0 B7R0.5 C#CCC(=O)N(C)C WXVL_AN0032SB3070 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.5 C#CCC(=O)N(C)C WXVL_AN0032SB3070 [0,0,0,0,0,0|2,0,2]=4 2 B7R0.5 C/C=C/C(=O)N(C)C WXVL_AN0032SB0340 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.5 C/C=C/C(=O)N(C)C WXVL_AN0032SB0340 [0,0,0,0,0,0|2,0,2]=4 4 B7R0.5 C=C(F)C(=O)NCC WXVL_AK00476SB1376 [0,0,0,0,0,0|2,0,1]=3 5 B7R0.5 C=C(F)C(=O)NCC WXVL_AK00476SB1376 [0,0,0,0,0,0|2,0,1]=3 6 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,0,0,0,0,0|2,0,2]=4 7 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,0,0,0,0,0|2,0,2]=4 8 B7R0.5 CC#CC(=O)N(C)C WXVL_AN0032SB1240 [0,0,0,0,0,0|2,0,2]=4 9 B7R0.5 CC#CC(=O)N(C)C WXVL_AN0032SB1240 [0,0,0,0,0,0|2,0,2]=4 10 B7R0.5 CC(=O)N(C)CC#N WXVL_AN2942SB0150 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.5 CC(=O)N(C)CC#N WXVL_AN2942SB0150 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,0,0,0,0,0|3,0,0]=3 13 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,0,0,0,0,0|3,0,0]=3 14 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,0,0,0,0,0|2,0,1]=3 15 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,0,0,0,0,0|2,0,1]=3 16 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [0,0,0,0,0,0|2,0,0]=2 17 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [0,0,0,0,0,0|2,0,0]=2 18 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,0,0,0,0,0|2,0,1]=3 19 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,0,0,0,0,0|2,0,1]=3 20 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [0,0,0,0,0,0|1,0,2]=3 21 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [0,0,0,0,0,0|1,0,2]=3 22 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,0,0,0,0,0|1,0,0]=1 23 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,0,0,0,0,0|1,0,0]=1 24 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,0,0,0,0,0|2,0,0]=2 25 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,0,0,0,0,0|2,0,0]=2 26 B7R0.5 CCNC(=O)C(C)C WXVL_AK00476SB0052 [0,0,0,0,0,0|2,0,1]=3 27 B7R0.5 CCNC(=O)C(C)C WXVL_AK00476SB0052 [0,0,0,0,0,0|2,0,1]=3 28 B7R0.5 CCNC(=O)C(C)S WXVL_AK00476SB2708 [0,0,0,0,0,0|1,1,1]=3 29 B7R0.5 CCNC(=O)C(C)S WXVL_AK00476SB2708 [0,0,0,0,0,0|1,1,1]=3 30 B7R0.5 CCNC(=O)C(F)F WXVL_AK00476SB0079 [0,0,0,0,0,0|3,0,1]=4 31 B7R0.5 CCNC(=O)C(F)F WXVL_AK00476SB0079 [0,0,0,0,0,0|3,0,1]=4 32 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,0,0,0,0,0|1,0,2]=3 33 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,0,0,0,0,0|1,0,2]=3 34 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,0,0,0,0,0|2,0,0]=2 35 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,0,0,0,0,0|2,0,0]=2 36 B7R0.5 CN(C)C(=O)CC#N WXVL_AN0032SB0057 [0,0,0,0,0,0|3,0,1]=4 37 B7R0.5 CN(C)C(=O)CC#N WXVL_AN0032SB0057 [0,0,0,0,0,0|3,0,1]=4 38 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,0,0,0,0,0|3,0,0]=3 39 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,0,0,0,0,0|3,0,0]=3 40 B7R0.5 CSCC(=O)N(C)C WXVL_AN0032SB1267 [0,0,0,0,0,0|3,0,0]=3 41 B7R0.5 CSCC(=O)N(C)C WXVL_AN0032SB1267 [0,0,0,0,0,0|3,0,0]=3 42 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [1,0,0,0,0,0|1,0,2]=4 43 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [1,0,0,0,0,0|1,0,2]=4 44 B6R0.1 C#CCC(=O)NC WXVL_AK00442SB3070 [1,0,0,0,0,0|1,0,2]=4 45 B6R0.1 C#CCC(=O)NC WXVL_AK00442SB3070 [1,0,0,0,0,0|1,0,2]=4 46 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [1,0,0,0,0,0|1,0,2]=4 47 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [1,0,0,0,0,0|1,0,2]=4 48 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [1,0,0,0,0,0|1,0,2]=4 49 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [1,0,0,0,0,0|1,0,2]=4 50 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [1,0,0,0,0,0|1,0,2]=4 51 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [1,0,0,0,0,0|1,0,2]=4 52 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [1,0,0,0,0,0|1,0,0]=2 53 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [1,0,0,0,0,0|1,0,0]=2 54 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [1,0,0,0,0,0|1,0,1]=3 55 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [1,0,0,0,0,0|1,0,1]=3 56 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [1,0,0,0,0,0|1,0,2]=4 57 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [1,0,0,0,0,0|1,0,2]=4 58 B6R0.1 CNC(=O)CC#N WXVL_AK00442SB0057 [1,0,0,0,0,0|2,0,1]=4 59 B6R0.1 CNC(=O)CC#N WXVL_AK00442SB0057 [1,0,0,0,0,0|2,0,1]=4 60 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [1,0,0,0,0,0|2,0,0]=3 61 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [1,0,0,0,0,0|2,0,0]=3 62 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [1,0,0,0,0,0|2,0,0]=3 63 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [1,0,0,0,0,0|2,0,0]=3 64 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [1,0,0,0,0,0|2,0,1]=4 65 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [1,0,0,0,0,0|2,0,1]=4 66 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [1,0,0,0,0,0|2,0,1]=4 67 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [1,0,0,0,0,0|2,0,1]=4 68 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [1,0,0,0,0,0|1,0,0]=2 69 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [1,0,0,0,0,0|1,0,0]=2 70 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [1,0,0,0,0,0|2,0,0]=3 71 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [1,0,0,0,0,0|2,0,0]=3 72 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [1,0,0,0,0,0|2,0,1]=4 73 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [1,0,0,0,0,0|2,0,1]=4 74 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [1,0,0,0,0,0|2,0,1]=4 75 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [1,0,0,0,0,0|2,0,1]=4 76 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [1,0,0,0,0,0|1,0,2]=4 77 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [1,0,0,0,0,0|1,0,2]=4 78 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [1,0,0,0,0,0|3,0,0]=4 79 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [1,0,0,0,0,0|3,0,0]=4 80 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [1,0,0,0,0,0|1,0,0]=2 81 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [1,0,0,0,0,0|1,0,0]=2 82 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [1,0,0,0,0,0|2,0,0]=3 83 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [1,0,0,0,0,0|2,0,0]=3 84 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [1,0,0,0,0,0|2,0,1]=4 85 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [1,0,0,0,0,0|2,0,1]=4 86 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [1,0,0,0,0,0|1,1,1]=4 87 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [1,0,0,0,0,0|1,1,1]=4 88 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [1,0,0,0,0,0|1,0,2]=4 89 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [1,0,0,0,0,0|1,0,2]=4 90 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [1,0,0,0,0,0|1,0,2]=4 91 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [1,0,0,0,0,0|1,0,2]=4 92 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [1,0,0,0,0,0|2,0,1]=4 93 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [1,0,0,0,0,0|2,0,1]=4 94 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [1,0,0,0,0,0|2,0,0]=3 95 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [1,0,0,0,0,0|2,0,0]=3 96 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [1,0,0,0,0,0|1,0,0]=2 97 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [1,0,0,0,0,0|1,0,0]=2 98 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [1,0,0,0,0,0|2,0,1]=4 99 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [1,0,0,0,0,0|2,0,1]=4 100 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [1,0,0,0,0,0|2,0,1]=4 101 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [1,0,0,0,0,0|2,0,1]=4 102 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [1,0,0,0,0,0|2,0,1]=4 103 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [1,0,0,0,0,0|2,0,1]=4 104 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [1,0,0,0,0,0|2,0,1]=4 105 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [1,0,0,0,0,0|2,0,1]=4 106 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [1,0,0,0,0,0|2,0,1]=4 107 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [1,0,0,0,0,0|2,0,1]=4 108 B8R0.2 CCC(=O)C(=O)N(C)C WXVL_AN0032SB0344 [0,1,0,0,0,0|2,0,1]=4 109 B8R0.2 CCC(=O)C(=O)N(C)C WXVL_AN0032SB0344 [0,1,0,0,0,0|2,0,1]=4 110 B8R0.2 CCC(C)C(=O)N(C)C WXVL_AN0032SB0054 [0,1,0,0,0,0|2,0,0]=3 111 B8R0.2 CCC(C)C(=O)N(C)C WXVL_AN0032SB0054 [0,1,0,0,0,0|2,0,0]=3 112 B8R0.2 CC[C@@H](C)C(=O)N(C)C WXVL_AN0032SB00054 [0,1,0,0,0,0|2,0,0]=3 113 B8R0.2 CC[C@@H](C)C(=O)N(C)C WXVL_AN0032SB00054 [0,1,0,0,0,0|2,0,0]=3 114 B8R0.2 CC[C@H](O)C(=O)N(C)C WXVL_AN0032SB3573 [0,1,0,0,0,0|2,0,0]=3 115 B8R0.2 CC[C@H](O)C(=O)N(C)C WXVL_AN0032SB3573 [0,1,0,0,0,0|2,0,0]=3 116 B8R0.2 CO[C@H](C)C(=O)N(C)C WXVL_AN0032SB2926 [0,1,0,0,0,0|3,0,0]=4 117 B8R0.2 CO[C@H](C)C(=O)N(C)C WXVL_AN0032SB2926 [0,1,0,0,0,0|3,0,0]=4 118 B8R0.3 C/C=C(\C)/C(=O)NCC WXVL_AK00476SB0343 [0,1,0,0,0,0|2,0,0]=3 119 B8R0.3 C/C=C(\C)/C(=O)NCC WXVL_AK00476SB0343 [0,1,0,0,0,0|2,0,0]=3 120 B8R0.3 CC/C=C(\C)/C(=O)NC WXVL_AK00442SB0037 [0,1,0,0,0,0|1,0,1]=3 121 B8R0.3 CC/C=C(\C)/C(=O)NC WXVL_AK00442SB0037 [0,1,0,0,0,0|1,0,1]=3 122 B8R0.3 CCC(=O)N(C)CCO WXVL_AN2670SB0064 [0,1,0,0,0,0|3,0,0]=4 123 B8R0.3 CCC(=O)N(C)CCO WXVL_AN2670SB0064 [0,1,0,0,0,0|3,0,0]=4 124 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [0,1,0,0,0,0|1,0,1]=3 125 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [0,1,0,0,0,0|1,0,1]=3 126 B8R0.3 CCC[C@H](O)C(=O)NC WXVL_AK00442SB3627 [0,1,0,0,0,0|0,0,2]=3 127 B8R0.3 CCC[C@H](O)C(=O)NC WXVL_AK00442SB3627 [0,1,0,0,0,0|0,0,2]=3 128 B8R0.3 CCNC(=O)C(=O)CC WXVL_AK00476SB0344 [0,1,0,0,0,0|1,0,0]=2 129 B8R0.3 CCNC(=O)C(=O)CC WXVL_AK00476SB0344 [0,1,0,0,0,0|1,0,0]=2 130 B8R0.3 CCNC(=O)C(C)CC WXVL_AK00476SB0054 [0,1,0,0,0,0|2,0,1]=4 131 B8R0.3 CCNC(=O)C(C)CC WXVL_AK00476SB0054 [0,1,0,0,0,0|2,0,1]=4 132 B8R0.3 CCNC(=O)[C@@H](C)OC WXVL_AK00476SB2926 [0,1,0,0,0,0|1,0,2]=4 133 B8R0.3 CCNC(=O)[C@@H](C)OC WXVL_AK00476SB2926 [0,1,0,0,0,0|1,0,2]=4 134 B8R0.3 CCNC(=O)[C@@H](O)CC WXVL_AK00476SB3573 [0,1,0,0,0,0|1,0,2]=4 135 B8R0.3 CCNC(=O)[C@@H](O)CC WXVL_AK00476SB3573 [0,1,0,0,0,0|1,0,2]=4 136 B8R0.3 CCNC(=O)[C@H](C)CC WXVL_AK00476SB00054 [0,1,0,0,0,0|2,0,1]=4 137 B8R0.3 CCNC(=O)[C@H](C)CC WXVL_AK00476SB00054 [0,1,0,0,0,0|2,0,1]=4 138 B8R0.3 CCOC(=O)C(=O)NC WXVL_AK00442SB4144 [0,1,0,0,0,0|1,0,0]=2 139 B8R0.3 CCOC(=O)C(=O)NC WXVL_AK00442SB4144 [0,1,0,0,0,0|1,0,0]=2 140 B8R0.3 CN(CCO)C(=O)CO WXVL_AN2670SB2706 [0,1,0,0,0,0|3,0,0]=4 141 B8R0.3 CN(CCO)C(=O)CO WXVL_AN2670SB2706 [0,1,0,0,0,0|3,0,0]=4 142 B8R0.8 C#CCCC(=O)N(C)C WXVL_AN0032SB2189 [0,1,0,0,0,0|2,0,1]=4 143 B8R0.8 C#CCCC(=O)N(C)C WXVL_AN0032SB2189 [0,1,0,0,0,0|2,0,1]=4 144 B8R0.8 C=C(F)C(=O)NCCC WXVL_AK00504SB1376 [0,1,0,0,0,0|1,0,1]=3 145 B8R0.8 C=C(F)C(=O)NCCC WXVL_AK00504SB1376 [0,1,0,0,0,0|1,0,1]=3 146 B8R0.8 C=C(F)C(=O)NCCF WXVL_AK00466SB1376 [0,1,0,0,0,0|2,0,1]=4 147 B8R0.8 C=C(F)C(=O)NCCF WXVL_AK00466SB1376 [0,1,0,0,0,0|2,0,1]=4 148 B8R0.8 C=CCCC(=O)N(C)C WXVL_AN0032SB1035 [0,1,0,0,0,0|2,0,1]=4 149 B8R0.8 C=CCCC(=O)N(C)C WXVL_AN0032SB1035 [0,1,0,0,0,0|2,0,1]=4 150 B8R0.8 C=CCNC(=O)C(=O)C WXVL_AK00561SB0051 [0,1,0,0,0,0|0,0,2]=3 151 B8R0.8 C=CCNC(=O)C(=O)C WXVL_AK00561SB0051 [0,1,0,0,0,0|0,0,2]=3 152 B8R0.8 C=CCNC(=O)C(=O)N WXVL_AK00561SB0128 [0,1,0,0,0,0|1,0,2]=4 153 B8R0.8 C=CCNC(=O)C(=O)N WXVL_AK00561SB0128 [0,1,0,0,0,0|1,0,2]=4 154 B8R0.8 CC(=O)C(=O)NCC#N WXVL_AK0683SB0051 [0,1,0,0,0,0|1,0,1]=3 155 B8R0.8 CC(=O)C(=O)NCC#N WXVL_AK0683SB0051 [0,1,0,0,0,0|1,0,1]=3 156 B8R0.8 CC(=O)C(=O)NCCF WXVL_AK00466SB0051 [0,1,0,0,0,0|1,0,0]=2 157 B8R0.8 CC(=O)C(=O)NCCF WXVL_AK00466SB0051 [0,1,0,0,0,0|1,0,0]=2 158 B8R0.8 CC(C)C(=O)NCCF WXVL_AK00466SB0052 [0,1,0,0,0,0|2,0,1]=4 159 B8R0.8 CC(C)C(=O)NCCF WXVL_AK00466SB0052 [0,1,0,0,0,0|2,0,1]=4 160 B8R0.8 CC(S)C(=O)NCCF WXVL_AK00466SB2708 [0,1,0,0,0,0|1,1,1]=4 161 B8R0.8 CC(S)C(=O)NCCF WXVL_AK00466SB2708 [0,1,0,0,0,0|1,1,1]=4 162 B8R0.8 CCCCC(O)C(=O)N WXVL_AK0084SB3429 [0,1,0,0,0,0|1,0,2]=4 163 B8R0.8 CCCCC(O)C(=O)N WXVL_AK0084SB3429 [0,1,0,0,0,0|1,0,2]=4 164 B8R0.8 CCCNC(=O)C(=O)C WXVL_AK00504SB0051 [0,1,0,0,0,0|0,0,0]=1 165 B8R0.8 CCCNC(=O)C(=O)C WXVL_AK00504SB0051 [0,1,0,0,0,0|0,0,0]=1 166 B8R0.8 CCCNC(=O)C(=O)N WXVL_AK00504SB0128 [0,1,0,0,0,0|1,0,0]=2 167 B8R0.8 CCCNC(=O)C(=O)N WXVL_AK00504SB0128 [0,1,0,0,0,0|1,0,0]=2 168 B8R0.8 CCCNC(=O)C(C)C WXVL_AK00504SB0052 [0,1,0,0,0,0|1,0,1]=3 169 B8R0.8 CCCNC(=O)C(C)C WXVL_AK00504SB0052 [0,1,0,0,0,0|1,0,1]=3 170 B8R0.8 CCCNC(=O)C(C)S WXVL_AK00504SB2708 [0,1,0,0,0,0|0,1,1]=3 171 B8R0.8 CCCNC(=O)C(C)S WXVL_AK00504SB2708 [0,1,0,0,0,0|0,1,1]=3 172 B8R0.8 CCCNC(=O)C(F)F WXVL_AK00504SB0079 [0,1,0,0,0,0|2,0,1]=4 173 B8R0.8 CCCNC(=O)C(F)F WXVL_AK00504SB0079 [0,1,0,0,0,0|2,0,1]=4 174 B8R0.8 CCCNC(=O)[C@@H](C)O WXVL_AK00504SB1085 [0,1,0,0,0,0|0,0,2]=3 175 B8R0.8 CCCNC(=O)[C@@H](C)O WXVL_AK00504SB1085 [0,1,0,0,0,0|0,0,2]=3 176 B8R0.8 CCOCC(=O)N(C)C WXVL_AN0032SB0091 [0,1,0,0,0,0|2,0,0]=3 177 B8R0.8 CCOCC(=O)N(C)C WXVL_AN0032SB0091 [0,1,0,0,0,0|2,0,0]=3 178 B8R0.8 CCSCC(=O)N(C)C WXVL_AN0032SB0002 [0,1,0,0,0,0|2,0,0]=3 179 B8R0.8 CCSCC(=O)N(C)C WXVL_AN0032SB0002 [0,1,0,0,0,0|2,0,0]=3 180 B8R0.8 CN(C)C(=O)NCCCl WXVL_AN0032YV0092 [0,1,0,0,0,0|3,0,0]=4 181 B8R0.8 CN(C)C(=O)NCCCl WXVL_AN0032YV0092 [0,1,0,0,0,0|3,0,0]=4 182 B8R0.8 COCCC(=O)N(C)C WXVL_AN0032SB0156 [0,1,0,0,0,0|2,0,0]=3 183 B8R0.8 COCCC(=O)N(C)C WXVL_AN0032SB0156 [0,1,0,0,0,0|2,0,0]=3 184 B8R0.8 COCCN(C)C(=O)C WXVL_AN0085SB0150 [0,1,0,0,0,0|2,0,0]=3 185 B8R0.8 COCCN(C)C(=O)C WXVL_AN0085SB0150 [0,1,0,0,0,0|2,0,0]=3 186 B8R0.8 CSCCC(=O)N(C)C WXVL_AN0032SB0361 [0,1,0,0,0,0|2,0,0]=3 187 B8R0.8 CSCCC(=O)N(C)C WXVL_AN0032SB0361 [0,1,0,0,0,0|2,0,0]=3 188 B8R0.8 C[C@@H](O)C(=O)NCCF WXVL_AK00466SB1085 [0,1,0,0,0,0|1,0,2]=4 189 B8R0.8 C[C@@H](O)C(=O)NCCF WXVL_AK00466SB1085 [0,1,0,0,0,0|1,0,2]=4 190 B8R0.8 N#CCNC(=O)C(=O)N WXVL_AK0683SB0128 [0,1,0,0,0,0|2,0,1]=4 191 B8R0.8 N#CCNC(=O)C(=O)N WXVL_AK0683SB0128 [0,1,0,0,0,0|2,0,1]=4 192 B8R0.8 NC(=O)C(=O)NCCF WXVL_AK00466SB0128 [0,1,0,0,0,0|2,0,0]=3 193 B8R0.8 NC(=O)C(=O)NCCF WXVL_AK00466SB0128 [0,1,0,0,0,0|2,0,0]=3 194 B8R0.12 CCCC(C)(C)C(=O)N WXVL_AK0084SB0372 [0,1,0,0,0,0|2,0,1]=4 195 B8R0.12 CCCC(C)(C)C(=O)N WXVL_AK0084SB0372 [0,1,0,0,0,0|2,0,1]=4 196 B8R0.12 CCCS(=O)(=O)N(C)C WXVL_AN0032HU0030 [0,1,0,0,0,0|3,0,0]=4 197 B8R0.12 CCCS(=O)(=O)N(C)C WXVL_AN0032HU0030 [0,1,0,0,0,0|3,0,0]=4 198 B8R0.14 CCNC(=O)C(C)(C)Br WXVL_AK00476SB0432 [0,1,0,0,0,0|2,0,1]=4 199 B8R0.14 CCNC(=O)C(C)(C)Br WXVL_AK00476SB0432 [0,1,0,0,0,0|2,0,1]=4 200 B8R0.14 CCNC(=O)C(C)(C)C WXVL_AK00476SB0078 [0,1,0,0,0,0|2,0,1]=4 201 B8R0.14 CCNC(=O)C(C)(C)C WXVL_AK00476SB0078 [0,1,0,0,0,0|2,0,1]=4 202 B8R0.14 CCNC(=O)C(C)(C)F WXVL_AK00476SB0199 [0,1,0,0,0,0|2,0,1]=4 203 B8R0.14 CCNC(=O)C(C)(C)F WXVL_AK00476SB0199 [0,1,0,0,0,0|2,0,1]=4 204 B8R0.14 CCNC(=O)C(C)(C)O WXVL_AK00476SB0125 [0,1,0,0,0,0|1,0,2]=4 205 B8R0.14 CCNC(=O)C(C)(C)O WXVL_AK00476SB0125 [0,1,0,0,0,0|1,0,2]=4 206 B8R0.14 CCNC(=O)C(C)(F)F WXVL_AK00476SB0197 [0,1,0,0,0,0|2,0,1]=4 207 B8R0.14 CCNC(=O)C(C)(F)F WXVL_AK00476SB0197 [0,1,0,0,0,0|2,0,1]=4 208 B8R0.15 CCN(CCO)C(=O)C WXVL_AN3174SB0150 [0,1,0,0,0,0|3,0,0]=4 209 B8R0.23 C=C(F)C(=O)NC(C)C WXVL_AK0030SB1376 [0,1,0,0,0,0|2,0,1]=4 210 B8R0.23 C=C(F)C(=O)NC(C)C WXVL_AK0030SB1376 [0,1,0,0,0,0|2,0,1]=4 211 B8R0.23 CC(=O)C(=O)NC(C)C WXVL_AK0030SB0051 [0,1,0,0,0,0|1,0,0]=2 212 B8R0.23 CC(=O)C(=O)NC(C)C WXVL_AK0030SB0051 [0,1,0,0,0,0|1,0,0]=2 213 B8R0.23 CC(C)CC(=O)N(C)C WXVL_AN0032SB0063 [0,1,0,0,0,0|2,0,0]=3 214 B8R0.23 CC(C)CC(=O)N(C)C WXVL_AN0032SB0063 [0,1,0,0,0,0|2,0,0]=3 215 B8R0.23 CC(C)CC(O)C(=O)N WXVL_AK0084SB4281 [0,1,0,0,0,0|1,0,2]=4 216 B8R0.23 CC(C)CC(O)C(=O)N WXVL_AK0084SB4281 [0,1,0,0,0,0|1,0,2]=4 217 B8R0.23 CC(C)NC(=O)C(=O)N WXVL_AK0030SB0128 [0,1,0,0,0,0|2,0,0]=3 218 B8R0.23 CC(C)NC(=O)C(=O)N WXVL_AK0030SB0128 [0,1,0,0,0,0|2,0,0]=3 219 B8R0.23 CC(C)NC(=O)C(C)C WXVL_AK0030SB0052 [0,1,0,0,0,0|2,0,1]=4 220 B8R0.23 CC(C)NC(=O)C(C)C WXVL_AK0030SB0052 [0,1,0,0,0,0|2,0,1]=4 221 B8R0.23 CC(C)NC(=O)C(C)S WXVL_AK0030SB2708 [0,1,0,0,0,0|1,1,1]=4 222 B8R0.23 CC(C)NC(=O)C(C)S WXVL_AK0030SB2708 [0,1,0,0,0,0|1,1,1]=4 223 B8R0.23 CC(C)NC(=O)[C@@H](C)O WXVL_AK0030SB1085 [0,1,0,0,0,0|1,0,2]=4 224 B8R0.23 CC(C)NC(=O)[C@@H](C)O WXVL_AK0030SB1085 [0,1,0,0,0,0|1,0,2]=4 225 B8R0.23 CC(O)CC(=O)N(C)C WXVL_AN0032SB3643 [0,1,0,0,0,0|2,0,0]=3 226 B8R0.23 CC(O)CC(=O)N(C)C WXVL_AN0032SB3643 [0,1,0,0,0,0|2,0,0]=3 227 B8R0.23 CN(C)CC(=O)N(C)C WXVL_AN0032SB0085 [0,1,0,0,0,0|3,0,0]=4 228 B8R0.23 CN(C)CC(=O)N(C)C WXVL_AN0032SB0085 [0,1,0,0,0,0|3,0,0]=4 229 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [0,0,0,1,0,0|2,0,0]=3 230 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [0,0,0,1,0,0|2,0,0]=3 231 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [0,0,0,1,0,0|2,0,1]=4 232 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [0,0,0,1,0,0|2,0,1]=4 233 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [0,0,0,1,0,0|1,0,2]=4 234 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [0,0,0,1,0,0|1,0,2]=4 235 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [0,0,0,1,0,0|1,1,1]=4 236 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [0,0,0,1,0,0|1,1,1]=4 237 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [0,0,0,1,0,0|1,0,2]=4 238 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [0,0,0,1,0,0|1,0,2]=4 239 B8R1.23 CC(=O)N1CC(C1)C WXVL_AN0291SB0150 [0,0,0,1,0,0|2,0,0]=3 240 B8R1.23 CC(=O)N1CC(C1)C WXVL_AN0291SB0150 [0,0,0,1,0,0|2,0,0]=3 241 B8R1.23 CC(=O)N1CC(C1)O WXVL_AN0284SB0150 [0,0,0,1,0,0|3,0,0]=4 242 B8R1.23 CC(=O)N1CC(C1)O WXVL_AN0284SB0150 [0,0,0,1,0,0|3,0,0]=4 243 B8R1.37 CCNC(=O)C1CC1 WXVL_AK00476SB0038 [0,0,0,1,0,0|2,0,1]=4 244 B8R1.37 CCNC(=O)C1CC1 WXVL_AK00476SB0038 [0,0,0,1,0,0|2,0,1]=4 245 B8R1.54 CC(=O)N(C)C1CC1 WXVL_AN0276SB0150 [0,0,0,1,0,0|2,0,0]=3 246 B8R1.54 CC(=O)N(C)C1CC1 WXVL_AN0276SB0150 [0,0,0,1,0,0|2,0,0]=3 247 B8R1.54 CN(C)C(=O)C1CC1 WXVL_AN0032SB0038 [0,0,0,1,0,0|2,0,0]=3 248 B8R1.54 CN(C)C(=O)C1CC1 WXVL_AN0032SB0038 [0,0,0,1,0,0|2,0,0]=3 249 B8R1.54 NC(=O)C(=O)C1CC1 WXVL_AK0084SB3659 [0,0,0,1,0,0|1,0,0]=2 250 B8R1.54 NC(=O)C(=O)C1CC1 WXVL_AK0084SB3659 [0,0,0,1,0,0|1,0,0]=2 251 B8R1.78 CC1(CCC1)C(=O)N WXVL_AK0084SB0805 [0,0,0,1,0,0|2,0,1]=4 252 B8R1.78 CC1(CCC1)C(=O)N WXVL_AK0084SB0805 [0,0,0,1,0,0|2,0,1]=4 253 B8R1.78 NC(=O)C1(CCC1)Br WXVL_AK0084SB0465 [0,0,0,1,0,0|2,0,1]=4 254 B8R1.78 NC(=O)C1(CCC1)Br WXVL_AK0084SB0465 [0,0,0,1,0,0|2,0,1]=4 255 B8R1.78 NC(=O)C1(CCC1)F WXVL_AK0084SB0033 [0,0,0,1,0,0|2,0,1]=4 256 B8R1.78 NC(=O)C1(CCC1)F WXVL_AK0084SB0033 [0,0,0,1,0,0|2,0,1]=4 257 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [0,0,0,0,0,1|2,0,1]=4 258 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [0,0,0,0,0,1|2,0,1]=4 259 B8R0.5 CCCC(=O)NC(C)C WXVL_AK0030SB0073 [0,0,0,0,0,1|1,0,1]=3 260 B8R0.5 CCCC(=O)NC(C)C WXVL_AK0030SB0073 [0,0,0,0,0,1|1,0,1]=3 261 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [0,0,0,0,0,1|1,0,1]=3 262 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [0,0,0,0,0,1|1,0,1]=3 263 B8R0.5 CCNC(=O)C=C(C)C WXVL_AK00476SB0342 [0,0,0,0,0,1|2,0,0]=3 264 B8R0.5 CCNC(=O)C=C(C)C WXVL_AK00476SB0342 [0,0,0,0,0,1|2,0,0]=3 265 B8R0.5 CCNC(=O)CC(C)C WXVL_AK00476SB0063 [0,0,0,0,0,1|2,0,1]=4 266 B8R0.5 CCNC(=O)CC(C)C WXVL_AK00476SB0063 [0,0,0,0,0,1|2,0,1]=4 267 B8R0.5 CCNC(=O)CC(C)O WXVL_AK00476SB3643 [0,0,0,0,0,1|1,0,2]=4 268 B8R0.5 CCNC(=O)CC(C)O WXVL_AK00476SB3643 [0,0,0,0,0,1|1,0,2]=4 269 B8R0.5 CCNC(=O)CN(C)C WXVL_AK00476SB0085 [0,0,0,0,0,1|3,0,0]=4 270 B8R0.5 CCNC(=O)CN(C)C WXVL_AK00476SB0085 [0,0,0,0,0,1|3,0,0]=4 271 B8R0.5 CCOC(=O)CC(=O)N WXVL_AK0084SB3094 [0,0,0,0,0,1|2,0,0]=3 272 B8R0.5 CCOC(=O)CC(=O)N WXVL_AK0084SB3094 [0,0,0,0,0,1|2,0,0]=3 273 B8R0.5 COCC(=O)NC(C)C WXVL_AK0030SB0090 [0,0,0,0,0,1|2,0,1]=4 274 B8R0.5 COCC(=O)NC(C)C WXVL_AK0030SB0090 [0,0,0,0,0,1|2,0,1]=4 275 B8R0.5 COC[C@@H](C)NC(=O)C WXVL_AK00613SB0150 [0,0,0,0,0,1|2,0,1]=4 276 B8R0.5 COC[C@@H](C)NC(=O)C WXVL_AK00613SB0150 [0,0,0,0,0,1|2,0,1]=4 277 B8R0.5 COC[C@H](C)NC(=O)C WXVL_AK0137SB0150 [0,0,0,0,0,1|2,0,1]=4 278 B8R0.5 COC[C@H](C)NC(=O)C WXVL_AK0137SB0150 [0,0,0,0,0,1|2,0,1]=4 279 B8R0.5 CSCC(=O)NC(C)C WXVL_AK0030SB1267 [0,0,0,0,0,1|2,0,1]=4 280 B8R0.5 CSCC(=O)NC(C)C WXVL_AK0030SB1267 [0,0,0,0,0,1|2,0,1]=4 281 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [2,0,0,0,0,0|1,0,1]=4 282 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [2,0,0,0,0,0|1,0,1]=4 283 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [2,0,0,0,0,0|1,0,0]=3 284 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [2,0,0,0,0,0|1,0,0]=3 285 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [2,0,0,0,0,0|1,0,0]=3 286 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [2,0,0,0,0,0|1,0,0]=3 287 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [2,0,0,0,0,0|2,0,0]=4 288 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [2,0,0,0,0,0|2,0,0]=4 289 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [2,0,0,0,0,0|2,0,0]=4 290 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [2,0,0,0,0,0|2,0,0]=4 291 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [2,0,0,0,0,0|1,0,0]=3 292 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [2,0,0,0,0,0|1,0,0]=3 293 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [2,0,0,0,0,0|2,0,0]=4 294 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [2,0,0,0,0,0|2,0,0]=4 295 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [2,0,0,0,0,0|1,0,0]=3 296 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [2,0,0,0,0,0|1,0,0]=3 297 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [2,0,0,0,0,0|2,0,0]=4 298 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [2,0,0,0,0,0|2,0,0]=4 299 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [2,0,0,0,0,0|2,0,0]=4 300 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [2,0,0,0,0,0|2,0,0]=4 301 B7R0.2 CCC(=O)NC(C)C WXVL_AK0030SB0064 [1,1,0,0,0,0|1,0,1]=4 302 B7R0.2 CCC(=O)NC(C)C WXVL_AK0030SB0064 [1,1,0,0,0,0|1,0,1]=4 303 B7R0.2 CNC(=O)CC(C)C WXVL_AK00442SB0063 [1,1,0,0,0,0|1,0,0]=3 304 B7R0.2 CNC(=O)CC(C)C WXVL_AK00442SB0063 [1,1,0,0,0,0|1,0,0]=3 305 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [1,1,0,0,0,0|1,0,0]=3 306 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [1,1,0,0,0,0|1,0,0]=3 307 B7R0.2 CNC(=O)CN(C)C WXVL_AK00442SB0085 [1,1,0,0,0,0|2,0,0]=4 308 B7R0.2 CNC(=O)CN(C)C WXVL_AK00442SB0085 [1,1,0,0,0,0|2,0,0]=4 309 B7R0.3 C#CC(=O)NCCC WXVL_AK00504SB0338 [1,1,0,0,0,0|0,0,2]=4 310 B7R0.3 C#CC(=O)NCCC WXVL_AK00504SB0338 [1,1,0,0,0,0|0,0,2]=4 311 B7R0.3 C#CCCC(=O)NC WXVL_AK00442SB2189 [1,1,0,0,0,0|1,0,1]=4 312 B7R0.3 C#CCCC(=O)NC WXVL_AK00442SB2189 [1,1,0,0,0,0|1,0,1]=4 313 B7R0.3 C=CCCC(=O)NC WXVL_AK00442SB1035 [1,1,0,0,0,0|1,0,1]=4 314 B7R0.3 C=CCCC(=O)NC WXVL_AK00442SB1035 [1,1,0,0,0,0|1,0,1]=4 315 B7R0.3 CCC(=O)NCCF WXVL_AK00466SB0064 [1,1,0,0,0,0|1,0,1]=4 316 B7R0.3 CCC(=O)NCCF WXVL_AK00466SB0064 [1,1,0,0,0,0|1,0,1]=4 317 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [1,1,0,0,0,0|0,0,1]=3 318 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [1,1,0,0,0,0|0,0,1]=3 319 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [1,1,0,0,0,0|0,0,2]=4 320 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [1,1,0,0,0,0|0,0,2]=4 321 B7R0.3 CCOCC(=O)NC WXVL_AK00442SB0091 [1,1,0,0,0,0|1,0,0]=3 322 B7R0.3 CCOCC(=O)NC WXVL_AK00442SB0091 [1,1,0,0,0,0|1,0,0]=3 323 B7R0.3 CCSCC(=O)NC WXVL_AK00442SB0002 [1,1,0,0,0,0|1,0,0]=3 324 B7R0.3 CCSCC(=O)NC WXVL_AK00442SB0002 [1,1,0,0,0,0|1,0,0]=3 325 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [1,1,0,0,0,0|1,0,0]=3 326 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [1,1,0,0,0,0|1,0,0]=3 327 B7R0.3 CNC(=O)CCSC WXVL_AK00442SB0361 [1,1,0,0,0,0|1,0,0]=3 328 B7R0.3 CNC(=O)CCSC WXVL_AK00442SB0361 [1,1,0,0,0,0|1,0,0]=3 329 B7R0.3 CNC(=O)NCCCl WXVL_AK00442YV0092 [1,1,0,0,0,0|2,0,0]=4 330 B7R0.3 CNC(=O)NCCCl WXVL_AK00442YV0092 [1,1,0,0,0,0|2,0,0]=4 331 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [1,1,0,0,0,0|1,0,0]=3 332 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [1,1,0,0,0,0|1,0,0]=3 333 B7R0.7 C=CCC(=O)NCC WXVL_AK00476SB2732 [1,1,0,0,0,0|1,0,1]=4 334 B7R0.7 C=CCC(=O)NCC WXVL_AK00476SB2732 [1,1,0,0,0,0|1,0,1]=4 335 B7R0.7 CC#CC(=O)NCC WXVL_AK00476SB1240 [1,1,0,0,0,0|1,0,1]=4 336 B7R0.7 CC#CC(=O)NCC WXVL_AK00476SB1240 [1,1,0,0,0,0|1,0,1]=4 337 B7R0.7 CCCC(=O)NCC WXVL_AK00476SB0073 [1,1,0,0,0,0|0,0,1]=3 338 B7R0.7 CCCC(=O)NCC WXVL_AK00476SB0073 [1,1,0,0,0,0|0,0,1]=3 339 B7R0.7 CCNC(=O)COC WXVL_AK00476SB0090 [1,1,0,0,0,0|1,0,1]=4 340 B7R0.7 CCNC(=O)COC WXVL_AK00476SB0090 [1,1,0,0,0,0|1,0,1]=4 341 B7R0.7 CCNC(=O)CSC WXVL_AK00476SB1267 [1,1,0,0,0,0|1,0,1]=4 342 B7R0.7 CCNC(=O)CSC WXVL_AK00476SB1267 [1,1,0,0,0,0|1,0,1]=4 343 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [1,1,0,0,0,0|1,0,1]=4 344 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [1,1,0,0,0,0|1,0,1]=4 345 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [1,1,0,0,0,0|1,0,0]=3 346 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [1,1,0,0,0,0|1,0,0]=3 347 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [1,1,0,0,0,0|1,0,0]=3 348 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [1,1,0,0,0,0|1,0,0]=3 349 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [1,1,0,0,0,0|1,0,0]=3 350 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [1,1,0,0,0,0|1,0,0]=3 351 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [1,1,0,0,0,0|2,0,0]=4 352 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [1,1,0,0,0,0|2,0,0]=4 353 B7R0.11 CCCS(=O)(=O)NC WXVL_AK00442HU0030 [1,1,0,0,0,0|2,0,0]=4 354 B7R0.11 CCCS(=O)(=O)NC WXVL_AK00442HU0030 [1,1,0,0,0,0|2,0,0]=4 355 B7R0.15 CCN(CC)C(=O)C WXVL_AN0042SB0150 [1,1,0,0,0,0|2,0,0]=4 356 B7R0.15 CCN(CC)C(=O)C WXVL_AN0042SB0150 [1,1,0,0,0,0|2,0,0]=4 357 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [1,1,0,0,0,0|1,0,0]=3 358 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [1,1,0,0,0,0|1,0,0]=3 359 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [1,1,0,0,0,0|2,0,0]=4 360 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [1,1,0,0,0,0|2,0,0]=4 361 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [1,1,0,0,0,0|1,0,0]=3 362 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [1,1,0,0,0,0|1,0,0]=3 363 B7R0.16 CC(C)C(=O)N(C)C WXVL_AN0032SB0052 [1,1,0,0,0,0|2,0,0]=4 364 B7R0.16 CC(C)C(=O)N(C)C WXVL_AN0032SB0052 [1,1,0,0,0,0|2,0,0]=4 365 B7R0.16 CC(S)C(=O)N(C)C WXVL_AN0032SB2708 [1,1,0,0,0,0|2,0,0]=4 366 B7R0.16 CC(S)C(=O)N(C)C WXVL_AN0032SB2708 [1,1,0,0,0,0|2,0,0]=4 367 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [1,1,0,0,0,0|2,0,0]=4 368 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [1,1,0,0,0,0|2,0,0]=4 369 B7R0.16 C[C@@H](O)C(=O)N(C)C WXVL_AN0032SB1085 [1,1,0,0,0,0|2,0,0]=4 370 B7R0.16 C[C@@H](O)C(=O)N(C)C WXVL_AN0032SB1085 [1,1,0,0,0,0|2,0,0]=4 371 B7R0.4 C#CCCNC(=O)C WXVL_AK3109SB0150 [1,1,0,0,0,0|1,0,1]=4 372 B7R0.4 C#CCCNC(=O)C WXVL_AK3109SB0150 [1,1,0,0,0,0|1,0,1]=4 373 B7R0.4 C=CCCNC(=O)C WXVL_AK00138SB0150 [1,1,0,0,0,0|1,0,1]=4 374 B7R0.4 C=CCCNC(=O)C WXVL_AK00138SB0150 [1,1,0,0,0,0|1,0,1]=4 375 B7R0.4 CC(=O)NCCC#N WXVL_AK0087SB0150 [1,1,0,0,0,0|1,0,1]=4 376 B7R0.4 CC(=O)NCCC#N WXVL_AK0087SB0150 [1,1,0,0,0,0|1,0,1]=4 377 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,1,0,0,0,0|1,0,0]=3 378 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,1,0,0,0,0|1,0,0]=3 379 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,1,0,0,0,0|1,0,1]=4 380 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,1,0,0,0,0|1,0,1]=4 381 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,1,0,0,0,0|0,0,1]=3 382 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,1,0,0,0,0|0,0,1]=3 383 B7R0.4 CCO/C=C/C(=O)N WXVL_AK0084SB3226 [1,1,0,0,0,0|1,0,1]=4 384 B7R0.4 CCO/C=C/C(=O)N WXVL_AK0084SB3226 [1,1,0,0,0,0|1,0,1]=4 385 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,1,0,0,0,0|1,0,0]=3 386 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,1,0,0,0,0|1,0,0]=3 387 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,1,0,0,0,0|1,0,1]=4 388 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,1,0,0,0,0|1,0,1]=4 389 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,1,0,0,0,0|1,0,1]=4 390 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,1,0,0,0,0|1,0,1]=4 391 B7R0.6 C=C(C)CNC(=O)C WXVL_AK0761SB0150 [1,1,0,0,0,0|1,0,1]=4 392 B7R0.6 C=C(C)CNC(=O)C WXVL_AK0761SB0150 [1,1,0,0,0,0|1,0,1]=4 393 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [1,1,0,0,0,0|1,0,0]=3 394 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [1,1,0,0,0,0|1,0,0]=3 395 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [1,1,0,0,0,0|1,0,0]=3 396 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [1,1,0,0,0,0|1,0,0]=3 397 B7R0.6 CC(=O)NCC(F)F WXVL_AK0136SB0150 [1,1,0,0,0,0|2,0,0]=4 398 B7R0.6 CC(=O)NCC(F)F WXVL_AK0136SB0150 [1,1,0,0,0,0|2,0,0]=4 399 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [1,1,0,0,0,0|1,0,0]=3 400 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [1,1,0,0,0,0|1,0,0]=3 401 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [1,1,0,0,0,0|1,0,1]=4 402 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [1,1,0,0,0,0|1,0,1]=4 403 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [1,1,0,0,0,0|1,0,1]=4 404 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [1,1,0,0,0,0|1,0,1]=4 405 B9R0.4 CC(=CC(=O)NCCF)C WXVL_AK00466SB0342 [0,1,0,0,0,1|2,0,0]=4 406 B9R0.4 CC(=CC(=O)NCCF)C WXVL_AK00466SB0342 [0,1,0,0,0,1|2,0,0]=4 407 B9R0.4 CCCNC(=O)C=C(C)C WXVL_AK00504SB0342 [0,1,0,0,0,1|1,0,0]=3 408 B9R0.4 CCCNC(=O)C=C(C)C WXVL_AK00504SB0342 [0,1,0,0,0,1|1,0,0]=3 409 B9R0.4 CCCNC(=O)CC(C)C WXVL_AK00504SB0063 [0,1,0,0,0,1|1,0,1]=4 410 B9R0.4 CCCNC(=O)CC(C)C WXVL_AK00504SB0063 [0,1,0,0,0,1|1,0,1]=4 411 B9R0.4 CCCNC(=O)CC(C)O WXVL_AK00504SB3643 [0,1,0,0,0,1|0,0,2]=4 412 B9R0.4 CCCNC(=O)CC(C)O WXVL_AK00504SB3643 [0,1,0,0,0,1|0,0,2]=4 413 B9R0.4 CCCNC(=O)CN(C)C WXVL_AK00504SB0085 [0,1,0,0,0,1|2,0,0]=4 414 B9R0.4 CCCNC(=O)CN(C)C WXVL_AK00504SB0085 [0,1,0,0,0,1|2,0,0]=4 415 B9R0.4 CCOCC(=O)NC(C)C WXVL_AK0030SB0091 [0,1,0,0,0,1|1,0,1]=4 416 B9R0.4 CCOCC(=O)NC(C)C WXVL_AK0030SB0091 [0,1,0,0,0,1|1,0,1]=4 417 B9R0.4 CCSCC(=O)NC(C)C WXVL_AK0030SB0002 [0,1,0,0,0,1|1,0,1]=4 418 B9R0.4 CCSCC(=O)NC(C)C WXVL_AK0030SB0002 [0,1,0,0,0,1|1,0,1]=4 419 B9R0.4 COCCC(=O)NC(C)C WXVL_AK0030SB0156 [0,1,0,0,0,1|1,0,1]=4 420 B9R0.4 COCCC(=O)NC(C)C WXVL_AK0030SB0156 [0,1,0,0,0,1|1,0,1]=4 421 B9R0.4 CSCCC(=O)NC(C)C WXVL_AK0030SB0361 [0,1,0,0,0,1|1,0,1]=4 422 B9R0.4 CSCCC(=O)NC(C)C WXVL_AK0030SB0361 [0,1,0,0,0,1|1,0,1]=4 423 B9R0.6 CCCC(=O)N(C)C(C)C WXVL_AN0073SB0073 [0,1,0,0,0,1|1,0,1]=4 424 B9R0.6 CCCC(=O)N(C)C(C)C WXVL_AN0073SB0073 [0,1,0,0,0,1|1,0,1]=4 425 B9R0.14 CCC[C@@H](CO)NC(=O)C WXVL_AK2551SB0150 [0,1,0,0,0,1|0,0,2]=4 426 B9R0.14 CCC[C@@H](CO)NC(=O)C WXVL_AK2551SB0150 [0,1,0,0,0,1|0,0,2]=4 427 B9R0.23 CCC(C)C(=O)NC(C)C WXVL_AK0030SB0054 [0,1,0,0,0,1|1,0,1]=4 428 B9R0.23 CCC(C)C(=O)NC(C)C WXVL_AK0030SB0054 [0,1,0,0,0,1|1,0,1]=4 429 B9R0.23 CC[C@@H](C)C(=O)NC(C)C WXVL_AK0030SB00054 [0,1,0,0,0,1|1,0,1]=4 430 B9R0.23 CC[C@@H](C)C(=O)NC(C)C WXVL_AK0030SB00054 [0,1,0,0,0,1|1,0,1]=4 431 B9R0.23 CC[C@H](O)C(=O)NC(C)C WXVL_AK0030SB3573 [0,1,0,0,0,1|1,0,1]=4 432 B9R0.23 CC[C@H](O)C(=O)NC(C)C WXVL_AK0030SB3573 [0,1,0,0,0,1|1,0,1]=4 433 B9R0.34 C#C[C@@H](C)NC(=O)CCC WXVL_AK00735SB0073 [0,1,0,0,0,1|1,0,1]=4 434 B9R0.34 C#C[C@@H](C)NC(=O)CCC WXVL_AK00735SB0073 [0,1,0,0,0,1|1,0,1]=4 435 B9R0.34 C=CC(C)NC(=O)CCC WXVL_AK00769SB0073 [0,1,0,0,0,1|1,0,1]=4 436 B9R0.34 C=CC(C)NC(=O)CCC WXVL_AK00769SB0073 [0,1,0,0,0,1|1,0,1]=4 437 B9R0.34 CCCC(=O)NC(C)C#N WXVL_AK00810SB0073 [0,1,0,0,0,1|1,0,1]=4 438 B9R0.34 CCCC(=O)NC(C)C#N WXVL_AK00810SB0073 [0,1,0,0,0,1|1,0,1]=4 439 B9R0.34 CCCC(=O)N[C@@H](C)CC WXVL_AK00678SB0073 [0,1,0,0,0,1|1,0,1]=4 440 B9R0.34 CCCC(=O)N[C@@H](C)CC WXVL_AK00678SB0073 [0,1,0,0,0,1|1,0,1]=4 441 B9R0.34 CCCC(=O)N[C@@H](C)CF WXVL_AK00558SB0073 [0,1,0,0,0,1|1,0,1]=4 442 B9R0.34 CCCC(=O)N[C@@H](C)CF WXVL_AK00558SB0073 [0,1,0,0,0,1|1,0,1]=4 443 B9R0.34 CCCC(=O)N[C@@H](C)CO WXVL_AK0109SB0073 [0,1,0,0,0,1|0,0,2]=4 444 B9R0.34 CCCC(=O)N[C@@H](C)CO WXVL_AK0109SB0073 [0,1,0,0,0,1|0,0,2]=4 445 B9R0.34 CCC[C@H](C)NC(=O)CC WXVL_AK00682SB0064 [0,1,0,0,0,1|1,0,1]=4 446 B9R0.34 CCC[C@H](C)NC(=O)CC WXVL_AK00682SB0064 [0,1,0,0,0,1|1,0,1]=4 447 B9R0.34 CCC[C@H](C)NC(=O)CO WXVL_AK00682SB2706 [0,1,0,0,0,1|1,0,1]=4 448 B9R0.34 CCC[C@H](C)NC(=O)CO WXVL_AK00682SB2706 [0,1,0,0,0,1|1,0,1]=4 449 B9R0.34 CCNC(=O)CC(=O)OC WXVL_AK00476SB2790 [0,1,0,0,0,1|1,0,0]=3 450 B9R0.34 CCNC(=O)CC(=O)OC WXVL_AK00476SB2790 [0,1,0,0,0,1|1,0,0]=3 451 B9R0.34 CCOC(=O)CC(=O)NC WXVL_AK00442SB3094 [0,1,0,0,0,1|1,0,0]=3 452 B9R0.34 CCOC(=O)CC(=O)NC WXVL_AK00442SB3094 [0,1,0,0,0,1|1,0,0]=3 453 B9R0.44 CCCC(=O)NC(C)(C)C WXVL_AK0024SB0073 [0,1,0,0,0,1|1,0,1]=4 454 B9R0.44 CCCC(=O)NC(C)(C)C WXVL_AK0024SB0073 [0,1,0,0,0,1|1,0,1]=4 455 B9R0.44 CCNC(=O)CS(=O)(=O)C WXVL_AK00476SB0162 [0,1,0,0,0,1|2,0,0]=4 456 B9R0.44 CCNC(=O)CS(=O)(=O)C WXVL_AK00476SB0162 [0,1,0,0,0,1|2,0,0]=4 457 B9R0.53 CC(=CC(=O)NC(C)C)C WXVL_AK0030SB0342 [0,1,0,0,0,1|2,0,0]=4 458 B9R0.53 CC(=CC(=O)NC(C)C)C WXVL_AK0030SB0342 [0,1,0,0,0,1|2,0,0]=4 459 B9R0.53 CC(C)CC(=O)NC(C)C WXVL_AK0030SB0063 [0,1,0,0,0,1|1,0,1]=4 460 B9R0.53 CC(C)CC(=O)NC(C)C WXVL_AK0030SB0063 [0,1,0,0,0,1|1,0,1]=4 461 B9R0.53 CC(O)CC(=O)NC(C)C WXVL_AK0030SB3643 [0,1,0,0,0,1|1,0,1]=4 462 B9R0.53 CC(O)CC(=O)NC(C)C WXVL_AK0030SB3643 [0,1,0,0,0,1|1,0,1]=4 463 B9R0.32 CCC(C)(C)C(=O)N(C)C WXVL_AN0032SB0355 [0,2,0,0,0,0|2,0,0]=4 464 B9R0.32 CCC(C)(C)C(=O)N(C)C WXVL_AN0032SB0355 [0,2,0,0,0,0|2,0,0]=4 465 B9R0.32 CCC(C)(O)C(=O)N(C)C WXVL_AN0032SB3009 [0,2,0,0,0,0|2,0,0]=4 466 B9R0.32 CCC(C)(O)C(=O)N(C)C WXVL_AN0032SB3009 [0,2,0,0,0,0|2,0,0]=4 467 B9R0.41 CCC(CC)C(=O)N(C)C WXVL_AN0032SB0055 [0,2,0,0,0,0|2,0,0]=4 468 B9R0.41 CCC(CC)C(=O)N(C)C WXVL_AN0032SB0055 [0,2,0,0,0,0|2,0,0]=4 469 B9R0.41 CCN(CC)C(=O)C(=O)C WXVL_AN0042SB0051 [0,2,0,0,0,0|1,0,0]=3 470 B9R0.41 CCN(CC)C(=O)C(=O)C WXVL_AN0042SB0051 [0,2,0,0,0,0|1,0,0]=3 471 B9R0.41 CCN(CC)C(=O)C(=O)N WXVL_AN0042SB0128 [0,2,0,0,0,0|2,0,0]=4 472 B9R0.41 CCN(CC)C(=O)C(=O)N WXVL_AN0042SB0128 [0,2,0,0,0,0|2,0,0]=4 473 B9R0.79 CC(=O)C(=O)N(C)C(C)C WXVL_AN0073SB0051 [0,2,0,0,0,0|1,0,0]=3 474 B9R0.79 CC(=O)C(=O)N(C)C(C)C WXVL_AN0073SB0051 [0,2,0,0,0,0|1,0,0]=3 475 B9R0.79 CC(C)C(O)C(=O)N(C)C WXVL_AN0032SB1147 [0,2,0,0,0,0|2,0,0]=4 476 B9R0.79 CC(C)C(O)C(=O)N(C)C WXVL_AN0032SB1147 [0,2,0,0,0,0|2,0,0]=4 477 B9R0.79 CC(C)N(C)C(=O)C(=O)N WXVL_AN0073SB0128 [0,2,0,0,0,0|2,0,0]=4 478 B9R0.79 CC(C)N(C)C(=O)C(=O)N WXVL_AN0073SB0128 [0,2,0,0,0,0|2,0,0]=4 479 B9R0.8 C/C=C(\C)/C(=O)NCCC WXVL_AK00504SB0343 [0,2,0,0,0,0|1,0,0]=3 480 B9R0.8 C/C=C(\C)/C(=O)NCCC WXVL_AK00504SB0343 [0,2,0,0,0,0|1,0,0]=3 481 B9R0.8 C/C=C(\C)/C(=O)NCCF WXVL_AK00466SB0343 [0,2,0,0,0,0|2,0,0]=4 482 B9R0.8 C/C=C(\C)/C(=O)NCCF WXVL_AK00466SB0343 [0,2,0,0,0,0|2,0,0]=4 483 B9R0.8 C=CCNC(=O)C(=O)CC WXVL_AK00561SB0344 [0,2,0,0,0,0|0,0,2]=4 484 B9R0.8 C=CCNC(=O)C(=O)CC WXVL_AK00561SB0344 [0,2,0,0,0,0|0,0,2]=4 485 B9R0.8 CCC(=O)C(=O)NCC#N WXVL_AK0683SB0344 [0,2,0,0,0,0|1,0,1]=4 486 B9R0.8 CCC(=O)C(=O)NCC#N WXVL_AK0683SB0344 [0,2,0,0,0,0|1,0,1]=4 487 B9R0.8 CCC(=O)C(=O)NCCF WXVL_AK00466SB0344 [0,2,0,0,0,0|1,0,0]=3 488 B9R0.8 CCC(=O)C(=O)NCCF WXVL_AK00466SB0344 [0,2,0,0,0,0|1,0,0]=3 489 B9R0.8 CCC(=O)N(C)CCOC WXVL_AN0085SB0064 [0,2,0,0,0,0|2,0,0]=4 490 B9R0.8 CCC(=O)N(C)CCOC WXVL_AN0085SB0064 [0,2,0,0,0,0|2,0,0]=4 491 B9R0.8 CCCCC(O)C(=O)NC WXVL_AK00442SB3429 [0,2,0,0,0,0|0,0,2]=4 492 B9R0.8 CCCCC(O)C(=O)NC WXVL_AK00442SB3429 [0,2,0,0,0,0|0,0,2]=4 493 B9R0.8 CCCNC(=O)C(=O)CC WXVL_AK00504SB0344 [0,2,0,0,0,0|0,0,0]=2 494 B9R0.8 CCCNC(=O)C(=O)CC WXVL_AK00504SB0344 [0,2,0,0,0,0|0,0,0]=2 495 B9R0.8 CCCNC(=O)C(C)CC WXVL_AK00504SB0054 [0,2,0,0,0,0|1,0,1]=4 496 B9R0.8 CCCNC(=O)C(C)CC WXVL_AK00504SB0054 [0,2,0,0,0,0|1,0,1]=4 497 B9R0.8 CCCNC(=O)[C@@H](C)OC WXVL_AK00504SB2926 [0,2,0,0,0,0|0,0,2]=4 498 B9R0.8 CCCNC(=O)[C@@H](C)OC WXVL_AK00504SB2926 [0,2,0,0,0,0|0,0,2]=4 499 B9R0.8 CCCNC(=O)[C@@H](O)CC WXVL_AK00504SB3573 [0,2,0,0,0,0|0,0,2]=4 500 B9R0.8 CCCNC(=O)[C@@H](O)CC WXVL_AK00504SB3573 [0,2,0,0,0,0|0,0,2]=4 501 B9R0.8 CCCNC(=O)[C@H](C)CC WXVL_AK00504SB00054 [0,2,0,0,0,0|1,0,1]=4 502 B9R0.8 CCCNC(=O)[C@H](C)CC WXVL_AK00504SB00054 [0,2,0,0,0,0|1,0,1]=4 503 B9R0.8 COCCN(C)C(=O)CO WXVL_AN0085SB2706 [0,2,0,0,0,0|2,0,0]=4 504 B9R0.8 COCCN(C)C(=O)CO WXVL_AN0085SB2706 [0,2,0,0,0,0|2,0,0]=4 505 B9R0.35 CC/C=C(\C)/C(=O)NCC WXVL_AK00476SB0037 [0,2,0,0,0,0|1,0,1]=4 506 B9R0.35 CC/C=C(\C)/C(=O)NCC WXVL_AK00476SB0037 [0,2,0,0,0,0|1,0,1]=4 507 B9R0.35 CCCC(=O)N(C)CC#N WXVL_AN2942SB0073 [0,2,0,0,0,0|2,0,0]=4 508 B9R0.35 CCCC(=O)N(C)CC#N WXVL_AN2942SB0073 [0,2,0,0,0,0|2,0,0]=4 509 B9R0.35 CCCC(=O)N(C)CCO WXVL_AN2670SB0073 [0,2,0,0,0,0|1,0,1]=4 510 B9R0.35 CCCC(=O)N(C)CCO WXVL_AN2670SB0073 [0,2,0,0,0,0|1,0,1]=4 511 B9R0.35 CCCC(C)C(=O)NCC WXVL_AK00476SB0352 [0,2,0,0,0,0|1,0,1]=4 512 B9R0.35 CCCC(C)C(=O)NCC WXVL_AK00476SB0352 [0,2,0,0,0,0|1,0,1]=4 513 B9R0.35 CCC[C@H](O)C(=O)NCC WXVL_AK00476SB3627 [0,2,0,0,0,0|0,0,2]=4 514 B9R0.35 CCC[C@H](O)C(=O)NCC WXVL_AK00476SB3627 [0,2,0,0,0,0|0,0,2]=4 515 B9R0.35 CCNC(=O)C(=O)OCC WXVL_AK00476SB4144 [0,2,0,0,0,0|1,0,0]=3 516 B9R0.35 CCNC(=O)C(=O)OCC WXVL_AK00476SB4144 [0,2,0,0,0,0|1,0,0]=3 517 B9R0.35 CCNC(=O)[C@H](C)NC=O WXVL_AK00476SB5176 [0,2,0,0,0,0|1,0,1]=4 518 B9R0.35 CCNC(=O)[C@H](C)NC=O WXVL_AK00476SB5176 [0,2,0,0,0,0|1,0,1]=4 519 B9R0.37 CCCC(=O)N(CC)CC WXVL_AN0042SB0073 [0,2,0,0,0,0|2,0,0]=4 520 B9R0.37 CCCC(=O)N(CC)CC WXVL_AN0042SB0073 [0,2,0,0,0,0|2,0,0]=4 521 B9R0.60 CCCC(C)(C)C(=O)NC WXVL_AK00442SB0372 [0,2,0,0,0,0|1,0,1]=4 522 B9R0.60 CCCC(C)(C)C(=O)NC WXVL_AK00442SB0372 [0,2,0,0,0,0|1,0,1]=4 523 B9R0.3 CCCNC(=O)C(C)(C)Br WXVL_AK00504SB0432 [0,2,0,0,0,0|1,0,1]=4 524 B9R0.3 CCCNC(=O)C(C)(C)Br WXVL_AK00504SB0432 [0,2,0,0,0,0|1,0,1]=4 525 B9R0.3 CCCNC(=O)C(C)(C)C WXVL_AK00504SB0078 [0,2,0,0,0,0|1,0,1]=4 526 B9R0.3 CCCNC(=O)C(C)(C)C WXVL_AK00504SB0078 [0,2,0,0,0,0|1,0,1]=4 527 B9R0.3 CCCNC(=O)C(C)(C)F WXVL_AK00504SB0199 [0,2,0,0,0,0|1,0,1]=4 528 B9R0.3 CCCNC(=O)C(C)(C)F WXVL_AK00504SB0199 [0,2,0,0,0,0|1,0,1]=4 529 B9R0.3 CCCNC(=O)C(C)(C)O WXVL_AK00504SB0125 [0,2,0,0,0,0|0,0,2]=4 530 B9R0.3 CCCNC(=O)C(C)(C)O WXVL_AK00504SB0125 [0,2,0,0,0,0|0,0,2]=4 531 B9R0.3 CCCNC(=O)C(C)(F)F WXVL_AK00504SB0197 [0,2,0,0,0,0|1,0,1]=4 532 B9R0.3 CCCNC(=O)C(C)(F)F WXVL_AK00504SB0197 [0,2,0,0,0,0|1,0,1]=4 533 B9R0.7 C=C(C)CNC(=O)C(=O)C WXVL_AK0761SB0051 [0,2,0,0,0,0|0,0,1]=3 534 B9R0.7 C=C(C)CNC(=O)C(=O)C WXVL_AK0761SB0051 [0,2,0,0,0,0|0,0,1]=3 535 B9R0.7 C=C(C)CNC(=O)C(=O)N WXVL_AK0761SB0128 [0,2,0,0,0,0|1,0,1]=4 536 B9R0.7 C=C(C)CNC(=O)C(=O)N WXVL_AK0761SB0128 [0,2,0,0,0,0|1,0,1]=4 537 B9R0.7 C=C(F)C(=O)NCC(C)C WXVL_AK00544SB1376 [0,2,0,0,0,0|1,0,1]=4 538 B9R0.7 C=C(F)C(=O)NCC(C)C WXVL_AK00544SB1376 [0,2,0,0,0,0|1,0,1]=4 539 B9R0.7 C=C(F)C(=O)NCC(C)O WXVL_AK0052SB1376 [0,2,0,0,0,0|1,0,1]=4 540 B9R0.7 C=C(F)C(=O)NCC(C)O WXVL_AK0052SB1376 [0,2,0,0,0,0|1,0,1]=4 541 B9R0.7 C=C(F)C(=O)NC[C@H](C)O WXVL_AK0113SB1376 [0,2,0,0,0,0|1,0,1]=4 542 B9R0.7 C=C(F)C(=O)NC[C@H](C)O WXVL_AK0113SB1376 [0,2,0,0,0,0|1,0,1]=4 543 B9R0.7 CC(=O)C(=O)NCC(=O)N WXVL_AK0147SB0051 [0,2,0,0,0,0|1,0,1]=4 544 B9R0.7 CC(=O)C(=O)NCC(=O)N WXVL_AK0147SB0051 [0,2,0,0,0,0|1,0,1]=4 545 B9R0.7 CC(=O)C(=O)NCC(C)C WXVL_AK00544SB0051 [0,2,0,0,0,0|0,0,0]=2 546 B9R0.7 CC(=O)C(=O)NCC(C)C WXVL_AK00544SB0051 [0,2,0,0,0,0|0,0,0]=2 547 B9R0.7 CC(=O)C(=O)NCC(C)O WXVL_AK0052SB0051 [0,2,0,0,0,0|0,0,0]=2 548 B9R0.7 CC(=O)C(=O)NCC(C)O WXVL_AK0052SB0051 [0,2,0,0,0,0|0,0,0]=2 549 B9R0.7 CC(=O)C(=O)NCC(F)F WXVL_AK0136SB0051 [0,2,0,0,0,0|1,0,0]=3 550 B9R0.7 CC(=O)C(=O)NCC(F)F WXVL_AK0136SB0051 [0,2,0,0,0,0|1,0,0]=3 551 B9R0.7 CC(=O)C(=O)NC[C@H](C)O WXVL_AK0113SB0051 [0,2,0,0,0,0|0,0,0]=2 552 B9R0.7 CC(=O)C(=O)NC[C@H](C)O WXVL_AK0113SB0051 [0,2,0,0,0,0|0,0,0]=2 553 B9R0.7 CC(=O)CCC(=O)N(C)C WXVL_AN0032SB0072 [0,2,0,0,0,0|2,0,0]=4 554 B9R0.7 CC(=O)CCC(=O)N(C)C WXVL_AN0032SB0072 [0,2,0,0,0,0|2,0,0]=4 555 B9R0.7 CC(=O)N(C)CCN(C)C WXVL_AN0052SB0150 [0,2,0,0,0,0|2,0,0]=4 556 B9R0.7 CC(=O)N(C)CCN(C)C WXVL_AN0052SB0150 [0,2,0,0,0,0|2,0,0]=4 557 B9R0.7 CC(C)C(=O)NC[C@H](C)O WXVL_AK0113SB0052 [0,2,0,0,0,0|1,0,1]=4 558 B9R0.7 CC(C)C(=O)NC[C@H](C)O WXVL_AK0113SB0052 [0,2,0,0,0,0|1,0,1]=4 559 B9R0.7 CC(C)CCC(=O)N(C)C WXVL_AN0032SB0354 [0,2,0,0,0,0|2,0,0]=4 560 B9R0.7 CC(C)CCC(=O)N(C)C WXVL_AN0032SB0354 [0,2,0,0,0,0|2,0,0]=4 561 B9R0.7 CC(C)CNC(=O)C(=O)N WXVL_AK00544SB0128 [0,2,0,0,0,0|1,0,0]=3 562 B9R0.7 CC(C)CNC(=O)C(=O)N WXVL_AK00544SB0128 [0,2,0,0,0,0|1,0,0]=3 563 B9R0.7 CC(C)CNC(=O)C(C)C WXVL_AK00544SB0052 [0,2,0,0,0,0|1,0,1]=4 564 B9R0.7 CC(C)CNC(=O)C(C)C WXVL_AK00544SB0052 [0,2,0,0,0,0|1,0,1]=4 565 B9R0.7 CC(C)CNC(=O)C(C)S WXVL_AK00544SB2708 [0,2,0,0,0,0|0,1,1]=4 566 B9R0.7 CC(C)CNC(=O)C(C)S WXVL_AK00544SB2708 [0,2,0,0,0,0|0,1,1]=4 567 B9R0.7 CC(C)CNC(=O)[C@@H](C)O WXVL_AK00544SB1085 [0,2,0,0,0,0|0,0,2]=4 568 B9R0.7 CC(C)CNC(=O)[C@@H](C)O WXVL_AK00544SB1085 [0,2,0,0,0,0|0,0,2]=4 569 B9R0.7 CC(C)OCC(=O)N(C)C WXVL_AN0032SB0213 [0,2,0,0,0,0|2,0,0]=4 570 B9R0.7 CC(C)OCC(=O)N(C)C WXVL_AN0032SB0213 [0,2,0,0,0,0|2,0,0]=4 571 B9R0.7 CC(O)CNC(=O)C(=O)N WXVL_AK0052SB0128 [0,2,0,0,0,0|1,0,0]=3 572 B9R0.7 CC(O)CNC(=O)C(=O)N WXVL_AK0052SB0128 [0,2,0,0,0,0|1,0,0]=3 573 B9R0.7 CC(O)CNC(=O)C(C)C WXVL_AK0052SB0052 [0,2,0,0,0,0|1,0,1]=4 574 B9R0.7 CC(O)CNC(=O)C(C)C WXVL_AK0052SB0052 [0,2,0,0,0,0|1,0,1]=4 575 B9R0.7 CC(O)CNC(=O)C(C)S WXVL_AK0052SB2708 [0,2,0,0,0,0|0,1,1]=4 576 B9R0.7 CC(O)CNC(=O)C(C)S WXVL_AK0052SB2708 [0,2,0,0,0,0|0,1,1]=4 577 B9R0.7 CC(O)CNC(=O)[C@@H](C)O WXVL_AK0052SB1085 [0,2,0,0,0,0|0,0,2]=4 578 B9R0.7 CC(O)CNC(=O)[C@@H](C)O WXVL_AK0052SB1085 [0,2,0,0,0,0|0,0,2]=4 579 B9R0.7 CC(S)C(=O)NC[C@H](C)O WXVL_AK0113SB2708 [0,2,0,0,0,0|0,1,1]=4 580 B9R0.7 CC(S)C(=O)NC[C@H](C)O WXVL_AK0113SB2708 [0,2,0,0,0,0|0,1,1]=4 581 B9R0.7 CN(C)CCC(=O)N(C)C WXVL_AN0032SB00052 [0,2,0,0,0,0|2,0,0]=4 582 B9R0.7 CN(C)CCC(=O)N(C)C WXVL_AN0032SB00052 [0,2,0,0,0,0|2,0,0]=4 583 B9R0.7 C[C@H](O)CNC(=O)C(=O)N WXVL_AK0113SB0128 [0,2,0,0,0,0|1,0,0]=3 584 B9R0.7 C[C@H](O)CNC(=O)C(=O)N WXVL_AK0113SB0128 [0,2,0,0,0,0|1,0,0]=3 585 B9R0.7 C[C@H](O)CNC(=O)[C@@H](C)O WXVL_AK0113SB1085 [0,2,0,0,0,0|0,0,2]=4 586 B9R0.7 C[C@H](O)CNC(=O)[C@@H](C)O WXVL_AK0113SB1085 [0,2,0,0,0,0|0,0,2]=4 587 B9R0.7 NC(=O)C(=O)NCC(F)F WXVL_AK0136SB0128 [0,2,0,0,0,0|2,0,0]=4 588 B9R0.7 NC(=O)C(=O)NCC(F)F WXVL_AK0136SB0128 [0,2,0,0,0,0|2,0,0]=4 589 B9R0.42 C#C[C@@H](C)NC(=O)C(=O)C WXVL_AK00735SB0051 [0,2,0,0,0,0|1,0,0]=3 590 B9R0.42 C#C[C@@H](C)NC(=O)C(=O)C WXVL_AK00735SB0051 [0,2,0,0,0,0|1,0,0]=3 591 B9R0.42 C#C[C@@H](C)NC(=O)C(=O)N WXVL_AK00735SB0128 [0,2,0,0,0,0|2,0,0]=4 592 B9R0.42 C#C[C@@H](C)NC(=O)C(=O)N WXVL_AK00735SB0128 [0,2,0,0,0,0|2,0,0]=4 593 B9R0.42 C=C(F)C(=O)N[C@@H](C)CC WXVL_AK00678SB1376 [0,2,0,0,0,0|1,0,1]=4 594 B9R0.42 C=C(F)C(=O)N[C@@H](C)CC WXVL_AK00678SB1376 [0,2,0,0,0,0|1,0,1]=4 595 B9R0.42 C=CC(C)NC(=O)C(=O)C WXVL_AK00769SB0051 [0,2,0,0,0,0|1,0,0]=3 596 B9R0.42 C=CC(C)NC(=O)C(=O)C WXVL_AK00769SB0051 [0,2,0,0,0,0|1,0,0]=3 597 B9R0.42 C=CC(C)NC(=O)C(=O)N WXVL_AK00769SB0128 [0,2,0,0,0,0|2,0,0]=4 598 B9R0.42 C=CC(C)NC(=O)C(=O)N WXVL_AK00769SB0128 [0,2,0,0,0,0|2,0,0]=4 599 B9R0.42 CC(=O)C(=O)NC(C)C#N WXVL_AK00810SB0051 [0,2,0,0,0,0|1,0,0]=3 600 B9R0.42 CC(=O)C(=O)NC(C)C#N WXVL_AK00810SB0051 [0,2,0,0,0,0|1,0,0]=3 601 B9R0.42 CC(=O)C(=O)N[C@@H](C)CF WXVL_AK00558SB0051 [0,2,0,0,0,0|1,0,0]=3 602 B9R0.42 CC(=O)C(=O)N[C@@H](C)CF WXVL_AK00558SB0051 [0,2,0,0,0,0|1,0,0]=3 603 B9R0.42 CC(=O)C(=O)N[C@@H](C)CO WXVL_AK0109SB0051 [0,2,0,0,0,0|1,0,0]=3 604 B9R0.42 CC(=O)C(=O)N[C@@H](C)CO WXVL_AK0109SB0051 [0,2,0,0,0,0|1,0,0]=3 605 B9R0.42 CC(C#N)NC(=O)C(=O)N WXVL_AK00810SB0128 [0,2,0,0,0,0|2,0,0]=4 606 B9R0.42 CC(C#N)NC(=O)C(=O)N WXVL_AK00810SB0128 [0,2,0,0,0,0|2,0,0]=4 607 B9R0.42 CCC(C)CC(=O)N(C)C WXVL_AN0032SB0353 [0,2,0,0,0,0|2,0,0]=4 608 B9R0.42 CCC(C)CC(=O)N(C)C WXVL_AN0032SB0353 [0,2,0,0,0,0|2,0,0]=4 609 B9R0.42 CCC(O)CC(=O)N(C)C WXVL_AN0032SB4092 [0,2,0,0,0,0|2,0,0]=4 610 B9R0.42 CCC(O)CC(=O)N(C)C WXVL_AN0032SB4092 [0,2,0,0,0,0|2,0,0]=4 611 B9R0.42 CC[C@@H](C)CC(=O)N(C)C WXVL_AN0032SB8650 [0,2,0,0,0,0|2,0,0]=4 612 B9R0.42 CC[C@@H](C)CC(=O)N(C)C WXVL_AN0032SB8650 [0,2,0,0,0,0|2,0,0]=4 613 B9R0.42 CC[C@H](C)NC(=O)C(=O)C WXVL_AK00678SB0051 [0,2,0,0,0,0|0,0,0]=2 614 B9R0.42 CC[C@H](C)NC(=O)C(=O)C WXVL_AK00678SB0051 [0,2,0,0,0,0|0,0,0]=2 615 B9R0.42 CC[C@H](C)NC(=O)C(=O)N WXVL_AK00678SB0128 [0,2,0,0,0,0|1,0,0]=3 616 B9R0.42 CC[C@H](C)NC(=O)C(=O)N WXVL_AK00678SB0128 [0,2,0,0,0,0|1,0,0]=3 617 B9R0.42 CC[C@H](C)NC(=O)C(C)C WXVL_AK00678SB0052 [0,2,0,0,0,0|1,0,1]=4 618 B9R0.42 CC[C@H](C)NC(=O)C(C)C WXVL_AK00678SB0052 [0,2,0,0,0,0|1,0,1]=4 619 B9R0.42 CC[C@H](C)NC(=O)C(C)S WXVL_AK00678SB2708 [0,2,0,0,0,0|0,1,1]=4 620 B9R0.42 CC[C@H](C)NC(=O)C(C)S WXVL_AK00678SB2708 [0,2,0,0,0,0|0,1,1]=4 621 B9R0.42 CC[C@H](C)NC(=O)[C@@H](C)O WXVL_AK00678SB1085 [0,2,0,0,0,0|0,0,2]=4 622 B9R0.42 CC[C@H](C)NC(=O)[C@@H](C)O WXVL_AK00678SB1085 [0,2,0,0,0,0|0,0,2]=4 623 B9R0.42 C[C@@H](CF)NC(=O)C(=O)N WXVL_AK00558SB0128 [0,2,0,0,0,0|2,0,0]=4 624 B9R0.42 C[C@@H](CF)NC(=O)C(=O)N WXVL_AK00558SB0128 [0,2,0,0,0,0|2,0,0]=4 625 B9R0.42 C[C@@H](CO)NC(=O)C(=O)N WXVL_AK0109SB0128 [0,2,0,0,0,0|2,0,0]=4 626 B9R0.42 C[C@@H](CO)NC(=O)C(=O)N WXVL_AK0109SB0128 [0,2,0,0,0,0|2,0,0]=4 627 B9R0.47 C#CCCCC(=O)N(C)C WXVL_AN0032SB2709 [0,2,0,0,0,0|2,0,0]=4 628 B9R0.47 C#CCCCC(=O)N(C)C WXVL_AN0032SB2709 [0,2,0,0,0,0|2,0,0]=4 629 B9R0.47 C#CCCNC(=O)C(=O)C WXVL_AK3109SB0051 [0,2,0,0,0,0|0,0,1]=3 630 B9R0.47 C#CCCNC(=O)C(=O)C WXVL_AK3109SB0051 [0,2,0,0,0,0|0,0,1]=3 631 B9R0.47 C#CCCNC(=O)C(=O)N WXVL_AK3109SB0128 [0,2,0,0,0,0|1,0,1]=4 632 B9R0.47 C#CCCNC(=O)C(=O)N WXVL_AK3109SB0128 [0,2,0,0,0,0|1,0,1]=4 633 B9R0.47 C=C(F)C(=O)NCCCC WXVL_AK00588SB1376 [0,2,0,0,0,0|1,0,1]=4 634 B9R0.47 C=C(F)C(=O)NCCCC WXVL_AK00588SB1376 [0,2,0,0,0,0|1,0,1]=4 635 B9R0.47 C=C(F)C(=O)NCCCO WXVL_AK0073SB1376 [0,2,0,0,0,0|1,0,1]=4 636 B9R0.47 C=C(F)C(=O)NCCCO WXVL_AK0073SB1376 [0,2,0,0,0,0|1,0,1]=4 637 B9R0.47 C=C(F)C(=O)NCCSC WXVL_AK00440SB1376 [0,2,0,0,0,0|1,0,1]=4 638 B9R0.47 C=C(F)C(=O)NCCSC WXVL_AK00440SB1376 [0,2,0,0,0,0|1,0,1]=4 639 B9R0.47 C=CCCCC(=O)N(C)C WXVL_AN0032SB2920 [0,2,0,0,0,0|2,0,0]=4 640 B9R0.47 C=CCCCC(=O)N(C)C WXVL_AN0032SB2920 [0,2,0,0,0,0|2,0,0]=4 641 B9R0.47 C=CCCNC(=O)C(=O)C WXVL_AK00138SB0051 [0,2,0,0,0,0|0,0,1]=3 642 B9R0.47 C=CCCNC(=O)C(=O)C WXVL_AK00138SB0051 [0,2,0,0,0,0|0,0,1]=3 643 B9R0.47 C=CCCNC(=O)C(=O)N WXVL_AK00138SB0128 [0,2,0,0,0,0|1,0,1]=4 644 B9R0.47 C=CCCNC(=O)C(=O)N WXVL_AK00138SB0128 [0,2,0,0,0,0|1,0,1]=4 645 B9R0.47 CC(=O)C(=O)NCCC#N WXVL_AK0087SB0051 [0,2,0,0,0,0|0,0,1]=3 646 B9R0.47 CC(=O)C(=O)NCCC#N WXVL_AK0087SB0051 [0,2,0,0,0,0|0,0,1]=3 647 B9R0.47 CC(=O)C(=O)NCCCO WXVL_AK0073SB0051 [0,2,0,0,0,0|0,0,0]=2 648 B9R0.47 CC(=O)C(=O)NCCCO WXVL_AK0073SB0051 [0,2,0,0,0,0|0,0,0]=2 649 B9R0.47 CC(C)C(=O)NCCCO WXVL_AK0073SB0052 [0,2,0,0,0,0|1,0,1]=4 650 B9R0.47 CC(C)C(=O)NCCCO WXVL_AK0073SB0052 [0,2,0,0,0,0|1,0,1]=4 651 B9R0.47 CC(S)C(=O)NCCCO WXVL_AK0073SB2708 [0,2,0,0,0,0|0,1,1]=4 652 B9R0.47 CC(S)C(=O)NCCCO WXVL_AK0073SB2708 [0,2,0,0,0,0|0,1,1]=4 653 B9R0.47 CC/C=C/CC(=O)N(C)C WXVL_AN0032SB0349 [0,2,0,0,0,0|2,0,0]=4 654 B9R0.47 CC/C=C/CC(=O)N(C)C WXVL_AN0032SB0349 [0,2,0,0,0,0|2,0,0]=4 655 B9R0.47 CCCCNC(=O)C(=O)C WXVL_AK00588SB0051 [0,2,0,0,0,0|0,0,0]=2 656 B9R0.47 CCCCNC(=O)C(=O)C WXVL_AK00588SB0051 [0,2,0,0,0,0|0,0,0]=2 657 B9R0.47 CCCCNC(=O)C(=O)N WXVL_AK00588SB0128 [0,2,0,0,0,0|1,0,0]=3 658 B9R0.47 CCCCNC(=O)C(=O)N WXVL_AK00588SB0128 [0,2,0,0,0,0|1,0,0]=3 659 B9R0.47 CCCCNC(=O)C(C)C WXVL_AK00588SB0052 [0,2,0,0,0,0|1,0,1]=4 660 B9R0.47 CCCCNC(=O)C(C)C WXVL_AK00588SB0052 [0,2,0,0,0,0|1,0,1]=4 661 B9R0.47 CCCCNC(=O)C(C)S WXVL_AK00588SB2708 [0,2,0,0,0,0|0,1,1]=4 662 B9R0.47 CCCCNC(=O)C(C)S WXVL_AK00588SB2708 [0,2,0,0,0,0|0,1,1]=4 663 B9R0.47 CCCCNC(=O)[C@@H](C)O WXVL_AK00588SB1085 [0,2,0,0,0,0|0,0,2]=4 664 B9R0.47 CCCCNC(=O)[C@@H](C)O WXVL_AK00588SB1085 [0,2,0,0,0,0|0,0,2]=4 665 B9R0.47 CN(C)C(=O)CCCCBr WXVL_AN0032SB3153 [0,2,0,0,0,0|2,0,0]=4 666 B9R0.47 CN(C)C(=O)CCCCBr WXVL_AN0032SB3153 [0,2,0,0,0,0|2,0,0]=4 667 B9R0.47 CN(C)C(=O)CCCCCl WXVL_AN0032SB0379 [0,2,0,0,0,0|2,0,0]=4 668 B9R0.47 CN(C)C(=O)CCCCCl WXVL_AN0032SB0379 [0,2,0,0,0,0|2,0,0]=4 669 B9R0.47 CN(C)C(=O)NCCCCl WXVL_AN0032YV0130 [0,2,0,0,0,0|2,0,0]=4 670 B9R0.47 CN(C)C(=O)NCCCCl WXVL_AN0032YV0130 [0,2,0,0,0,0|2,0,0]=4 671 B9R0.47 CSCCNC(=O)C(=O)C WXVL_AK00440SB0051 [0,2,0,0,0,0|0,0,0]=2 672 B9R0.47 CSCCNC(=O)C(=O)C WXVL_AK00440SB0051 [0,2,0,0,0,0|0,0,0]=2 673 B9R0.47 CSCCNC(=O)C(=O)N WXVL_AK00440SB0128 [0,2,0,0,0,0|1,0,0]=3 674 B9R0.47 CSCCNC(=O)C(=O)N WXVL_AK00440SB0128 [0,2,0,0,0,0|1,0,0]=3 675 B9R0.47 CSCCNC(=O)C(C)C WXVL_AK00440SB0052 [0,2,0,0,0,0|1,0,1]=4 676 B9R0.47 CSCCNC(=O)C(C)C WXVL_AK00440SB0052 [0,2,0,0,0,0|1,0,1]=4 677 B9R0.47 CSCCNC(=O)C(C)S WXVL_AK00440SB2708 [0,2,0,0,0,0|0,1,1]=4 678 B9R0.47 CSCCNC(=O)C(C)S WXVL_AK00440SB2708 [0,2,0,0,0,0|0,1,1]=4 679 B9R0.47 CSCCNC(=O)[C@@H](C)O WXVL_AK00440SB1085 [0,2,0,0,0,0|0,0,2]=4 680 B9R0.47 CSCCNC(=O)[C@@H](C)O WXVL_AK00440SB1085 [0,2,0,0,0,0|0,0,2]=4 681 B9R0.47 C[C@@H](O)C(=O)NCCCO WXVL_AK0073SB1085 [0,2,0,0,0,0|0,0,2]=4 682 B9R0.47 C[C@@H](O)C(=O)NCCCO WXVL_AK0073SB1085 [0,2,0,0,0,0|0,0,2]=4 683 B9R0.47 N#CCCNC(=O)C(=O)N WXVL_AK0087SB0128 [0,2,0,0,0,0|1,0,1]=4 684 B9R0.47 N#CCCNC(=O)C(=O)N WXVL_AK0087SB0128 [0,2,0,0,0,0|1,0,1]=4 685 B9R0.47 NC(=O)C(=O)NCCCO WXVL_AK0073SB0128 [0,2,0,0,0,0|1,0,0]=3 686 B9R0.47 NC(=O)C(=O)NCCCO WXVL_AK0073SB0128 [0,2,0,0,0,0|1,0,0]=3 687 B9R0.15 CCCN(CCC)C(=O)C WXVL_AN00632SB0150 [0,2,0,0,0,0|2,0,0]=4 688 B9R0.33 CCCN(C(=O)C)C(C)C WXVL_AN7248SB0150 [0,2,0,0,0,0|2,0,0]=4 689 B9R0.57 CC(=O)C(=O)NC(C)(C)C WXVL_AK0024SB0051 [0,2,0,0,0,0|1,0,0]=3 690 B9R0.57 CC(=O)C(=O)NC(C)(C)C WXVL_AK0024SB0051 [0,2,0,0,0,0|1,0,0]=3 691 B9R0.57 CC(C)(C)NC(=O)C(=O)N WXVL_AK0024SB0128 [0,2,0,0,0,0|2,0,0]=4 692 B9R0.57 CC(C)(C)NC(=O)C(=O)N WXVL_AK0024SB0128 [0,2,0,0,0,0|2,0,0]=4 693 B9R0.57 CN(C)C(=O)CC(C)(C)C WXVL_AN0032SB0062 [0,2,0,0,0,0|2,0,0]=4 694 B9R0.57 CN(C)C(=O)CC(C)(C)C WXVL_AN0032SB0062 [0,2,0,0,0,0|2,0,0]=4 695 B9R0.57 CN(C)C(=O)CC(C)(C)O WXVL_AN0032SB0163 [0,2,0,0,0,0|2,0,0]=4 696 B9R0.57 CN(C)C(=O)CC(C)(C)O WXVL_AN0032SB0163 [0,2,0,0,0,0|2,0,0]=4 697 B7R1.22 CNC(=O)C1CC1 WXVL_AK00442SB0038 [1,0,0,1,0,0|1,0,0]=3 698 B7R1.22 CNC(=O)C1CC1 WXVL_AK00442SB0038 [1,0,0,1,0,0|1,0,0]=3 699 B7R1.20 CC(=O)NC1CC1 WXVL_AK0001SB0150 [1,0,0,1,0,0|1,0,0]=3 700 B7R1.20 CC(=O)NC1CC1 WXVL_AK0001SB0150 [1,0,0,1,0,0|1,0,0]=3 701 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [1,0,0,1,0,0|1,0,1]=4 702 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [1,0,0,1,0,0|1,0,1]=4 703 B9R1.41 CC(=O)N1CCC[C@H]1C WXVL_AN00593SB0150 [0,0,0,1,0,1|1,0,1]=4 704 B9R1.53 CC(=O)NC1CC(C1)C WXVL_AK0309SB0150 [0,0,0,1,0,1|1,0,1]=4 705 B9R1.53 CC(=O)NC1CC(C1)C WXVL_AK0309SB0150 [0,0,0,1,0,1|1,0,1]=4 706 B9R1.75 CCCC(=O)NC1CC1 WXVL_AK0001SB0073 [0,0,0,1,0,1|1,0,1]=4 707 B9R1.75 CCCC(=O)NC1CC1 WXVL_AK0001SB0073 [0,0,0,1,0,1|1,0,1]=4 708 B9R1.137 CC(=O)NC(C)C1CC1 WXVL_AK00200SB0150 [0,0,0,1,0,1|1,0,1]=4 709 B9R1.137 CC(=O)NC(C)C1CC1 WXVL_AK00200SB0150 [0,0,0,1,0,1|1,0,1]=4 710 B9R1.137 CC(=O)N[C@@H](C)C1CC1 WXVL_AK0484SB0150 [0,0,0,1,0,1|1,0,1]=4 711 B9R1.137 CC(=O)N[C@@H](C)C1CC1 WXVL_AK0484SB0150 [0,0,0,1,0,1|1,0,1]=4 712 B9R1.137 CC(C)NC(=O)C1CC1 WXVL_AK0030SB0038 [0,0,0,1,0,1|1,0,1]=4 713 B9R1.137 CC(C)NC(=O)C1CC1 WXVL_AK0030SB0038 [0,0,0,1,0,1|1,0,1]=4 714 B9R1.45 CC1CC1C(=O)N(C)C WXVL_AN0032SB0041 [0,1,0,1,0,0|2,0,0]=4 715 B9R1.45 CC1CC1C(=O)N(C)C WXVL_AN0032SB0041 [0,1,0,1,0,0|2,0,0]=4 716 B9R1.45 CN(C)C(=O)[C@@H]1C[C@@H]1F WXVL_AN0032SB1245 [0,1,0,1,0,0|2,0,0]=4 717 B9R1.45 CN(C)C(=O)[C@@H]1C[C@@H]1F WXVL_AN0032SB1245 [0,1,0,1,0,0|2,0,0]=4 718 B9R1.45 CN(C)C(=O)[C@H]1C[C@H]1F WXVL_AN0032SB00019 [0,1,0,1,0,0|2,0,0]=4 719 B9R1.45 CN(C)C(=O)[C@H]1C[C@H]1F WXVL_AN0032SB00019 [0,1,0,1,0,0|2,0,0]=4 720 B9R1.101 CCC(=O)N(C)C1CC1 WXVL_AN0276SB0064 [0,1,0,1,0,0|2,0,0]=4 721 B9R1.101 CCC(=O)N(C)C1CC1 WXVL_AN0276SB0064 [0,1,0,1,0,0|2,0,0]=4 722 B9R1.101 CN(C(=O)CO)C1CC1 WXVL_AN0276SB2706 [0,1,0,1,0,0|2,0,0]=4 723 B9R1.101 CN(C(=O)CO)C1CC1 WXVL_AN0276SB2706 [0,1,0,1,0,0|2,0,0]=4 724 B9R1.101 CNC(=O)C(=O)C1CC1 WXVL_AK00442SB3659 [0,1,0,1,0,0|0,0,0]=2 725 B9R1.101 CNC(=O)C(=O)C1CC1 WXVL_AK00442SB3659 [0,1,0,1,0,0|0,0,0]=2 726 B9R1.110 CN(C)C(=O)C1CCC1 WXVL_AN0032SB0042 [0,1,0,1,0,0|2,0,0]=4 727 B9R1.110 CN(C)C(=O)C1CCC1 WXVL_AN0032SB0042 [0,1,0,1,0,0|2,0,0]=4 728 B9R1.111 CN(C)C(=O)C1(CC1)Br WXVL_AN0032SB5517 [0,1,0,1,0,0|2,0,0]=4 729 B9R1.111 CN(C)C(=O)C1(CC1)Br WXVL_AN0032SB5517 [0,1,0,1,0,0|2,0,0]=4 730 B9R1.111 CN(C)C(=O)C1(CC1)C WXVL_AN0032SB0040 [0,1,0,1,0,0|2,0,0]=4 731 B9R1.111 CN(C)C(=O)C1(CC1)C WXVL_AN0032SB0040 [0,1,0,1,0,0|2,0,0]=4 732 B9R1.111 CN(C)C(=O)C1(CC1)F WXVL_AN0032SB0218 [0,1,0,1,0,0|2,0,0]=4 733 B9R1.111 CN(C)C(=O)C1(CC1)F WXVL_AN0032SB0218 [0,1,0,1,0,0|2,0,0]=4 734 B9R1.111 CN(C)C(=O)C1(CC1)O WXVL_AN0032SB2965 [0,1,0,1,0,0|2,0,0]=4 735 B9R1.111 CN(C)C(=O)C1(CC1)O WXVL_AN0032SB2965 [0,1,0,1,0,0|2,0,0]=4 736 B9R1.11 CCC(=O)N1CCCC1 WXVL_AN0008SB0064 [0,1,0,1,0,0|2,0,0]=4 737 B9R1.11 CCC(=O)N1CCCC1 WXVL_AN0008SB0064 [0,1,0,1,0,0|2,0,0]=4 738 B9R1.11 CNC(=O)C1CCCC1 WXVL_AK00442SB0043 [0,1,0,1,0,0|1,0,1]=4 739 B9R1.11 CNC(=O)C1CCCC1 WXVL_AK00442SB0043 [0,1,0,1,0,0|1,0,1]=4 740 B9R1.11 CNC(=O)C1CCCO1 WXVL_AK00442SB1033 [0,1,0,1,0,0|0,0,2]=4 741 B9R1.11 CNC(=O)C1CCCO1 WXVL_AK00442SB1033 [0,1,0,1,0,0|0,0,2]=4 742 B9R1.11 CNC(=O)C1CCCS1 WXVL_AK00442SB0022 [0,1,0,1,0,0|0,1,1]=4 743 B9R1.11 CNC(=O)C1CCCS1 WXVL_AK00442SB0022 [0,1,0,1,0,0|0,1,1]=4 744 B9R1.11 CNC(=O)[C@H]1CCCO1 WXVL_AK00442SB00043 [0,1,0,1,0,0|0,0,2]=4 745 B9R1.11 CNC(=O)[C@H]1CCCO1 WXVL_AK00442SB00043 [0,1,0,1,0,0|0,0,2]=4 746 B9R1.11 O=C(CO)N1CCCC1 WXVL_AN0008SB2706 [0,1,0,1,0,0|2,0,0]=4 747 B9R1.11 O=C(CO)N1CCCC1 WXVL_AN0008SB2706 [0,1,0,1,0,0|2,0,0]=4 748 B9R1.82 CC1CN(C1)C(=O)CO WXVL_AN0291SB2706 [0,1,0,1,0,0|2,0,0]=4 749 B9R1.82 CC1CN(C1)C(=O)CO WXVL_AN0291SB2706 [0,1,0,1,0,0|2,0,0]=4 750 B9R1.82 CCC(=O)N1CC(C1)C WXVL_AN0291SB0064 [0,1,0,1,0,0|2,0,0]=4 751 B9R1.82 CCC(=O)N1CC(C1)C WXVL_AN0291SB0064 [0,1,0,1,0,0|2,0,0]=4 752 B9R1.186 CNC(=O)C1(CCC1)Br WXVL_AK00442SB0465 [0,1,0,1,0,0|1,0,1]=4 753 B9R1.186 CNC(=O)C1(CCC1)Br WXVL_AK00442SB0465 [0,1,0,1,0,0|1,0,1]=4 754 B9R1.186 CNC(=O)C1(CCC1)C WXVL_AK00442SB0805 [0,1,0,1,0,0|1,0,1]=4 755 B9R1.186 CNC(=O)C1(CCC1)C WXVL_AK00442SB0805 [0,1,0,1,0,0|1,0,1]=4 756 B9R1.186 CNC(=O)C1(CCC1)F WXVL_AK00442SB0033 [0,1,0,1,0,0|1,0,1]=4 757 B9R1.186 CNC(=O)C1(CCC1)F WXVL_AK00442SB0033 [0,1,0,1,0,0|1,0,1]=4 758 B9R1.6 CC(=O)N1CCOCC1 WXVL_AN00478SB0150 [0,1,0,1,0,0|2,0,0]=4 759 B9R1.6 CC(=O)N1CCOCC1 WXVL_AN00478SB0150 [0,1,0,1,0,0|2,0,0]=4 760 B9R1.6 CC(=O)N1CCSCC1 WXVL_AN0896SB0150 [0,1,0,1,0,0|2,0,0]=4 761 B9R1.6 NC(=O)C1=CCCCO1 WXVL_AK0084SB4858 [0,1,0,1,0,0|1,0,1]=4 762 B9R1.6 NC(=O)C1=CCCCO1 WXVL_AK0084SB4858 [0,1,0,1,0,0|1,0,1]=4 763 B9R1.6 NC(=O)C1=COCCC1 WXVL_AK0084SB2928 [0,1,0,1,0,0|1,0,1]=4 764 B9R1.6 NC(=O)C1=COCCC1 WXVL_AK0084SB2928 [0,1,0,1,0,0|1,0,1]=4 765 B9R1.35 CC(=O)N1CCC(C1)Br WXVL_AN00715SB0150 [0,1,0,1,0,0|2,0,0]=4 766 B9R1.35 CC(=O)N1CCC(C1)C WXVL_AN0556SB0150 [0,1,0,1,0,0|2,0,0]=4 767 B9R1.35 CC(=O)N1CCC(C1)C WXVL_AN0556SB0150 [0,1,0,1,0,0|2,0,0]=4 768 B9R1.35 CC(=O)N1CCC(C1)F WXVL_AN00338SB0150 [0,1,0,1,0,0|2,0,0]=4 769 B9R1.35 CC(=O)N1CCC(C1)F WXVL_AN00338SB0150 [0,1,0,1,0,0|2,0,0]=4 770 B9R1.35 CC(=O)N1CCC(C1)O WXVL_AN0158SB0150 [0,1,0,1,0,0|2,0,0]=4 771 B9R1.35 CC(=O)N1CCC(C1)O WXVL_AN0158SB0150 [0,1,0,1,0,0|2,0,0]=4 772 B9R1.35 CC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB0150 [0,1,0,1,0,0|2,0,0]=4 773 B9R1.35 CC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB0150 [0,1,0,1,0,0|2,0,0]=4 774 B9R1.35 CC(=O)N1CC[C@@H](C1)O WXVL_AN00391SB0150 [0,1,0,1,0,0|2,0,0]=4 775 B9R1.35 CC(=O)N1CC[C@@H](C1)O WXVL_AN00391SB0150 [0,1,0,1,0,0|2,0,0]=4 776 B9R1.35 CC(=O)N1CC[C@H](C1)C WXVL_AN00488SB0150 [0,1,0,1,0,0|2,0,0]=4 777 B9R1.35 CC(=O)N1CC[C@H](C1)C WXVL_AN00488SB0150 [0,1,0,1,0,0|2,0,0]=4 778 B9R1.35 CC(=O)N1CC[C@H](C1)F WXVL_AN00035SB0150 [0,1,0,1,0,0|2,0,0]=4 779 B9R1.35 CC(=O)N1CC[C@H](C1)F WXVL_AN00035SB0150 [0,1,0,1,0,0|2,0,0]=4 780 B9R1.35 CC(=O)N1CC[C@H](C1)O WXVL_AN00543SB0150 [0,1,0,1,0,0|2,0,0]=4 781 B9R1.100 CCCNC(=O)C1CC1 WXVL_AK00504SB0038 [0,1,0,1,0,0|1,0,1]=4 782 B9R1.100 CCCNC(=O)C1CC1 WXVL_AK00504SB0038 [0,1,0,1,0,0|1,0,1]=4 783 B9R1.112 C=C(F)C(=O)NC1CC1 WXVL_AK0001SB1376 [0,1,0,1,0,0|1,0,1]=4 784 B9R1.112 C=C(F)C(=O)NC1CC1 WXVL_AK0001SB1376 [0,1,0,1,0,0|1,0,1]=4 785 B9R1.112 CC(=O)C(=O)NC1CC1 WXVL_AK0001SB0051 [0,1,0,1,0,0|0,0,0]=2 786 B9R1.112 CC(=O)C(=O)NC1CC1 WXVL_AK0001SB0051 [0,1,0,1,0,0|0,0,0]=2 787 B9R1.112 CC(C)C(=O)NC1CC1 WXVL_AK0001SB0052 [0,1,0,1,0,0|1,0,1]=4 788 B9R1.112 CC(C)C(=O)NC1CC1 WXVL_AK0001SB0052 [0,1,0,1,0,0|1,0,1]=4 789 B9R1.112 CC(S)C(=O)NC1CC1 WXVL_AK0001SB2708 [0,1,0,1,0,0|0,1,1]=4 790 B9R1.112 CC(S)C(=O)NC1CC1 WXVL_AK0001SB2708 [0,1,0,1,0,0|0,1,1]=4 791 B9R1.112 CN(C)C(=O)CC1CC1 WXVL_AN0032SB0155 [0,1,0,1,0,0|2,0,0]=4 792 B9R1.112 CN(C)C(=O)CC1CC1 WXVL_AN0032SB0155 [0,1,0,1,0,0|2,0,0]=4 793 B9R1.112 C[C@@H](O)C(=O)NC1CC1 WXVL_AK0001SB1085 [0,1,0,1,0,0|0,0,2]=4 794 B9R1.112 C[C@@H](O)C(=O)NC1CC1 WXVL_AK0001SB1085 [0,1,0,1,0,0|0,0,2]=4 795 B9R1.112 NC(=O)C(=O)NC1CC1 WXVL_AK0001SB0128 [0,1,0,1,0,0|1,0,0]=3 796 B9R1.112 NC(=O)C(=O)NC1CC1 WXVL_AK0001SB0128 [0,1,0,1,0,0|1,0,0]=3 797 B9R1.116 CCN(C(=O)C)C1CC1 WXVL_AN0137SB0150 [0,1,0,1,0,0|2,0,0]=4 798 B9R1.116 CCN(C(=O)C)C1CC1 WXVL_AN0137SB0150 [0,1,0,1,0,0|2,0,0]=4 799 B9R1.164 CC(=O)N1CC(C1)(C)O WXVL_AN0497SB0150 [0,1,0,1,0,0|2,0,0]=4 800 B9R1.164 CC(=O)N1CC(C1)(C)O WXVL_AN0497SB0150 [0,1,0,1,0,0|2,0,0]=4 801 B9R0.48 C=C(C)CNC(=O)CCC WXVL_AK0761SB0073 [0,0,0,0,0,2|1,0,0]=3 802 B9R0.48 C=C(C)CNC(=O)CCC WXVL_AK0761SB0073 [0,0,0,0,0,2|1,0,0]=3 803 B9R0.48 C=C(C)CNC(=O)COC WXVL_AK0761SB0090 [0,0,0,0,0,2|2,0,0]=4 804 B9R0.48 C=C(C)CNC(=O)COC WXVL_AK0761SB0090 [0,0,0,0,0,2|2,0,0]=4 805 B9R0.48 C=C(C)CNC(=O)CSC WXVL_AK0761SB1267 [0,0,0,0,0,2|2,0,0]=4 806 B9R0.48 C=C(C)CNC(=O)CSC WXVL_AK0761SB1267 [0,0,0,0,0,2|2,0,0]=4 807 B9R0.48 CCCC(=O)NCC(=O)N WXVL_AK0147SB0073 [0,0,0,0,0,2|1,0,0]=3 808 B9R0.48 CCCC(=O)NCC(=O)N WXVL_AK0147SB0073 [0,0,0,0,0,2|1,0,0]=3 809 B9R0.48 CCCC(=O)NCC(C)C WXVL_AK00544SB0073 [0,0,0,0,0,2|1,0,1]=4 810 B9R0.48 CCCC(=O)NCC(C)C WXVL_AK00544SB0073 [0,0,0,0,0,2|1,0,1]=4 811 B9R0.48 CCCC(=O)NCC(C)O WXVL_AK0052SB0073 [0,0,0,0,0,2|0,0,2]=4 812 B9R0.48 CCCC(=O)NCC(C)O WXVL_AK0052SB0073 [0,0,0,0,0,2|0,0,2]=4 813 B9R0.48 CCCC(=O)NC[C@H](C)O WXVL_AK0113SB0073 [0,0,0,0,0,2|0,0,2]=4 814 B9R0.48 CCCC(=O)NC[C@H](C)O WXVL_AK0113SB0073 [0,0,0,0,0,2|0,0,2]=4 815 B9R0.48 CCNC(=O)C#CC(=O)O WXVL_AK00476SB1110 [0,0,0,0,0,2|2,0,0]=4 816 B9R0.48 CCNC(=O)C#CC(=O)O WXVL_AK00476SB1110 [0,0,0,0,0,2|2,0,0]=4 817 B9R0.48 CCNC(=O)CCC(=O)C WXVL_AK00476SB0072 [0,0,0,0,0,2|1,0,0]=3 818 B9R0.48 CCNC(=O)CCC(=O)C WXVL_AK00476SB0072 [0,0,0,0,0,2|1,0,0]=3 819 B9R0.48 CCNC(=O)CCC(=O)N WXVL_AK00476SB0358 [0,0,0,0,0,2|2,0,0]=4 820 B9R0.48 CCNC(=O)CCC(=O)N WXVL_AK00476SB0358 [0,0,0,0,0,2|2,0,0]=4 821 B9R0.48 CCNC(=O)CNC(=O)C WXVL_AK00476SB0357 [0,0,0,0,0,2|1,0,0]=3 822 B9R0.48 CCNC(=O)CNC(=O)C WXVL_AK00476SB0357 [0,0,0,0,0,2|1,0,0]=3 823 B9R0.48 CCNC(=O)CNC(=O)N WXVL_AK00476SB0746 [0,0,0,0,0,2|2,0,0]=4 824 B9R0.48 CCNC(=O)CNC(=O)N WXVL_AK00476SB0746 [0,0,0,0,0,2|2,0,0]=4 825 B9R0.48 CCNC(=O)COC(=O)C WXVL_AK00476SB2824 [0,0,0,0,0,2|1,0,0]=3 826 B9R0.48 CCNC(=O)COC(=O)C WXVL_AK00476SB2824 [0,0,0,0,0,2|1,0,0]=3 827 B9R0.48 CCNC(=O)CSC(=O)C WXVL_AK00476SB3992 [0,0,0,0,0,2|1,0,0]=3 828 B9R0.48 CCNC(=O)CSC(=O)C WXVL_AK00476SB3992 [0,0,0,0,0,2|1,0,0]=3 829 B9R0.48 CCOC(=O)/C=C/C(=O)N WXVL_AK0084SB0061 [0,0,0,0,0,2|2,0,0]=4 830 B9R0.48 CCOC(=O)/C=C/C(=O)N WXVL_AK0084SB0061 [0,0,0,0,0,2|2,0,0]=4 831 B9R0.48 COCC(=O)NCC(=O)N WXVL_AK0147SB0090 [0,0,0,0,0,2|2,0,0]=4 832 B9R0.48 COCC(=O)NCC(=O)N WXVL_AK0147SB0090 [0,0,0,0,0,2|2,0,0]=4 833 B9R0.48 CSCC(=O)NCC(=O)N WXVL_AK0147SB1267 [0,0,0,0,0,2|2,0,0]=4 834 B9R0.48 CSCC(=O)NCC(=O)N WXVL_AK0147SB1267 [0,0,0,0,0,2|2,0,0]=4