0 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,0,0,0,0,0|2,0,2]=4 4 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|2,0,1]=4 5 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|2,0,1]=4 6 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|1,0,1]=3 7 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|1,0,1]=3 8 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,1,0,0,0,0|1,0,1]=3 9 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,1,0,0,0,0|1,0,1]=3 10 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,1,0,0,0,0|1,0,0]=2 11 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,1,0,0,0,0|1,0,0]=2 12 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,1,0,0,0,0|1,0,1]=3 13 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,1,0,0,0,0|1,0,1]=3 14 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|2,0,1]=4 15 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|2,0,1]=4 16 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,1,0,0,0,0|2,0,1]=4 17 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,1,0,0,0,0|2,0,1]=4 18 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,1,0,0,0,0|1,0,2]=4 19 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,1,0,0,0,0|1,0,2]=4 20 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|2,0,1]=4 21 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|2,0,1]=4 22 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|1,0,1]=3 23 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|1,0,1]=3 24 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,1,0,0,0,0|2,0,1]=4 25 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,1,0,0,0,0|2,0,1]=4 26 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|2,0,1]=4 27 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,1,0,0,0,0|1,0,0]=2 29 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,1,0,0,0,0|1,0,0]=2 30 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [0,1,0,0,0,0|2,0,0]=3 31 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [0,1,0,0,0,0|2,0,0]=3 32 B6R0.3 CNC(=O)C(F)F WXVL_AK00442SB0079 [0,1,0,0,0,0|3,0,0]=4 33 B6R0.3 CNC(=O)C(F)F WXVL_AK00442SB0079 [0,1,0,0,0,0|3,0,0]=4 34 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,1,0,0,0,0|2,0,0]=3 35 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,1,0,0,0,0|2,0,0]=3 36 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,1,0,0,0,0|2,0,1]=4 37 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,1,0,0,0,0|2,0,1]=4 38 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,0]=3 39 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,0]=3 40 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|1,0,0]=3 41 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|1,0,0]=3 42 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|2,0,0]=4 43 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|2,0,0]=4 44 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|2,0,0]=4 45 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|2,0,0]=4 46 B7R0.2 C#CC(=O)NC(C)C WXVL_AK0030SB0338 [0,2,0,0,0,0|0,0,2]=4 47 B7R0.2 C#CC(=O)NC(C)C WXVL_AK0030SB0338 [0,2,0,0,0,0|0,0,2]=4 48 B7R0.2 C#C[C@@H](C)NC(=O)C WXVL_AK00735SB0150 [0,2,0,0,0,0|1,0,1]=4 49 B7R0.2 C#C[C@@H](C)NC(=O)C WXVL_AK00735SB0150 [0,2,0,0,0,0|1,0,1]=4 50 B7R0.2 C=CC(C)NC(=O)C WXVL_AK00769SB0150 [0,2,0,0,0,0|1,0,1]=4 51 B7R0.2 C=CC(C)NC(=O)C WXVL_AK00769SB0150 [0,2,0,0,0,0|1,0,1]=4 52 B7R0.2 CC(=O)NC(C)C#N WXVL_AK00810SB0150 [0,2,0,0,0,0|1,0,1]=4 53 B7R0.2 CC(=O)NC(C)C#N WXVL_AK00810SB0150 [0,2,0,0,0,0|1,0,1]=4 54 B7R0.2 CC(=O)N[C@@H](C)CF WXVL_AK00558SB0150 [0,2,0,0,0,0|1,0,0]=3 55 B7R0.2 CC(=O)N[C@@H](C)CF WXVL_AK00558SB0150 [0,2,0,0,0,0|1,0,0]=3 56 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|1,0,0]=3 57 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|1,0,0]=3 58 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,0]=3 59 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,0]=3 60 B7R0.2 CCC(=O)NC(C)C WXVL_AK0030SB0064 [0,2,0,0,0,0|0,0,1]=3 61 B7R0.2 CCC(=O)NC(C)C WXVL_AK0030SB0064 [0,2,0,0,0,0|0,0,1]=3 62 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,2,0,0,0,0|1,0,1]=4 63 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,2,0,0,0,0|1,0,1]=4 64 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,2,0,0,0,0|1,0,1]=4 65 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,2,0,0,0,0|1,0,1]=4 66 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,2,0,0,0,0|1,0,0]=3 67 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,2,0,0,0,0|1,0,0]=3 68 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|0,0,1]=3 69 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|0,0,1]=3 70 B7R0.2 CNC(=O)CC(C)C WXVL_AK00442SB0063 [0,2,0,0,0,0|0,0,1]=3 71 B7R0.2 CNC(=O)CC(C)C WXVL_AK00442SB0063 [0,2,0,0,0,0|0,0,1]=3 72 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|1,0,1]=4 73 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|1,0,1]=4 74 B7R0.2 CNC(=O)CN(C)C WXVL_AK00442SB0085 [0,2,0,0,0,0|1,0,1]=4 75 B7R0.2 CNC(=O)CN(C)C WXVL_AK00442SB0085 [0,2,0,0,0,0|1,0,1]=4 76 B7R0.3 CNC(=O)/C=C/CBr WXVL_AK00442SB0424 [0,2,0,0,0,0|1,0,1]=4 77 B7R0.3 CNC(=O)/C=C/CBr WXVL_AK00442SB0424 [0,2,0,0,0,0|1,0,1]=4 78 B7R0.5 C/C=C/C(=O)N(C)C WXVL_AN0032SB0340 [0,2,0,0,0,0|1,0,0]=3 79 B7R0.5 C/C=C/C(=O)N(C)C WXVL_AN0032SB0340 [0,2,0,0,0,0|1,0,0]=3 80 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,2,0,0,0,0|1,0,1]=4 81 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,2,0,0,0,0|1,0,1]=4 82 B7R0.5 CC#CC(=O)N(C)C WXVL_AN0032SB1240 [0,2,0,0,0,0|1,0,1]=4 83 B7R0.5 CC#CC(=O)N(C)C WXVL_AN0032SB1240 [0,2,0,0,0,0|1,0,1]=4 84 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [0,2,0,0,0,0|1,0,1]=4 85 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [0,2,0,0,0,0|1,0,1]=4 86 B7R0.5 CCNC(=O)C(C)C WXVL_AK00476SB0052 [0,2,0,0,0,0|0,0,1]=3 87 B7R0.5 CCNC(=O)C(C)C WXVL_AK00476SB0052 [0,2,0,0,0,0|0,0,1]=3 88 B7R0.5 CCNC(=O)C(C)S WXVL_AK00476SB2708 [0,2,0,0,0,0|1,0,1]=4 89 B7R0.5 CCNC(=O)C(C)S WXVL_AK00476SB2708 [0,2,0,0,0,0|1,0,1]=4 90 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,2,0,0,0,0|1,0,1]=4 91 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,2,0,0,0,0|1,0,1]=4 92 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|1,0,1]=4 93 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|1,0,1]=4 94 B7R0.5 CSCC(=O)N(C)C WXVL_AN0032SB1267 [0,2,0,0,0,0|1,0,1]=4 95 B7R0.5 CSCC(=O)N(C)C WXVL_AN0032SB1267 [0,2,0,0,0,0|1,0,1]=4 96 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [0,2,0,0,0,0|1,0,1]=4 97 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [0,2,0,0,0,0|1,0,1]=4 98 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|1,0,1]=4 99 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|1,0,1]=4 100 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [0,2,0,0,0,0|1,0,0]=3 101 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [0,2,0,0,0,0|1,0,0]=3 102 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [0,2,0,0,0,0|1,0,0]=3 103 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [0,2,0,0,0,0|1,0,0]=3 104 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [0,2,0,0,0,0|2,0,0]=4 105 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [0,2,0,0,0,0|2,0,0]=4 106 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [0,2,0,0,0,0|1,0,0]=3 107 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [0,2,0,0,0,0|1,0,0]=3 108 B7R0.9 CC(=O)NC(C)(C)C WXVL_AK0024SB0150 [0,2,0,0,0,0|1,0,0]=3 109 B7R0.9 CC(=O)NC(C)(C)C WXVL_AK0024SB0150 [0,2,0,0,0,0|1,0,0]=3 110 B7R0.9 CC(C)(C)CC(=O)N WXVL_AK0084SB0062 [0,2,0,0,0,0|1,0,1]=4 111 B7R0.9 CC(C)(C)CC(=O)N WXVL_AK0084SB0062 [0,2,0,0,0,0|1,0,1]=4 112 B7R0.9 CC(C)(O)CC(=O)N WXVL_AK0084SB0163 [0,2,0,0,0,0|1,0,1]=4 113 B7R0.9 CC(C)(O)CC(=O)N WXVL_AK0084SB0163 [0,2,0,0,0,0|1,0,1]=4 114 B7R0.16 C=C(F)C(=O)N(C)C WXVL_AN0032SB1376 [0,2,0,0,0,0|1,0,1]=4 115 B7R0.16 C=C(F)C(=O)N(C)C WXVL_AN0032SB1376 [0,2,0,0,0,0|1,0,1]=4 116 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|1,0,0]=3 117 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|1,0,0]=3 118 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,2,0,0,0,0|1,0,0]=3 119 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,2,0,0,0,0|1,0,0]=3 120 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|1,0,0]=3 121 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|1,0,0]=3 122 B7R0.16 CC(C)C(=O)N(C)C WXVL_AN0032SB0052 [0,2,0,0,0,0|1,0,0]=3 123 B7R0.16 CC(C)C(=O)N(C)C WXVL_AN0032SB0052 [0,2,0,0,0,0|1,0,0]=3 124 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,2,0,0,0,0|1,0,1]=4 125 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,2,0,0,0,0|1,0,1]=4 126 B7R0.16 CC(S)C(=O)N(C)C WXVL_AN0032SB2708 [0,2,0,0,0,0|1,0,1]=4 127 B7R0.16 CC(S)C(=O)N(C)C WXVL_AN0032SB2708 [0,2,0,0,0,0|1,0,1]=4 128 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [0,2,0,0,0,0|2,0,0]=4 129 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [0,2,0,0,0,0|2,0,0]=4 130 B7R0.16 C[C@@H](O)C(=O)N(C)C WXVL_AN0032SB1085 [0,2,0,0,0,0|1,0,1]=4 131 B7R0.16 C[C@@H](O)C(=O)N(C)C WXVL_AN0032SB1085 [0,2,0,0,0,0|1,0,1]=4 132 B7R0.13 CNS(=O)(=O)C(C)C WXVL_AK00442HU0023 [0,2,0,0,0,0|2,0,0]=4 133 B7R0.13 CNS(=O)(=O)C(C)C WXVL_AK00442HU0023 [0,2,0,0,0,0|2,0,0]=4 134 B7R0.14 CNC(=O)C(C)(C)Br WXVL_AK00442SB0432 [0,2,0,0,0,0|1,0,0]=3 135 B7R0.14 CNC(=O)C(C)(C)Br WXVL_AK00442SB0432 [0,2,0,0,0,0|1,0,0]=3 136 B7R0.14 CNC(=O)C(C)(C)C WXVL_AK00442SB0078 [0,2,0,0,0,0|1,0,0]=3 137 B7R0.14 CNC(=O)C(C)(C)C WXVL_AK00442SB0078 [0,2,0,0,0,0|1,0,0]=3 138 B7R0.14 CNC(=O)C(C)(C)F WXVL_AK00442SB0199 [0,2,0,0,0,0|1,0,0]=3 139 B7R0.14 CNC(=O)C(C)(C)F WXVL_AK00442SB0199 [0,2,0,0,0,0|1,0,0]=3 140 B7R0.14 CNC(=O)C(C)(C)O WXVL_AK00442SB0125 [0,2,0,0,0,0|1,0,0]=3 141 B7R0.14 CNC(=O)C(C)(C)O WXVL_AK00442SB0125 [0,2,0,0,0,0|1,0,0]=3 142 B7R0.14 CNC(=O)C(C)(F)F WXVL_AK00442SB0197 [0,2,0,0,0,0|2,0,0]=4 143 B7R0.14 CNC(=O)C(C)(F)F WXVL_AK00442SB0197 [0,2,0,0,0,0|2,0,0]=4 144 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [0,2,0,0,0,0|0,0,1]=3 145 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [0,2,0,0,0,0|0,0,1]=3 146 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|1,0,1]=4 147 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|1,0,1]=4 148 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|1,0,1]=4 149 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|1,0,1]=4 150 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [0,2,0,0,0,0|0,0,1]=3 151 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [0,2,0,0,0,0|0,0,1]=3 152 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [0,2,0,0,0,0|1,0,1]=4 153 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [0,2,0,0,0,0|1,0,1]=4 154 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [0,2,0,0,0,0|1,0,1]=4 155 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [0,2,0,0,0,0|1,0,1]=4 156 B7R1.22 CNC(=O)C1CC1 WXVL_AK00442SB0038 [0,1,0,1,0,0|1,0,0]=3 157 B7R1.22 CNC(=O)C1CC1 WXVL_AK00442SB0038 [0,1,0,1,0,0|1,0,0]=3 158 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,1,0,1,0,0|1,0,1]=4 159 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,1,0,1,0,0|1,0,1]=4 160 B7R1.20 CC(=O)NC1CC1 WXVL_AK0001SB0150 [0,1,0,1,0,0|1,0,0]=3 161 B7R1.20 CC(=O)NC1CC1 WXVL_AK0001SB0150 [0,1,0,1,0,0|1,0,0]=3 162 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [0,1,0,1,0,0|1,0,1]=4 163 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [0,1,0,1,0,0|1,0,1]=4