0 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [0,0,0,0,0,0|1,0,2]=3 1 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [0,0,0,0,0,0|1,0,2]=3 2 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [0,0,0,0,0,0|1,0,2]=3 3 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [0,0,0,0,0,0|1,0,2]=3 4 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [0,0,0,0,0,0|2,0,1]=3 5 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [0,0,0,0,0,0|2,0,1]=3 6 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [1,0,0,0,0,0|1,0,2]=4 7 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [1,0,0,0,0,0|1,0,2]=4 8 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|2,0,0]=3 9 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|2,0,0]=3 10 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|1,0,1]=3 11 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|1,0,1]=3 12 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|2,0,1]=4 13 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|2,0,1]=4 14 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,1,0,0,0,0|1,0,2]=4 15 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,1,0,0,0,0|1,0,2]=4 16 B6R0.1 C#CCC(=O)NC WXVL_AK00442SB3070 [0,1,0,0,0,0|1,0,2]=4 17 B6R0.1 C#CCC(=O)NC WXVL_AK00442SB3070 [0,1,0,0,0,0|1,0,2]=4 18 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|1,0,0]=2 19 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|1,0,0]=2 20 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,1,0,0,0,0|1,0,0]=2 21 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,1,0,0,0,0|1,0,0]=2 22 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [0,1,0,0,0,0|1,0,2]=4 23 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [0,1,0,0,0,0|1,0,2]=4 24 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|1,0,2]=4 25 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|1,0,2]=4 26 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,1,0,0,0,0|1,0,2]=4 27 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,1,0,0,0,0|1,0,2]=4 28 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,1,0,0,0,0|2,0,1]=4 29 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,1,0,0,0,0|2,0,1]=4 30 B6R0.1 CNC(=O)CC#N WXVL_AK00442SB0057 [0,1,0,0,0,0|1,0,2]=4 31 B6R0.1 CNC(=O)CC#N WXVL_AK00442SB0057 [0,1,0,0,0,0|1,0,2]=4 32 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [0,1,0,0,0,0|1,0,1]=3 33 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [0,1,0,0,0,0|1,0,1]=3 34 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [0,1,0,0,0,0|1,0,2]=4 35 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [0,1,0,0,0,0|1,0,2]=4 36 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,1,0,0,0,0|1,0,2]=4 37 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,1,0,0,0,0|1,0,2]=4 38 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|3,0,0]=4 39 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|3,0,0]=4 40 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,1,0,0,0,0|1,0,0]=2 41 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,1,0,0,0,0|1,0,0]=2 42 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|2,0,0]=3 43 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|2,0,0]=3 44 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|1,0,2]=4 45 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|1,0,2]=4 46 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,1,0,0,0,0|2,0,1]=4 47 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,1,0,0,0,0|2,0,1]=4 48 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|1,0,1]=3 49 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|1,0,1]=3 50 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,1,0,0,0,0|2,0,0]=3 51 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,1,0,0,0,0|2,0,0]=3 52 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,1,0,0,0,0|1,0,2]=4 53 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,1,0,0,0,0|1,0,2]=4 54 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [0,1,0,0,0,0|1,0,2]=4 55 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [0,1,0,0,0,0|1,0,2]=4 56 B6R0.3 CNC(=O)C(F)F WXVL_AK00442SB0079 [0,1,0,0,0,0|2,0,1]=4 57 B6R0.3 CNC(=O)C(F)F WXVL_AK00442SB0079 [0,1,0,0,0,0|2,0,1]=4 58 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,1,0,0,0,0|1,0,2]=4 59 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,1,0,0,0,0|1,0,2]=4 60 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,1,0,0,0,0|2,0,1]=4 61 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,1,0,0,0,0|2,0,1]=4 62 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,0]=3 63 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,0]=3 64 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [1,1,0,0,0,0|1,0,0]=3 65 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [1,1,0,0,0,0|1,0,0]=3 66 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [1,1,0,0,0,0|1,0,0]=3 67 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [1,1,0,0,0,0|1,0,0]=3 68 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [1,1,0,0,0,0|2,0,0]=4 69 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [1,1,0,0,0,0|2,0,0]=4 70 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,1,0,0,0,0|2,0,0]=4 71 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,1,0,0,0,0|2,0,0]=4 72 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,1,0,0,0,0|0,0,2]=4 73 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,1,0,0,0,0|0,0,2]=4 74 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [1,1,0,0,0,0|1,0,0]=3 75 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [1,1,0,0,0,0|1,0,0]=3 76 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [1,1,0,0,0,0|1,1,0]=4 77 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [1,1,0,0,0,0|1,1,0]=4 78 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [1,1,0,0,0,0|1,0,0]=3 79 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [1,1,0,0,0,0|1,0,0]=3 80 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,0]=3 81 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,0]=3 82 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,1]=4 83 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,1]=4 84 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|2,0,0]=4 85 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|2,0,0]=4 86 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|2,0,0]=4 87 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|2,0,0]=4 88 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|2,0,0]=4 89 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|2,0,0]=4 90 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [1,1,0,0,0,0|2,0,0]=4 91 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [1,1,0,0,0,0|2,0,0]=4 92 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|1,0,0]=3 93 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|1,0,0]=3 94 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,2,0,0,0,0|0,0,1]=3 95 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,2,0,0,0,0|0,0,1]=3 96 B7R0.3 C#CC(=O)NCC=C WXVL_AK00561SB0338 [0,2,0,0,0,0|1,0,1]=4 97 B7R0.3 C#CC(=O)NCC=C WXVL_AK00561SB0338 [0,2,0,0,0,0|1,0,1]=4 98 B7R0.3 C=CCCC(=O)NC WXVL_AK00442SB1035 [0,2,0,0,0,0|1,0,0]=3 99 B7R0.3 C=CCCC(=O)NC WXVL_AK00442SB1035 [0,2,0,0,0,0|1,0,0]=3 100 B7R0.3 C=CCNC(=O)CC WXVL_AK00561SB0064 [0,2,0,0,0,0|1,0,0]=3 101 B7R0.3 C=CCNC(=O)CC WXVL_AK00561SB0064 [0,2,0,0,0,0|1,0,0]=3 102 B7R0.3 C=CCNC(=O)CO WXVL_AK00561SB2706 [0,2,0,0,0,0|2,0,0]=4 103 B7R0.3 C=CCNC(=O)CO WXVL_AK00561SB2706 [0,2,0,0,0,0|2,0,0]=4 104 B7R0.3 CCOCC(=O)NC WXVL_AK00442SB0091 [0,2,0,0,0,0|1,0,1]=4 105 B7R0.3 CCOCC(=O)NC WXVL_AK00442SB0091 [0,2,0,0,0,0|1,0,1]=4 106 B7R0.3 CNC(=O)/C=C/CBr WXVL_AK00442SB0424 [0,2,0,0,0,0|1,0,0]=3 107 B7R0.3 CNC(=O)/C=C/CBr WXVL_AK00442SB0424 [0,2,0,0,0,0|1,0,0]=3 108 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,2,0,0,0,0|1,0,1]=4 109 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,2,0,0,0,0|1,0,1]=4 110 B7R0.5 C/C=C/C(=O)N(C)C WXVL_AN0032SB0340 [0,2,0,0,0,0|1,0,0]=3 111 B7R0.5 C/C=C/C(=O)N(C)C WXVL_AN0032SB0340 [0,2,0,0,0,0|1,0,0]=3 112 B7R0.5 C=C(F)C(=O)NCC WXVL_AK00476SB1376 [0,2,0,0,0,0|1,0,0]=3 113 B7R0.5 C=C(F)C(=O)NCC WXVL_AK00476SB1376 [0,2,0,0,0,0|1,0,0]=3 114 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,2,0,0,0,0|1,0,0]=3 115 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,2,0,0,0,0|1,0,0]=3 116 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|1,0,1]=4 117 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|1,0,1]=4 118 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,2,0,0,0,0|2,0,0]=4 119 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,2,0,0,0,0|2,0,0]=4 120 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,2,0,0,0,0|1,0,0]=3 121 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,2,0,0,0,0|1,0,0]=3 122 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|1,0,1]=4 123 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|1,0,1]=4 124 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [0,2,0,0,0,0|1,0,0]=3 125 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [0,2,0,0,0,0|1,0,0]=3 126 B7R0.7 C=CCC(=O)NCC WXVL_AK00476SB2732 [0,2,0,0,0,0|1,0,0]=3 127 B7R0.7 C=CCC(=O)NCC WXVL_AK00476SB2732 [0,2,0,0,0,0|1,0,0]=3 128 B7R0.7 CCNC(=O)COC WXVL_AK00476SB0090 [0,2,0,0,0,0|0,0,2]=4 129 B7R0.7 CCNC(=O)COC WXVL_AK00476SB0090 [0,2,0,0,0,0|0,0,2]=4 130 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|1,0,0]=3 131 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|1,0,0]=3 132 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|1,0,1]=4 133 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|1,0,1]=4 134 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [0,2,0,0,0,0|1,0,1]=4 135 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [0,2,0,0,0,0|1,0,1]=4 136 B7R0.11 C=CCS(=O)(=O)NC WXVL_AK00442HU0152 [0,2,0,0,0,0|2,0,0]=4 137 B7R0.11 C=CCS(=O)(=O)NC WXVL_AK00442HU0152 [0,2,0,0,0,0|2,0,0]=4 138 B7R0.16 C=C(F)C(=O)N(C)C WXVL_AN0032SB1376 [0,2,0,0,0,0|1,0,0]=3 139 B7R0.16 C=C(F)C(=O)N(C)C WXVL_AN0032SB1376 [0,2,0,0,0,0|1,0,0]=3 140 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|1,0,1]=4 141 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|1,0,1]=4 142 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|2,0,0]=4 143 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|2,0,0]=4 144 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [0,2,0,0,0,0|2,0,0]=4 145 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [0,2,0,0,0,0|2,0,0]=4