0 B8R0.23 CC(=O)C(=O)NC(C)C WXVL_AK0030SB0051 [0,0,0,0,0,0|3,0,1]=4 1 B8R0.23 CC(=O)C(=O)NC(C)C WXVL_AK0030SB0051 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.23 CC(C)CC(O)C(=O)N WXVL_AK0084SB4281 [0,0,0,0,0,0|2,0,0]=2 3 B8R0.23 CC(C)CC(O)C(=O)N WXVL_AK0084SB4281 [0,0,0,0,0,0|2,0,0]=2 4 B8R0.23 CC(C)NC(=O)C(=O)N WXVL_AK0030SB0128 [0,0,0,0,0,0|3,0,1]=4 5 B8R0.23 CC(C)NC(=O)C(=O)N WXVL_AK0030SB0128 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [1,0,0,0,0,0|2,0,0]=3 8 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [1,0,0,0,0,0|2,0,0]=3 9 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [1,0,0,0,0,0|2,0,0]=3 10 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [1,0,0,0,0,0|2,0,1]=4 11 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [1,0,0,0,0,0|2,0,1]=4 12 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [1,0,0,0,0,0|2,0,0]=3 14 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [1,0,0,0,0,0|3,0,0]=4 15 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [1,0,0,0,0,0|3,0,0]=4 16 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [1,0,0,0,0,0|3,0,0]=4 17 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [1,0,0,0,0,0|3,0,0]=4 18 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [1,0,0,0,0,0|1,0,2]=4 19 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [1,0,0,0,0,0|1,0,2]=4 20 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [1,0,0,0,0,0|1,0,0]=2 21 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [1,0,0,0,0,0|1,0,0]=2 22 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [1,0,0,0,0,0|2,0,0]=3 23 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [1,0,0,0,0,0|2,0,0]=3 24 B7R0.6 CN(C)CCC(=O)N WXVL_AK0084SB00052 [1,0,0,0,0,0|2,0,0]=3 25 B7R0.6 CN(C)CCC(=O)N WXVL_AK0084SB00052 [1,0,0,0,0,0|2,0,0]=3 26 B9R0.23 CNC(=O)C(O)CC(C)C WXVL_AK00442SB4281 [0,1,0,0,0,0|2,0,0]=3 27 B9R0.23 CNC(=O)C(O)CC(C)C WXVL_AK00442SB4281 [0,1,0,0,0,0|2,0,0]=3 28 B9R1.35 CC(=O)N1CCC(C1)C WXVL_AN0556SB0150 [0,0,0,1,0,0|3,0,0]=4 29 B9R1.35 CC(=O)N1CCC(C1)C WXVL_AN0556SB0150 [0,0,0,1,0,0|3,0,0]=4 30 B9R1.35 CC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB0150 [0,0,0,1,0,0|3,0,0]=4 31 B9R1.35 CC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB0150 [0,0,0,1,0,0|3,0,0]=4 32 B9R1.35 CC(=O)N1CC[C@H](C1)C WXVL_AN00488SB0150 [0,0,0,1,0,0|3,0,0]=4 33 B9R1.35 CC(=O)N1CC[C@H](C1)C WXVL_AN00488SB0150 [0,0,0,1,0,0|3,0,0]=4 34 B9R1.35 CN1CCC(C1)C(=O)N WXVL_AK0084SB1540 [0,0,0,1,0,0|3,0,0]=4 35 B9R1.35 CN1CCC(C1)C(=O)N WXVL_AK0084SB1540 [0,0,0,1,0,0|3,0,0]=4 36 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)N WXVL_AK0084SB0853 [0,0,0,1,0,0|3,0,0]=4 37 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)N WXVL_AK0084SB0853 [0,0,0,1,0,0|3,0,0]=4 38 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK0084SB00007 [0,0,0,1,0,0|2,0,0]=3 39 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK0084SB00007 [0,0,0,1,0,0|2,0,0]=3 40 B9R1.164 CC1(CC(C1)C(=O)N)C WXVL_AK0084SB2977 [0,0,0,1,0,0|2,0,0]=3 41 B9R1.164 CC1(CC(C1)C(=O)N)C WXVL_AK0084SB2977 [0,0,0,1,0,0|2,0,0]=3 42 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,0,0,0,1,0|3,0,0]=4 43 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,0,0,0,1,0|3,0,0]=4 44 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,0,0,0,1,0|2,0,1]=4 45 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,0,0,0,1,0|2,0,1]=4 46 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,0,0,0,1,0|2,0,0]=3 47 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,0,0,0,1,0|2,0,0]=3 48 B9R0.7 CC(=O)C(=O)NCC(C)C WXVL_AK00544SB0051 [0,0,0,0,0,1|2,0,1]=4 49 B9R0.7 CC(=O)C(=O)NCC(C)C WXVL_AK00544SB0051 [0,0,0,0,0,1|2,0,1]=4 50 B9R0.7 CC(C)CNC(=O)C(=O)N WXVL_AK00544SB0128 [0,0,0,0,0,1|2,0,1]=4 51 B9R0.7 CC(C)CNC(=O)C(=O)N WXVL_AK00544SB0128 [0,0,0,0,0,1|2,0,1]=4 52 B9R0.53 CC(=O)NC(C)CN(C)C WXVL_AK0938SB0150 [0,0,0,0,0,1|3,0,0]=4 53 B9R0.53 CC(=O)NC(C)CN(C)C WXVL_AK0938SB0150 [0,0,0,0,0,1|3,0,0]=4 54 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [2,0,0,0,0,0|0,0,1]=3 55 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [2,0,0,0,0,0|0,0,1]=3 56 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [2,0,0,0,0,0|1,0,1]=4 57 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [2,0,0,0,0,0|1,0,1]=4 58 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [2,0,0,0,0,0|1,0,1]=4 59 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [2,0,0,0,0,0|1,0,1]=4 60 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [2,0,0,0,0,0|2,0,0]=4 61 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [2,0,0,0,0,0|2,0,0]=4 62 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [2,0,0,0,0,0|2,0,0]=4 63 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [2,0,0,0,0,0|2,0,0]=4 64 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [2,0,0,0,0,0|2,0,0]=4 65 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [2,0,0,0,0,0|2,0,0]=4 66 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [2,0,0,0,0,0|2,0,0]=4 67 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [2,0,0,0,0,0|2,0,0]=4 68 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [2,0,0,0,0,0|2,0,0]=4 69 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [2,0,0,0,0,0|2,0,0]=4 70 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [2,0,0,0,0,0|2,0,0]=4 71 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [2,0,0,0,0,0|2,0,0]=4 72 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [2,0,0,0,0,0|2,0,0]=4 73 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [2,0,0,0,0,0|2,0,0]=4 74 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [2,0,0,0,0,0|2,0,0]=4 75 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [2,0,0,0,0,0|2,0,0]=4 76 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [1,1,0,0,0,0|2,0,0]=4 77 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [1,1,0,0,0,0|2,0,0]=4 78 B8R0.3 CCC[C@H](O)C(=O)NC WXVL_AK00442SB3627 [1,1,0,0,0,0|2,0,0]=4 79 B8R0.3 CCC[C@H](O)C(=O)NC WXVL_AK00442SB3627 [1,1,0,0,0,0|2,0,0]=4 80 B8R0.8 CCCCC(O)C(=O)N WXVL_AK0084SB3429 [1,1,0,0,0,0|2,0,0]=4 81 B8R0.8 CCCCC(O)C(=O)N WXVL_AK0084SB3429 [1,1,0,0,0,0|2,0,0]=4 82 B8R0.12 CCCC(C)(C)C(=O)N WXVL_AK0084SB0372 [1,1,0,0,0,0|2,0,0]=4 83 B8R0.12 CCCC(C)(C)C(=O)N WXVL_AK0084SB0372 [1,1,0,0,0,0|2,0,0]=4 84 B8R0.9 C#CC(=O)NCC(C)C WXVL_AK00544SB0338 [1,1,0,0,0,0|2,0,0]=4 85 B8R0.9 C#CC(=O)NCC(C)C WXVL_AK00544SB0338 [1,1,0,0,0,0|2,0,0]=4 86 B8R0.9 CC(C)CNC(=O)CO WXVL_AK00544SB2706 [1,1,0,0,0,0|1,0,0]=3 87 B8R0.9 CC(C)CNC(=O)CO WXVL_AK00544SB2706 [1,1,0,0,0,0|1,0,0]=3 88 B8R0.9 CC(O)CNC(=O)CO WXVL_AK0052SB2706 [1,1,0,0,0,0|2,0,0]=4 89 B8R0.9 CC(O)CNC(=O)CO WXVL_AK0052SB2706 [1,1,0,0,0,0|2,0,0]=4 90 B8R0.9 CCC(=O)NCC(C)C WXVL_AK00544SB0064 [1,1,0,0,0,0|2,0,0]=4 91 B8R0.9 CCC(=O)NCC(C)C WXVL_AK00544SB0064 [1,1,0,0,0,0|2,0,0]=4 92 B8R0.9 CNC(=O)CCC(C)C WXVL_AK00442SB0354 [1,1,0,0,0,0|1,0,0]=3 93 B8R0.9 CNC(=O)CCC(C)C WXVL_AK00442SB0354 [1,1,0,0,0,0|1,0,0]=3 94 B8R0.9 CNC(=O)CCN(C)C WXVL_AK00442SB00052 [1,1,0,0,0,0|2,0,0]=4 95 B8R0.9 CNC(=O)CCN(C)C WXVL_AK00442SB00052 [1,1,0,0,0,0|2,0,0]=4 96 B8R0.9 CNC(=O)COC(C)C WXVL_AK00442SB0213 [1,1,0,0,0,0|2,0,0]=4 97 B8R0.9 CNC(=O)COC(C)C WXVL_AK00442SB0213 [1,1,0,0,0,0|2,0,0]=4 98 B8R0.9 CO[C@H](C)CNC(=O)C WXVL_AK00704SB0150 [1,1,0,0,0,0|2,0,0]=4 99 B8R0.9 CO[C@H](C)CNC(=O)C WXVL_AK00704SB0150 [1,1,0,0,0,0|2,0,0]=4 100 B8R0.9 C[C@H](O)CNC(=O)CO WXVL_AK0113SB2706 [1,1,0,0,0,0|2,0,0]=4 101 B8R0.9 C[C@H](O)CNC(=O)CO WXVL_AK0113SB2706 [1,1,0,0,0,0|2,0,0]=4 102 B8R0.29 CC(=O)NCC(C)(C)C WXVL_AK00655SB0150 [1,1,0,0,0,0|2,0,0]=4 103 B8R0.29 CC(=O)NCC(C)(C)C WXVL_AK00655SB0150 [1,1,0,0,0,0|2,0,0]=4 104 B8R0.29 CC(=O)NCC(C)(C)F WXVL_AK00660SB0150 [1,1,0,0,0,0|2,0,0]=4 105 B8R0.29 CC(=O)NCC(C)(C)F WXVL_AK00660SB0150 [1,1,0,0,0,0|2,0,0]=4 106 B8R0.29 CC(=O)NCC(C)(C)O WXVL_AK0490SB0150 [1,1,0,0,0,0|2,0,0]=4 107 B8R0.29 CC(=O)NCC(C)(C)O WXVL_AK0490SB0150 [1,1,0,0,0,0|2,0,0]=4 108 B8R0.29 CC(C)(C)OCC(=O)N WXVL_AK0084SB1440 [1,1,0,0,0,0|2,0,0]=4 109 B8R0.29 CC(C)(C)OCC(=O)N WXVL_AK0084SB1440 [1,1,0,0,0,0|2,0,0]=4 110 B8R0.27 CC(C)(C)[C@H](O)C(=O)N WXVL_AK0084SB3694 [0,1,0,0,1,0|2,0,0]=4 111 B8R0.27 CC(C)(C)[C@H](O)C(=O)N WXVL_AK0084SB3694 [0,1,0,0,1,0|2,0,0]=4 112 B10R0.31 CC(CC(=O)N)CC(C)(C)C WXVL_AK0084SB3346 [0,1,0,0,0,1|2,0,0]=4 113 B10R0.31 CC(CC(=O)N)CC(C)(C)C WXVL_AK0084SB3346 [0,1,0,0,0,1|2,0,0]=4 114 B10R0.44 CC(CN(C)C)NC(=O)CO WXVL_AK0938SB2706 [0,1,0,0,0,1|2,0,0]=4 115 B10R0.44 CC(CN(C)C)NC(=O)CO WXVL_AK0938SB2706 [0,1,0,0,0,1|2,0,0]=4 116 B10R0.70 CC(=O)N[C@@H](CO)CC(C)C WXVL_AK0366SB0150 [0,1,0,0,0,1|2,0,0]=4 117 B10R0.70 CC(=O)N[C@@H](CO)CC(C)C WXVL_AK0366SB0150 [0,1,0,0,0,1|2,0,0]=4 118 B10R0.70 CC(=O)N[C@H](CO)CC(C)C WXVL_AK00511SB0150 [0,1,0,0,0,1|2,0,0]=4 119 B10R0.70 CC(=O)N[C@H](CO)CC(C)C WXVL_AK00511SB0150 [0,1,0,0,0,1|2,0,0]=4 120 B10R0.32 CCNC(=O)C(O)CC(C)C WXVL_AK00476SB4281 [0,2,0,0,0,0|2,0,0]=4 121 B10R0.32 CCNC(=O)C(O)CC(C)C WXVL_AK00476SB4281 [0,2,0,0,0,0|2,0,0]=4 122 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [1,0,0,1,0,0|2,0,0]=4 123 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [1,0,0,1,0,0|2,0,0]=4 124 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [1,0,0,1,0,0|2,0,0]=4 125 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [1,0,0,1,0,0|2,0,0]=4 126 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [1,0,0,1,0,0|2,0,0]=4 127 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [1,0,0,1,0,0|2,0,0]=4 128 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [1,0,0,1,0,0|2,0,0]=4 129 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [1,0,0,1,0,0|2,0,0]=4 130 B8R1.78 CC1(CCC1)C(=O)N WXVL_AK0084SB0805 [1,0,0,1,0,0|2,0,0]=4 131 B8R1.78 CC1(CCC1)C(=O)N WXVL_AK0084SB0805 [1,0,0,1,0,0|2,0,0]=4 132 B8R1.78 NC(=O)C1(CCC1)Br WXVL_AK0084SB0465 [1,0,0,1,0,0|2,0,0]=4 133 B8R1.78 NC(=O)C1(CCC1)Br WXVL_AK0084SB0465 [1,0,0,1,0,0|2,0,0]=4 134 B8R1.78 NC(=O)C1(CCC1)F WXVL_AK0084SB0033 [1,0,0,1,0,0|2,0,0]=4 135 B8R1.78 NC(=O)C1(CCC1)F WXVL_AK0084SB0033 [1,0,0,1,0,0|2,0,0]=4 136 B8R1.35 NC(=O)CCC1CC1 WXVL_AK0084SB5360 [1,0,0,1,0,0|1,0,0]=3 137 B8R1.35 NC(=O)CCC1CC1 WXVL_AK0084SB5360 [1,0,0,1,0,0|1,0,0]=3 138 B8R1.77 CC1(CC1C(=O)N)C WXVL_AK0084SB0012 [1,0,0,1,0,0|1,0,0]=3 139 B8R1.77 CC1(CC1C(=O)N)C WXVL_AK0084SB0012 [1,0,0,1,0,0|1,0,0]=3 140 B10R1.14 CC1CCN(C1)C(=O)CO WXVL_AN0556SB2706 [0,1,0,1,0,0|2,0,0]=4 141 B10R1.14 CC1CCN(C1)C(=O)CO WXVL_AN0556SB2706 [0,1,0,1,0,0|2,0,0]=4 142 B10R1.14 CNC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK00442SB00007 [0,1,0,1,0,0|2,0,0]=4 143 B10R1.14 CNC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK00442SB00007 [0,1,0,1,0,0|2,0,0]=4 144 B10R1.14 C[C@@H]1CCN(C1)C(=O)CO WXVL_AN00488SB2706 [0,1,0,1,0,0|2,0,0]=4 145 B10R1.14 C[C@@H]1CCN(C1)C(=O)CO WXVL_AN00488SB2706 [0,1,0,1,0,0|2,0,0]=4 146 B10R1.14 C[C@H]1CCN(C1)C(=O)CO WXVL_AN00094SB2706 [0,1,0,1,0,0|2,0,0]=4 147 B10R1.14 C[C@H]1CCN(C1)C(=O)CO WXVL_AN00094SB2706 [0,1,0,1,0,0|2,0,0]=4 148 B10R1.413 CNC(=O)C1CC(C1)(C)C WXVL_AK00442SB2977 [0,1,0,1,0,0|2,0,0]=4 149 B10R1.413 CNC(=O)C1CC(C1)(C)C WXVL_AK00442SB2977 [0,1,0,1,0,0|2,0,0]=4 150 B10R1.113 CC1CCCC(C1)C(=O)N WXVL_AK0084SB5392 [0,1,0,1,0,0|2,0,0]=4 151 B10R1.113 CC1CCCC(C1)C(=O)N WXVL_AK0084SB5392 [0,1,0,1,0,0|2,0,0]=4 152 B10R2.633 NC(=O)C1CC1C2CC2 WXVL_AK0084SB3548 [0,0,0,2,0,0|2,0,0]=4 153 B10R2.633 NC(=O)C1CC1C2CC2 WXVL_AK0084SB3548 [0,0,0,2,0,0|2,0,0]=4 154 B8R0.28 CC(=CCCC(=O)N)C WXVL_AK0084SB00030 [1,0,0,0,0,1|1,0,1]=4 155 B8R0.28 CC(=CCCC(=O)N)C WXVL_AK0084SB00030 [1,0,0,0,0,1|1,0,1]=4 156 B8R0.28 CC(=O)NCCC(C)C WXVL_AK0068SB0150 [1,0,0,0,0,1|1,0,0]=3 157 B8R0.28 CC(=O)NCCC(C)C WXVL_AK0068SB0150 [1,0,0,0,0,1|1,0,0]=3 158 B8R0.28 CC(=O)NCCN(C)C WXVL_AK0058SB0150 [1,0,0,0,0,1|2,0,0]=4 159 B8R0.28 CC(=O)NCCN(C)C WXVL_AK0058SB0150 [1,0,0,0,0,1|2,0,0]=4 160 B8R0.28 CC(C)CCCC(=O)N WXVL_AK0084SB1301 [1,0,0,0,0,1|1,0,0]=3 161 B8R0.28 CC(C)CCCC(=O)N WXVL_AK0084SB1301 [1,0,0,0,0,1|1,0,0]=3 162 B8R0.28 CN(C)CCCC(=O)N WXVL_AK0084SB00055 [1,0,0,0,0,1|2,0,0]=4 163 B8R0.28 CN(C)CCCC(=O)N WXVL_AK0084SB00055 [1,0,0,0,0,1|2,0,0]=4