2,;-7.45,-1.29,;-8.09,1.34,;-7.32,2.68,;-5.81,2.36,;-4.72,3.44,;-2.98,.82,;-2.98,2.36,;-1.65,.05,;-.46,1.01,;-.85,2.49,)|

COc1cc(C)n(C)c(=O)c1CN1CCN(C)c2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(3.33,-2.71,;2.93,-1.22,;4.02,-.13,;5.51,-.53,;6.6,.56,;8.09,.16,;6.2,2.05,;7.29,3.13,;4.71,2.44,;4.31,3.93,;3.62,1.35,;2.14,1.75,;1.05,.66,;1.72,-.72,;1.05,-2.09,;-.45,-2.44,;-.85,-3.93,;-1.65,-1.48,;-2.98,-2.25,;-2.98,-3.79,;-4.32,-1.49,;-4.32,.05,;-5.65,.82,;-7.06,.2,;-7.45,-1.29,;-8.09,1.34,;-7.32,2.68,;-5.81,2.36,;-4.72,3.44,;-2.98,.82,;-2.98,2.36,;-1.65,.05,;-.46,1.01,;-.85,2.49,)|

CSc1cc(C)[nH]c(=O)c1CN1CCN(C)c2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(3.33,-2.71,;2.93,-1.22,;4.02,-.13,;5.51,-.53,;6.6,.56,;8.09,.16,;6.2,2.05,;4.71,2.44,;4.31,3.93,;3.62,1.35,;2.14,1.75,;1.05,.66,;1.72,-.72,;1.05,-2.09,;-.45,-2.44,;-.85,-3.93,;-1.65,-1.48,;-2.98,-2.25,;-2.98,-3.79,;-4.32,-1.49,;-4.32,.05,;-5.65,.82,;-7.06,.2,;-7.45,-1.29,;-8.09,1.34,;-7.32,2.68,;-5.81,2.36,;-4.72,3.44,;-2.98,.82,;-2.98,2.36,;-1.65,.05,;-.46,1.01,;-.85,2.49,)|

CSc1cc(C)n(C)c(=O)c1CN1CCN(C)c2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(3.33,-2.71,;2.93,-1.22,;4.02,-.13,;5.51,-.53,;6.6,.56,;8.09,.16,;6.2,2.05,;7.29,3.13,;4.71,2.44,;4.31,3.93,;3.62,1.35,;2.14,1.75,;1.05,.66,;1.72,-.72,;1.05,-2.09,;-.45,-2.44,;-.85,-3.93,;-1.65,-1.48,;-2.98,-2.25,;-2.98,-3.79,;-4.32,-1.49,;-4.32,.05,;-5.65,.82,;-7.06,.2,;-7.45,-1.29,;-8.09,1.34,;-7.32,2.68,;-5.81,2.36,;-4.72,3.44,;-2.98,.82,;-2.98,2.36,;-1.65,.05,;-.46,1.01,;-.85,2.49,)|

CSc1cc(C)n(C)c(=O)c1CN1CCNc2c(Cl)cc(-c3c(C)noc3C)c(Cl)c2C1=O |(3.33,-2.78,;2.93,-1.29,;4.02,-.2,;5.51,-.6,;6.6,.49,;8.09,.09,;6.2,1.98,;7.29,3.07,;4.71,2.37,;4.31,3.86,;3.62,1.29,;2.14,1.68,;1.05,.6,;1.72,-.78,;1.05,-2.15,;-.45,-2.51,;-1.65,-1.55,;-2.98,-2.32,;-2.98,-3.86,;-4.32,-1.56,;-4.32,-.01,;-5.65,.76,;-7.06,.13,;-7.45,-1.36,;-8.09,1.27,;-7.32,2.61,;-5.81,2.29,;-4.72,3.38,;-2.98,.75,;-2.98,2.3,;-1.65,-.01,;-.46,.94,;-.85,2.42,)|

CCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(NC(=O)C=C)c1C)-c1ccc(nc1)N1CCNCC1

CN(C)C1CCC(CC1)C1(C)Oc2c(O1)c(C)c(cc2Br)C(=O)NCc1c(C)cc(C)[nH]c1=O |(2.94,-8.67,;1.46,-8.27,;.37,-9.36,;1.06,-6.79,;2.15,-5.7,;1.75,-4.21,;.26,-3.81,;-.83,-4.9,;-.43,-6.39,;-.14,-2.32,;1.4,-2.32,;-1.67,-2.17,;-1.99,-.66,;-.66,.11,;.49,-.92,;-.66,1.66,;.67,2.43,;-2,2.43,;-3.34,1.66,;-3.34,.11,;-4.67,-.66,;-2,3.97,;-3.33,4.74,;-.66,4.74,;-.66,6.28,;.67,7.05,;.67,8.59,;-.66,9.36,;2,9.36,;3.34,8.59,;4.67,9.36,;3.34,7.05,;2,6.28,;2,4.74,)|

CN(C)C1CCC(CC1)C1(C)Oc2c(O1)c(C)c(cc2Cl)C(=O)NCc1c(C)cc(C)[nH]c1=O |(2.94,-8.67,;1.46,-8.27,;.37,-9.36,;1.06,-6.79,;2.15,-5.7,;1.75,-4.21,;.26,-3.81,;-.83,-4.9,;-.43,-6.39,;-.14,-2.32,;1.4,-2.32,;-1.67,-2.17,;-1.99,-.66,;-.66,.11,;.49,-.92,;-.66,1.66,;.67,2.43,;-2,2.43,;-3.34,1.66,;-3.34,.11,;-4.67,-.66,;-2,3.97,;-3.33,4.74,;-.66,4.74,;-.66,6.28,;.67,7.05,;.67,8.59,;-.66,9.36,;2,9.36,;3.34,8.59,;4.67,9.36,;3.34,7.05,;2,6.28,;2,4.74,)|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(C)CC1

COc1cc(C)[nH]c(=O)c1CNC(=O)c1cccc2n([C@H](C)C3CCOCC3)c(C)cc12 |r|

Cc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)n1-c1cccc(c1)N1CCOCC1

Cc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)n1-c1cccc(c1)N1CCCCC1

CC(c1ccccc1)n1nc(NC(=O)C=C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)c2O[C@@](C)(CN3CCOCC3)Oc12

CC(C)n1ncc2c(cc(cc12)-c1ccc(nc1)N1CCN(CC1)c1ncc(cn1)C(=O)NO)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC[C@@H](C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O |r|

COc1cc2nc(NCCCN(C)C)nc(NC3CCN(CCCc4ccccc4)CC3)c2cc1OC

COc1cc2c(NC3CCN(Cc4ccccc4)CC3)nc(NCCCN(C)C)nc2cc1OCc1ccccc1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(-c2ccc(nc2)N2CCOCC2)c2ccn(C(C)C)c2c1C

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(nc2n(ncc12)C(C)C)-c1ccncc1

CC(C)n1ncc2c(cc(nc12)-c1ccncc1)C(=O)NCc1c(C)c(F)c(C)[nH]c1=O

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(NC(C)C)c1C)-c1ccc(nc1)N1CCN(C)CC1

Cc1cc(C)c(CNC(=O)c2ccc(Oc3cccc(-c4ccnnc4)c3C#N)c(Cl)c2)c(=O)[nH]1

[2H]C([2H])(NC(=O)c1c(C)n([C@H](C)C2CCC(CC2)OC)c2ccccc12)c1c(SC)cc(C)[nH]c1=O |r,wD:10.10,(-4.41,-3.31,;-4.01,-1.83,;-2.93,-2.91,;-2.68,-1.06,;-1.35,-1.83,;-1.35,-3.37,;-.01,-1.06,;.15,.48,;-.94,1.56,;1.65,.8,;2.42,2.13,;1.65,3.46,;3.96,2.13,;4.73,3.46,;6.27,3.46,;7.04,2.13,;6.28,.8,;4.74,.79,;8.58,2.13,;9.35,3.46,;2.42,-.54,;3.92,-.86,;4.4,-2.32,;3.38,-3.46,;1.87,-3.15,;1.39,-1.68,;-5.35,-1.06,;-5.35,.48,;-4.01,1.25,;-4.01,2.79,;-6.68,1.25,;-8.02,.48,;-9.35,1.25,;-8.02,-1.06,;-6.68,-1.83,;-6.68,-3.37,)|

[2H]C([2H])([2H])Sc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCC(CC2)OC)c2ccc(cc12)-c1cnn(C)c1 |r,wD:21.22,(-2.68,5.46,;-4.01,4.69,;-5.35,5.46,;-4.01,6.23,;-4.01,3.15,;-5.35,2.38,;-6.68,3.15,;-8.02,2.38,;-9.35,3.15,;-8.02,.84,;-6.68,.07,;-6.68,-1.47,;-5.35,.84,;-4.01,.07,;-2.68,.84,;-1.35,.07,;-1.35,-1.47,;-.01,.84,;.15,2.37,;-.94,3.46,;1.65,2.69,;2.42,4.03,;1.65,5.36,;3.96,4.03,;4.73,5.36,;6.27,5.36,;7.04,4.02,;6.28,2.7,;4.74,2.69,;8.58,4.02,;9.35,5.36,;2.42,1.36,;3.92,1.04,;4.4,-.43,;3.38,-1.57,;1.87,-1.26,;1.39,.21,;3.78,-3.05,;2.81,-4.25,;3.65,-5.54,;5.13,-5.14,;6.22,-6.23,;5.21,-3.61,)|

[H][C@@]1(CC[C@@H](CC1)N(C)C)[C@]1(C)Oc2c(O1)c(Cl)c1CCN(Cc3c(SC)cc(C)[nH]c3=O)C(=O)c1c2C |r,wU:4.7,1.0,wD:10.11,(4.02,.48,;5.35,-.29,;6.84,-.69,;7.93,.4,;7.53,1.89,;6.04,2.29,;4.95,1.2,;8.62,2.98,;8.22,4.46,;10.11,2.58,;4.26,-1.38,;5.6,-2.15,;3.36,-.13,;1.89,-.61,;1.89,-2.15,;3.36,-2.62,;.57,-2.92,;.57,-4.46,;-.77,-2.16,;-2.11,-2.93,;-3.45,-2.16,;-3.44,-.61,;-4.77,.15,;-6.11,-.62,;-6.1,-2.16,;-4.77,-2.93,;-4.77,-4.46,;-7.44,-2.93,;-8.77,-2.16,;-10.11,-2.93,;-8.77,-.62,;-7.44,.15,;-7.44,1.69,;-2.11,.16,;-2.11,1.7,;-.77,-.61,;.56,.16,;.56,1.7,)|

[H][C@@]1(CC[C@@H](CC1)N(C)C)C1(C)Oc2c(O1)c(Br)c1CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c1c2C |r,wU:4.7,1.0,(4.02,.48,;5.35,-.29,;6.84,-.69,;7.93,.4,;7.53,1.89,;6.04,2.28,;4.95,1.2,;8.62,2.97,;8.22,4.46,;10.11,2.58,;4.26,-1.38,;5.6,-2.15,;3.36,-.14,;1.89,-.61,;1.89,-2.15,;3.36,-2.63,;.57,-2.92,;.57,-4.46,;-.77,-2.16,;-2.11,-2.94,;-3.45,-2.16,;-3.44,-.62,;-4.77,.15,;-6.11,-.62,;-6.1,-2.16,;-4.77,-2.93,;-7.44,-2.93,;-8.77,-2.16,;-10.11,-2.93,;-8.77,-.62,;-7.44,.15,;-7.44,1.69,;-2.11,.15,;-2.11,1.69,;-.77,-.61,;.56,.16,;.56,1.7,)|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n(C(C)C2CCOCC2)c2ccccc12

COc1cc(C)[nH]c(=O)c1CN1CCn2ccc3cc(-c4c(C)noc4C)c(Cl)c(C1=O)c23 |(-2.58,-3.36,;-2.58,-1.82,;-3.92,-1.05,;-5.25,-1.83,;-6.58,-1.06,;-7.92,-1.83,;-6.58,.48,;-5.25,1.26,;-5.25,2.8,;-3.92,.49,;-2.58,1.26,;-1.25,.49,;-1.77,-.94,;-.96,-2.24,;.57,-2.43,;1.4,-3.84,;2.91,-3.52,;3.07,-1.98,;4.31,-1.07,;4.15,.45,;5.48,1.22,;5.64,2.75,;4.55,3.84,;7.15,3.07,;7.92,1.74,;6.89,.6,;7.28,-.89,;2.74,1.08,;2.74,2.62,;1.5,.18,;.16,.94,;.16,2.48,;1.66,-1.36,)|

CCN(C1CCC(F)(F)CC1)c1cc(Cl)cc2c1C\C=C\CCc1cc(C)[nH]c(=O)c1CNC2=O |t:21|

CC(C)n1cc2\C=C\CCc3cc(C)[nH]c(=O)c3CNC(=O)c3cc(Cl)cc1c23 |t:6|

CC(C)n1cc2C\C=C\CCc3cc(C)[nH]c(=O)c3CNC(=O)c3cc(cc1c23)-c1ccc(nc1)N1CCNCC1 |t:7|

C\C=C(/[C@H]1CC[C@@H](CC1)N(C)C)c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(7.71,-2.37,;6.62,-1.28,;5.14,-1.67,;4.74,-3.16,;3.25,-3.56,;2.85,-5.05,;3.94,-6.14,;5.43,-5.74,;5.83,-4.25,;3.54,-7.62,;4.63,-8.71,;2.05,-8.02,;4.05,-.59,;2.51,-.59,;2.03,.88,;3.28,1.78,;3.28,3.32,;1.94,4.09,;4.61,4.09,;4.61,5.63,;5.94,6.4,;5.94,7.94,;4.61,8.71,;7.28,8.71,;8.61,7.94,;9.94,8.71,;8.61,6.4,;7.28,5.63,;7.28,4.09,;4.52,.88,;5.86,1.65,)|

CN(C)[C@H]1CC[C@@H](CC1)Oc1cc(Cl)cc(C(=O)NCc2c(C)[nH]c(C)cc2=O)c1C |r,wU:3.2,wD:6.9,(10,-.77,;8.67,-1.54,;8.67,-3.08,;7.33,-.77,;6,-1.54,;4.66,-.77,;4.66,.77,;6,1.54,;7.33,.77,;3.33,1.54,;2,.77,;2,-.77,;.67,-1.54,;.67,-3.08,;-.67,-.78,;-.67,.77,;-2,1.54,;-2,3.08,;-3.33,.77,;-4.67,1.54,;-6,.77,;-6,-.77,;-4.67,-1.54,;-7.33,-1.54,;-8.67,-.77,;-10,-1.54,;-8.67,.77,;-7.33,1.54,;-7.33,3.08,;.67,1.54,;.67,3.08,)|

c1cnc(c2c1n(cn2)[C@@H]3C=C([C@H]([C@H]3O)O)CO)N

C[C@H](C(=O)NC1COC1)c1cnc(NC[C@H]2CC[C@@H](CC2)Nc2ccc3ccnc(Cl)c3n2)nc1 |r,wU:15.15,wD:18.22,1.0,(6.38,4.23,;6.38,2.69,;7.71,1.92,;7.71,.38,;9.04,2.69,;10.38,1.92,;11.89,2.33,;12.29,.84,;10.78,.44,;5.04,1.92,;3.71,2.7,;2.38,1.93,;2.38,.39,;1.04,-.38,;-.29,.39,;-1.62,-.38,;-1.62,-1.92,;-2.96,-2.69,;-4.29,-1.92,;-4.29,-.38,;-2.96,.39,;-5.63,-2.69,;-6.96,-1.92,;-6.96,-.39,;-8.3,.38,;-9.63,-.39,;-10.96,.38,;-12.29,-.39,;-12.29,-1.93,;-10.95,-2.69,;-10.95,-4.23,;-9.63,-1.93,;-8.29,-2.7,;3.72,-.38,;5.05,.39,)|

CC(C)n1ncc2cc(cc(-c3ccc(nc3)N3CCN(CCOCCC(=O)Nc4cccc5C(=O)N(C6CCC(=O)NC6=O)C(=O)c45)CC3)c12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(NC(=O)C=C)nn1Cc1ccccc1

Cc1c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(NC(=O)C=C)nn1Cc1ccc(cc1)-c1ccccc1

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c[nH]c(C)cc2=O)c1C |r,wU:6.9,wD:3.2,(2,3.47,;3.33,2.7,;3.33,1.16,;4.66,.38,;4.66,-1.16,;6,-1.93,;7.33,-1.16,;7.33,.38,;6,1.16,;8.67,-1.93,;10,-1.16,;8.67,-3.47,;2,.38,;2,-1.16,;.67,-1.92,;.67,-3.47,;-.67,-1.16,;-.67,.38,;-2,1.15,;-2,2.69,;-3.33,.38,;-4.67,1.15,;-6,.38,;-6,-1.16,;-7.33,-1.93,;-8.67,-1.16,;-10,-1.93,;-8.67,.38,;-7.33,1.15,;-7.33,2.69,;.67,1.15,;.67,2.69,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Br)cc(C(=O)NCc2c[nH]c(C)cc2=O)c1C |r,wU:6.9,wD:3.2,(2,3.47,;3.33,2.7,;3.33,1.16,;4.66,.38,;4.66,-1.16,;6,-1.93,;7.33,-1.16,;7.33,.38,;6,1.16,;8.67,-1.93,;10,-1.16,;8.67,-3.47,;2,.38,;2,-1.16,;.67,-1.92,;.67,-3.47,;-.67,-1.16,;-.67,.38,;-2,1.15,;-2,2.69,;-3.33,.38,;-4.67,1.15,;-6,.38,;-6,-1.16,;-7.33,-1.93,;-8.67,-1.16,;-10,-1.93,;-8.67,.38,;-7.33,1.15,;-7.33,2.69,;.67,1.15,;.67,2.69,)|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(Cl)cc(C)c[n+]2[O-])c1C)-c1ccc(CN2CCOCC2)cc1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2N(NCc12)C(C)C)-c1ccc(nc1)N1CCN(CC1)C(C)C

CCCc1cc(C)n(C)c(=O)c1CN(C)C(=O)c1cc(cc2N(NCc12)C(C)C)-c1ccc(nc1)N1CCN(CC1)C(C)C

[H][C@@]1(CC[C@@H](CC1)N(C)C)[C@@]1(C)Oc2c(O1)c(C)c(cc2Br)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:4.7,1.0,wD:10.11,(3.73,.93,;5.06,.16,;6.39,-.61,;7.73,.16,;7.73,1.7,;6.39,2.47,;5.06,1.7,;9.06,2.47,;9.06,4.01,;10.4,1.7,;3.97,-.93,;5.31,-1.7,;3.07,-2.18,;1.6,-1.7,;1.6,-.16,;3.07,.32,;.27,.61,;.27,2.15,;-1.06,-.16,;-1.06,-1.71,;.28,-2.47,;.28,-4.01,;-2.4,.61,;-2.4,2.15,;-3.73,-.16,;-5.06,.6,;-6.4,-.17,;-6.4,-1.71,;-5.06,-2.48,;-7.73,-2.48,;-9.06,-1.71,;-10.4,-2.48,;-9.06,-.17,;-7.73,.6,;-7.73,2.14,)|

Cc1cc2CC\C=C/Cc3c(O[C@H]4CC[C@H](N)CC4)cc(Cl)cc3C(=O)NCc2c(=O)[nH]1 |r,wU:15.15,wD:12.11,c:6,(8,-0,;6.66,.77,;5.33,-0,;4,.77,;2.66,-0,;2.66,-1.54,;1.33,-2.31,;-0,-1.54,;-0,-0,;-1.34,.77,;-2.66,0,;-2.66,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.66,-2.31,;-6.66,-3.85,;-8,-4.62,;-5.33,-4.62,;-4,-3.85,;-4,.76,;-4,2.31,;-5.33,3.08,;-2.67,3.08,;-1.34,2.31,;-0,3.08,;-0,4.62,;1.33,2.31,;2.66,3.08,;4,2.31,;5.33,3.08,;5.33,4.62,;6.66,2.31,)|

CCN(C1CCC(CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(OCCOC)cc1 |(-6.66,1.53,;-5.33,.76,;-3.99,1.53,;-3.99,3.07,;-5.33,3.84,;-5.33,5.38,;-3.99,6.15,;-2.66,5.38,;-2.66,3.84,;-3.99,7.69,;-5.33,8.47,;-2.66,8.47,;-2.66,.76,;-1.33,1.53,;-.01,.77,;-.01,-.77,;-1.33,-1.53,;-1.33,-3.07,;.01,-3.84,;-2.66,-3.84,;-2.66,-5.38,;-3.99,-6.15,;-3.99,-7.7,;-2.66,-8.47,;-5.33,-8.47,;-6.66,-7.7,;-7.99,-8.47,;-6.66,-6.15,;-5.33,-5.38,;-5.33,-3.84,;-2.66,-.78,;-3.99,-1.55,;1.33,1.54,;1.33,3.08,;2.66,3.84,;3.99,3.07,;5.32,3.84,;6.65,3.07,;6.66,1.53,;7.99,.77,;7.99,-.77,;4,1.54,;2.67,.76,)|

CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C#CCN1CCOCC1 |r,wU:3.2,wD:6.9,(-6,1.54,;-4.67,.77,;-3.33,1.54,;-3.33,3.08,;-4.67,3.85,;-4.67,5.39,;-3.33,6.16,;-2,5.39,;-2,3.85,;-3.33,7.7,;-2,8.47,;-4.67,8.47,;-6,7.7,;-7.34,8.47,;-8.67,7.7,;-2,.77,;-.67,1.54,;.67,.77,;.67,-.77,;-.67,-1.54,;-.67,-3.08,;.67,-3.85,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-3.33,-7.7,;-2,-8.47,;-4.67,-8.47,;-6,-7.7,;-7.34,-8.47,;-6,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-2,-.77,;-3.33,-1.54,;2,1.54,;3.33,2.31,;4.67,3.08,;6,2.31,;6,.77,;7.34,,;8.67,.77,;8.67,2.31,;7.34,3.08,)|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(OC)cc(C)[nH]c2=O)c1C)-c1ccc2CCC(N3CCOCC3)c2c1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2c(ncn12)[C@H](C)CC)-c1ccc(nc1)N1CCNCC1 |r|

CC(C)Oc1cc(C)[nH]c(=O)c1CNC(=O)c1ccc2c(cc(C)nc2c1C)-c1ccc(nc1)N1CCN(C)CC1

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(C(CC)CC)c(=O)ccc12)-c1ccc(cc1)N1CCNCC1

CCC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCC1=C(O)NN(CC)C1C |c:34|

CCC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(O)nn(CC)c1C

CN1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2c(C)nn(c2c1)S(=O)(=O)C1(CC=C)CC1

COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n(C(C)C2CCN(C)C(C2)C(F)(F)F)c2ccccc12

CCN([C@H]1CC[C@@H](CC1)N1CC(C1)OC)c1c(CC)c(cc2n(C)ncc12)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,wU:3.2,wD:6.9,(-2.75,-10.21,;-2.75,-8.67,;-1.42,-7.9,;-.08,-8.67,;1.25,-7.9,;2.58,-8.67,;2.58,-10.21,;1.25,-10.98,;-.08,-10.21,;3.92,-10.98,;4.32,-12.47,;5.8,-12.07,;5.41,-10.58,;7.14,-12.84,;8.47,-12.07,;-1.42,-6.36,;-.08,-5.59,;1.25,-6.36,;2.58,-5.59,;-.08,-4.05,;-1.42,-3.28,;-2.75,-4.05,;-4.21,-3.58,;-4.69,-2.11,;-5.12,-4.82,;-4.21,-6.07,;-2.75,-5.59,;1.25,-3.28,;1.25,-1.74,;2.58,-4.05,;3.92,-3.28,;5.25,-4.05,;5.25,-5.59,;3.92,-6.36,;6.59,-6.36,;7.92,-5.59,;9.25,-6.36,;7.92,-4.05,;6.59,-3.28,;6.59,-1.74,)|

COc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2c(ccn2c(C(=C)N2CCOCC2)c1C)-c1ccnc(c1)N(C)C

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc2c(NCc3c(C)cc(C)[nH]c3=O)nccc12)-c1cnc(nc1)N1CCN(C)CC1 |r,wU:6.9,wD:3.2,(2,8.08,;3.33,7.31,;3.33,5.77,;4.66,5,;4.66,3.46,;6,2.69,;7.33,3.46,;7.33,5,;6,5.77,;8.66,2.69,;10,3.46,;8.66,1.15,;2,5,;2,3.47,;.69,2.7,;-.66,3.45,;-.66,4.99,;-2,5.75,;-3.33,4.98,;-4.66,5.75,;-6,4.98,;-6,3.44,;-4.66,2.67,;-7.33,2.67,;-8.66,3.44,;-10,2.67,;-8.66,4.98,;-7.33,5.75,;-7.33,7.29,;-2,7.3,;-.66,8.07,;.67,7.3,;.67,5.76,;.69,1.16,;-.63,.38,;-.63,-1.16,;.71,-1.92,;2.03,-1.14,;2.03,.4,;.71,-3.46,;2.06,-4.22,;2.06,-5.76,;.74,-6.54,;.74,-8.08,;-.6,-5.78,;-.6,-4.24,)|

CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc2c(NCc3c(C)cc(C)[nH]c3=O)nccc12)-c1ccc(CN2CCN(C)CC2)nc1 |r,wU:3.2,wD:6.9,(2,7.3,;3.33,6.53,;3.33,4.99,;4.66,4.22,;6,4.99,;7.33,4.22,;7.33,2.68,;6,1.91,;4.66,2.68,;8.66,1.91,;10,2.68,;8.66,.37,;2,4.22,;2,2.69,;.69,1.92,;-.66,2.67,;-.66,4.21,;-2,4.97,;-3.33,4.2,;-4.66,4.97,;-6,4.2,;-6,2.66,;-4.66,1.89,;-7.33,1.89,;-8.66,2.66,;-10,1.89,;-8.66,4.2,;-7.33,4.97,;-7.33,6.51,;-2,6.52,;-.66,7.29,;.67,6.52,;.67,4.98,;.69,.38,;-.63,-.4,;-.63,-1.94,;.71,-2.7,;.71,-4.24,;2.06,-5,;3.39,-4.22,;4.73,-4.98,;4.74,-6.52,;6.08,-7.29,;3.42,-7.3,;2.07,-6.54,;2.03,-1.92,;2.03,-.38,)|

COC1CN(C1)[C@H]1CC[C@@H](CC1)[C@@H](C)c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r,wU:6.6,wD:12.14,9.9,(11.22,3.42,;10.45,2.09,;8.91,2.09,;7.82,3.18,;6.71,2.07,;7.8,.98,;5.17,2.07,;4.4,.74,;2.86,.74,;2.09,2.07,;2.86,3.41,;4.4,3.41,;.55,2.07,;-.22,3.41,;-.22,.74,;.55,-.6,;-.48,-1.74,;-1.88,-1.11,;-3.22,-1.88,;-3.22,-3.42,;-4.55,-1.11,;-5.88,-1.88,;-7.22,-1.11,;-7.22,.43,;-5.88,1.2,;-8.55,1.2,;-9.89,.43,;-11.22,1.2,;-9.89,-1.11,;-8.55,-1.88,;-8.55,-3.42,;-1.72,.42,;-2.81,1.51,)|

COC1CN(C1)[C@H]1CC[C@@H](CC1)[C@@H](C)c1sc2CCCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1C |r,wU:9.9,12.14,wD:6.6,(10.07,6.78,;8.53,6.78,;7.76,5.44,;6.28,5.04,;6.67,3.56,;8.16,3.96,;5.9,2.22,;4.36,2.22,;3.59,.89,;4.36,-.44,;5.9,-.44,;6.67,.89,;3.59,-1.78,;4.36,-3.11,;2.05,-1.78,;1.15,-.53,;-.32,-1.01,;-1.52,-.05,;-3.02,-.39,;-3.69,-1.78,;-3.02,-3.16,;-3.98,-4.37,;-5.5,-4.14,;-6.07,-2.71,;-5.11,-1.5,;-7.59,-2.48,;-8.55,-3.68,;-10.07,-3.45,;-7.99,-5.11,;-6.46,-5.34,;-5.9,-6.78,;-1.52,-3.51,;-1.18,-5.01,;-.32,-2.55,;1.15,-3.02,;1.62,-4.49,)|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3CCCCCc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3CCCCCCc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CN1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2ccn(c2c1)S(=O)(=O)C1(CC=C)CC1

CN1CCN(CC1)c1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2c(C)cn(c2c1)S(=O)(=O)C1(CC=C)CC1

COc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(cc(C)c12)S(=O)(=O)C1(CC=C)CC1)-c1ccc(nc1)N1CCN(C)CC1

CN1CCN(CC1)c1ccc(cn1)-c1cc2N(CCc2c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O)S(=O)(=O)C1(CC=C)CC1

CC1CN(c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)-c1ccc(nc1)N1CCN(C)CC1)S(=O)(=O)C1(CC=C)CC1

CCN(C1CCN(CC1)C(=O)C=C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1

CCN(C1CCN(CC1)C(=O)C=C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCCC2)cc1

CNc1ncc(cn1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)c(c1)-c1c(C)cnn1C |(4.12,-6.31,;2.79,-5.54,;2.79,-4,;4.12,-3.23,;4.12,-1.7,;2.79,-.93,;1.45,-1.7,;1.46,-3.24,;2.79,.61,;1.45,1.37,;1.45,2.92,;.12,3.69,;.12,5.23,;-1.22,2.92,;-2.55,3.69,;-3.88,2.92,;-3.88,1.38,;-2.55,.61,;-5.22,.61,;-6.55,1.38,;-7.88,.61,;-6.55,2.92,;-5.22,3.69,;-5.22,5.23,;2.78,3.69,;2.78,5.23,;4.11,2.92,;4.11,1.38,;5.45,3.69,;5.61,5.22,;4.52,6.31,;7.11,5.54,;7.88,4.21,;6.85,3.07,;7.25,1.58,)|

CCN(C1CCCCC1)c1cc(cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(C)CC2)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C)-c1ccc(cc1)N1CCN(C)CC1

Cc1cc(C)c(CNC(=O)c2cnn(c2)-c2ccccc2)c(=O)[nH]1

CC(C)n1ncc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

COc1cccc2nc(Cl)cc(NC3CCN(Cc4ccccc4)CC3)c12

COc1cccc2nc(cc(NC3CCN(C)CC3)c12)N1CCCN(C)CC1

COc1ccc2nc(cc(NC3CCN(C)CC3)c2c1)N1CCCN(C)CC1

COc1ccc2c(NC3CCN(C)CC3)cc(nc2c1)N1CCCN(C)CC1

COc1cccc2c(NC3CCN(C)CC3)cc(nc12)N1CCCN(C)CC1

Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCNC(=O)c2ccc(cc2)-c2cnc(NCc3ccco3)n3cnnc23)C(C)(C)C)cc1 |r|

Cc1ccc2ccc(N[C@H]3CC[C@H](CNc4ncc(CC(=O)NC5COC5)cn4)CC3)nc2c1Cl |r,wU:12.12,wD:9.8,(-12.96,-1.93,;-11.62,-1.16,;-11.62,.38,;-10.29,1.15,;-8.96,.38,;-7.63,1.15,;-6.3,.38,;-6.29,-1.15,;-4.96,-1.92,;-3.62,-1.15,;-2.29,-1.92,;-.96,-1.15,;-.96,.39,;.38,1.16,;1.71,.39,;3.04,1.16,;3.04,2.7,;4.38,3.47,;5.71,2.69,;7.04,3.46,;8.38,2.69,;8.38,1.15,;9.71,3.46,;11.04,2.69,;12.56,3.1,;12.96,1.61,;11.44,1.21,;5.71,1.16,;4.38,.39,;-2.29,1.16,;-3.62,.39,;-7.62,-1.93,;-8.96,-1.16,;-10.29,-1.93,;-10.29,-3.47,)|

Cc1ccc2ccc(N[C@H]3CC[C@H](CNc4ncc(cn4)C(F)(F)C(=O)NC4COC4)CC3)nc2c1Cl |r,wU:12.12,wD:9.8,(-12.96,-2.6,;-11.62,-1.83,;-11.62,-.28,;-10.29,.48,;-8.96,-.28,;-7.63,.48,;-6.3,-.29,;-6.29,-1.82,;-4.96,-2.59,;-3.62,-1.82,;-2.29,-2.59,;-.96,-1.82,;-.96,-.28,;.38,.49,;1.71,-.28,;3.04,.49,;3.04,2.03,;4.37,2.8,;5.71,2.03,;5.71,.49,;4.38,-.28,;7.04,2.8,;7.81,4.13,;6.27,4.13,;8.38,2.03,;8.38,.49,;9.71,2.8,;11.04,2.03,;12.56,2.43,;12.96,.94,;11.44,.54,;-2.29,.49,;-3.62,-.28,;-7.62,-2.6,;-8.96,-1.82,;-10.28,-2.59,;-10.28,-4.13,)|

Cc1ccc2ccc(N[C@H]3CC[C@H](CNc4ncc(cn4)C(C#N)C(=O)NC4COC4)CC3)nc2c1Cl |r,wU:12.12,wD:9.8,(-12.96,-3.47,;-11.62,-2.7,;-11.62,-1.16,;-10.29,-.39,;-8.96,-1.16,;-7.63,-.39,;-6.3,-1.16,;-6.29,-2.69,;-4.96,-3.46,;-3.62,-2.69,;-2.29,-3.46,;-.96,-2.69,;-.96,-1.15,;.38,-.38,;1.71,-1.15,;3.04,-.38,;3.04,1.16,;4.37,1.93,;5.71,1.15,;5.71,-.38,;4.38,-1.15,;7.04,1.92,;7.04,3.46,;7.04,5,;8.38,1.15,;8.38,-.39,;9.71,1.92,;11.04,1.15,;12.56,1.56,;12.96,.07,;11.44,-.33,;-2.29,-.38,;-3.62,-1.15,;-7.62,-3.47,;-8.96,-2.7,;-10.28,-3.46,;-10.28,-5,)|

Cc1ccc2ccc(N[C@H]3CC[C@H](CNc4ncc(cn4)C(CO)C(=O)NC4COC4)CC3)nc2c1Cl |r,wU:12.12,wD:9.8,(-12.96,-3.09,;-11.62,-2.32,;-11.62,-.77,;-10.29,-0,;-8.96,-.77,;-7.63,-0,;-6.3,-.77,;-6.29,-2.31,;-4.96,-3.08,;-3.62,-2.31,;-2.29,-3.08,;-.96,-2.31,;-.96,-.77,;.38,0,;1.71,-.77,;3.04,0,;3.04,1.54,;4.37,2.31,;5.71,1.54,;5.71,.01,;4.38,-.77,;7.04,2.31,;7.04,3.85,;5.71,4.62,;8.38,1.54,;8.38,-0,;9.71,2.31,;11.04,1.54,;12.56,1.95,;12.96,.46,;11.44,.05,;-2.29,0,;-3.62,-.77,;-7.62,-3.08,;-8.96,-2.31,;-10.28,-3.08,;-10.28,-4.62,)|

Cc1ccc2ccc(N[C@H]3CC[C@H](CNc4ncc(cn4)C(O)C(=O)NC4COC4)CC3)nc2c1Cl |r,wU:12.12,wD:9.8,(-12.96,-2.7,;-11.62,-1.93,;-11.62,-.39,;-10.29,.38,;-8.96,-.39,;-7.63,.38,;-6.3,-.39,;-6.29,-1.92,;-4.96,-2.69,;-3.62,-1.92,;-2.29,-2.69,;-.96,-1.92,;-.96,-.38,;.38,.39,;1.71,-.38,;3.04,.39,;3.04,1.93,;4.37,2.69,;5.71,1.92,;5.71,.39,;4.38,-.38,;7.04,2.69,;7.04,4.23,;8.38,1.92,;8.38,.38,;9.71,2.69,;11.04,1.92,;12.56,2.33,;12.96,.84,;11.44,.44,;-2.29,.39,;-3.62,-.38,;-7.62,-2.7,;-8.96,-1.93,;-10.28,-2.69,;-10.28,-4.23,)|

Cc1ccc2ccc(N[C@H]3CC[C@H](CNc4ccc(CC(=O)NC5COC5)cn4)CC3)nc2c1Cl |r,wU:12.12,wD:9.8,(-12.96,-1.93,;-11.62,-1.16,;-11.62,.38,;-10.29,1.15,;-8.96,.38,;-7.63,1.15,;-6.3,.38,;-6.29,-1.15,;-4.96,-1.92,;-3.62,-1.15,;-2.29,-1.92,;-.96,-1.15,;-.96,.39,;.38,1.16,;1.71,.39,;3.04,1.16,;3.04,2.7,;4.38,3.46,;5.71,2.69,;7.04,3.46,;8.38,2.69,;8.38,1.15,;9.71,3.46,;11.04,2.69,;12.56,3.1,;12.96,1.61,;11.44,1.21,;5.71,1.16,;4.38,.38,;-2.29,1.16,;-3.62,.39,;-7.62,-1.93,;-8.96,-1.16,;-10.29,-1.92,;-10.29,-3.46,)|

N[C@@H](CCSC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)n1cnc2c(N)ncnc12)C(=O)NCc1cc([nH]n1)-c1ccccc1 |r|

CCC(CC)n1ncc2c(cc(nc12)C1CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1cc(c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(C)CC2)cc1

[H][C@@]1(CC[C@@H](CC1)N1CC(C1)OC1CC1)[C@H](C)n1c(C)c(C(=O)NCc2c(SC)cc(C)[nH]c2=O)c2ccccc12 |r,wU:15.18,wD:4.7,1.0,(.87,-.92,;-.67,-.92,;.1,-2.26,;-.67,-3.59,;-2.21,-3.59,;-2.98,-2.26,;-2.21,-.92,;-2.98,-4.92,;-2.58,-6.44,;-4.07,-6.83,;-4.47,-5.32,;-4.84,-8.17,;-4.07,-9.5,;-4.07,-11.05,;-2.73,-10.27,;.1,.41,;1.64,.41,;-.67,1.75,;-.2,3.21,;1.29,3.61,;-1.44,4.11,;-1.44,5.65,;-2.78,6.43,;-.11,6.43,;-.11,7.97,;1.22,8.74,;2.56,7.97,;2.56,6.43,;3.89,5.66,;3.89,8.74,;3.89,10.28,;5.22,11.05,;2.56,11.05,;1.22,10.28,;-.11,11.05,;-2.69,3.21,;-4.2,3.53,;-5.22,2.38,;-4.75,.93,;-3.24,.61,;-2.21,1.75,)|

Cc1coc-2c1C(=O)C(=O)c1c-2ccc2c1CC[C@@H](O)[C@]2(C)O |r|

CN(CC[C@H](N)C(O)=O)C[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)n1cnc2c(N)ncnc12 |r|

CCC(CC)n1ncc2c(cc(cc12)C#N)C(=O)NCc1c(C)cc(C)[nH]c1=O

CO[C@H](C1COC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(NC(=O)C[C@@H]2N=C(c3c(C)c(C)sc3-n3c(C)nnc23)c2ccc(Cl)cc2)cc1 |r,c:41|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNC(=O)C[C@@H]2N=C(c3c(C)c(C)sc3-n3c(C)nnc23)c2ccc(Cl)cc2)cc1 |r,c:42|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CCNC(=O)C[C@@H]2N=C(c3c(C)c(C)sc3-n3c(C)nnc23)c2ccc(Cl)cc2)cc1 |r,c:43|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(OCCNC(=O)C[C@@H]2N=C(c3c(C)c(C)sc3-n3c(C)nnc23)c2ccc(Cl)cc2)cc1 |r,c:44|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(OCCCNC(=O)C[C@@H]2N=C(c3c(C)c(C)sc3-n3c(C)nnc23)c2ccc(Cl)cc2)cc1 |r,c:45|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(OCCCCNC(=O)C[C@@H]2N=C(c3c(C)c(C)sc3-n3c(C)nnc23)c2ccc(Cl)cc2)cc1 |r,c:46|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(OCCCCCNC(=O)C[C@@H]2N=C(c3c(C)c(C)sc3-n3c(C)nnc23)c2ccc(Cl)cc2)cc1 |r,c:47|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(cc1)C(=O)NCCOCCNC(=O)C[C@@H]1N=C(c2c(C)c(C)sc2-n2c(C)nnc12)c1ccc(Cl)cc1 |r,c:52|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(NC(=O)CCCCCCNC(=O)C[C@@H]2N=C(c3c(C)c(C)sc3-n3c(C)nnc23)c2ccc(Cl)cc2)cc1 |r,c:50|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(NC(=O)CCCCCCCNC(=O)C[C@@H]2N=C(c3c(C)c(C)sc3-n3c(C)nnc23)c2ccc(Cl)cc2)cc1 |r,c:51|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(NC(=O)CCOCCOCCOCCNC(=O)C[C@@H]2N=C(c3c(C)c(C)sc3-n3c(C)nnc23)c2ccc(Cl)cc2)cc1 |r,c:55|

C[C@H](Oc1ccc(cc1)-c1cc2c(ncnc2[nH]1)C1=CCNCC1)c1ccccc1 |r,t:21|

CC(C)n1ncc2c(cc(cc12)-c1ccc(nc1)N1CCN(CCNC(=O)CCOCCNc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CC2)C(=O)CCCCCCCC(=O)N[C@H](C(=O)N2C[C@@H](C[C@H]2C(=O)NCc2ccc(cc2)-c2scnc2C)OCc2ccccc2)C(C)(C)C)cc1 |r|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCN(CC2)C(=O)CCCCCCCC(=O)N[C@H](C(=O)N2C[C@H](O)C[C@H]2C(=O)NCc2ccc(cc2)-c2scnc2C)C(C)(C)C)cc1 |r|

CC#CC(=O)NC12CC(C1)(C2)NC1=C(Cl)C(=O)c2cccnc2C1=O |c:14|

CC#CC(=O)NC12CC(C1)(C2)NC1=C(Cl)C(=O)c2ncccc2C1=O |c:14|

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cccc(NC(=O)C=C)c1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cccc(CNC(=O)C=C)c1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNC(=O)C=C)cc1

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cc(NC(=O)C=C)ccc1C

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cc(NC(=O)CC)ccc1C

CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c3CCCCc3c(C)[nH]c2=O)c1C)-c1ccc(CNC(=O)C=C)cc1

[H][C@]12[#6][C@@]3([H])[#6]=[#6]4-[#6](=O)-c5c(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6])c5-[#8][C@@]14[C@@]([#6]\[#6]=[#6](/[#6])-[#6](=O)-[#7]-[#6]-[#6]-[#8]-[#6]-[#6])([#8]C2([#6])[#6])[#6]3=O |r,t:5,TLB:52:51:6.5:1.2,THB:48:1:6.5:51.34,35:34:6.5:1.2,7:6:51.34:1.2|

Cc1cc(C)c(CNC(=O)c2cc(cc3[nH]ccc23)-c2cn(C)c(=O)c3[nH]ccc23)c(=O)[nH]1

CC(C)n1ccc2c(cc(cc12)-c1cn(C)c(=O)c2[nH]ccc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCC(C)n1ccc2c(cc(cc12)-c1cn(C)c(=O)c2[nH]ccc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCCC(C)n1ccc2c(cc(cc12)-c1cn(C)c(=O)c2[nH]ccc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

CCC(CC)n1ccc2c(cc(cc12)-c1cn(C)c(=O)c2[nH]ccc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ccc23)C2CCCC2)-c2cn(C)c(=O)c3[nH]ccc23)c(=O)[nH]1

Cc1cc(C)c(CNC(=O)c2cc(cc3n(CC4CCCCC4)ccc23)-c2cn(C)c(=O)c3[nH]ccc23)c(=O)[nH]1

Cc1[nH]c(=O)c(CNC(=O)c2cc(cc3[nH]ccc23)-c2cn(C)c(=O)c3[nH]ccc23)c2CCCCc12

CC(C)n1ccc2c(cc(cc12)-c1cn(C)c(=O)c2[nH]ccc12)C(=O)NCc1c2CCCCc2c(C)[nH]c1=O

CCC(C)n1ccc2c(cc(cc12)-c1cn(C)c(=O)c2[nH]ccc12)C(=O)NCc1c2CCCCc2c(C)[nH]c1=O

CCCC(C)n1ccc2c(cc(cc12)-c1cn(C)c(=O)c2[nH]ccc12)C(=O)NCc1c2CCCCc2c(C)[nH]c1=O

CCC(CC)n1ccc2c(cc(cc12)-c1cn(C)c(=O)c2[nH]ccc12)C(=O)NCc1c2CCCCc2c(C)[nH]c1=O

Cc1[nH]c(=O)c(CNC(=O)c2cc(cc3n(ccc23)C2CCCC2)-c2cn(C)c(=O)c3[nH]ccc23)c2CCCCc12

Cc1[nH]c(=O)c(CNC(=O)c2cc(cc3n(CC4CCCCC4)ccc23)-c2cn(C)c(=O)c3[nH]ccc23)c2CCCCc12

Cc1c[nH]c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)-c1cn(C)c(=O)c2[nH]ccc12

CCC(C)n1cc(C)c2c(cc(cc12)-c1cn(C)c(=O)c2[nH]ccc12)C(=O)NCc1c(C)cc(C)[nH]c1=O

Cc1cn(CC2CCCCC2)c2cc(cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c12)-c1cn(C)c(=O)c2[nH]ccc12

Cc1c[nH]c2cc(cc(C(=O)NCc3c4CCCCc4c(C)[nH]c3=O)c12)-c1cn(C)c(=O)c2[nH]ccc12

CCC(C)n1cc(C)c2c(cc(cc12)-c1cn(C)c(=O)c2[nH]ccc12)C(=O)NCc1c2CCCCc2c(C)[nH]c1=O

Cc1cn(CC2CCCCC2)c2cc(cc(C(=O)NCc3c4CCCCc4c(C)[nH]c3=O)c12)-c1cn(C)c(=O)c2[nH]ccc12

Cc1cc(C)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2cn(C)c(=O)c3[nH]ccc23)c(=O)[nH]1

Cc1[nH]c(=O)c(CNC(=O)c2cc(cc3n(ncc23)C2CCCC2)-c2cn(C)c(=O)c3[nH]ccc23)c2CCCCc12

CCC(C)n1cc(C)c2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O

CC(C)n1ncc2c(cc(NCCCCCNC(=O)C[C@@H]3N=C(c4c(C)c(C)sc4-n4c(C)nnc34)c3ccc(Cl)cc3)cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O |r,c:21|

CCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(NC(=O)C=C)c1C)-c1ccc(cc1)N1CCNCC1

COc1cc2nc(nc(NCc3c(C)cc(C)[nH]c3=O)c2cc1OC)N1CCCN(C)CC1

COc1cc2c(NCc3c(C)cc(C)[nH]c3=O)nc(nc2cc1OCCCN1CCCC1)N1CCC(F)(F)CC1

CCN(C1CCOCC1)c1cc(NC(=O)CC)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(NC(=O)C=C)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(NC(=O)C(C)=C)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(NC(=O)\C=C\C)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(NC(=O)\C=C\CN(C)C)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(NC(=O)\C=C\CN2CCOCC2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(NC(=O)C#CC)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C

CCN(C1CCOCC1)c1cc(NS(=O)(=O)C=C)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C