0 B9R0.35 CCCC(=O)N(C)CC#N WXVL_AN2942SB0073 [0,0,0,0,0,0|3,0,1]=4 1 B9R0.35 CCCC(=O)N(C)CC#N WXVL_AN2942SB0073 [0,0,0,0,0,0|3,0,1]=4 2 B9R0.35 CCCC(=O)N(C)CCO WXVL_AN2670SB0073 [0,0,0,0,0,0|3,0,1]=4 3 B9R0.35 CCCC(=O)N(C)CCO WXVL_AN2670SB0073 [0,0,0,0,0,0|3,0,1]=4 4 B9R0.35 CCCC(C)C(=O)NCC WXVL_AK00476SB0352 [0,0,0,0,0,0|1,0,2]=3 5 B9R0.35 CCCC(C)C(=O)NCC WXVL_AK00476SB0352 [0,0,0,0,0,0|1,0,2]=3 6 B9R0.35 CCC[C@H](O)C(=O)NCC WXVL_AK00476SB3627 [0,0,0,0,0,0|2,0,2]=4 7 B9R0.35 CCC[C@H](O)C(=O)NCC WXVL_AK00476SB3627 [0,0,0,0,0,0|2,0,2]=4 8 B9R0.35 CCNC(=O)[C@H](C)NC=O WXVL_AK00476SB5176 [0,0,0,0,0,0|3,0,0]=3 9 B9R0.35 CCNC(=O)[C@H](C)NC=O WXVL_AK00476SB5176 [0,0,0,0,0,0|3,0,0]=3 10 B8R0.1 C#CCCC(=O)NCC WXVL_AK00476SB2189 [1,0,0,0,0,0|1,0,2]=4 11 B8R0.1 C#CCCC(=O)NCC WXVL_AK00476SB2189 [1,0,0,0,0,0|1,0,2]=4 12 B8R0.1 C=CCCC(=O)NCC WXVL_AK00476SB1035 [1,0,0,0,0,0|1,0,0]=2 13 B8R0.1 C=CCCC(=O)NCC WXVL_AK00476SB1035 [1,0,0,0,0,0|1,0,0]=2 14 B8R0.1 C=CCNC(=O)/C=C/C WXVL_AK00561SB0340 [1,0,0,0,0,0|2,0,1]=4 15 B8R0.1 C=CCNC(=O)/C=C/C WXVL_AK00561SB0340 [1,0,0,0,0,0|2,0,1]=4 16 B8R0.1 C=CCNC(=O)C#CC WXVL_AK00561SB1240 [1,0,0,0,0,0|2,0,1]=4 17 B8R0.1 C=CCNC(=O)C#CC WXVL_AK00561SB1240 [1,0,0,0,0,0|2,0,1]=4 18 B8R0.1 C=CCNC(=O)CCC WXVL_AK00561SB0073 [1,0,0,0,0,0|2,0,0]=3 19 B8R0.1 C=CCNC(=O)CCC WXVL_AK00561SB0073 [1,0,0,0,0,0|2,0,0]=3 20 B8R0.1 C=CCNC(=O)COC WXVL_AK00561SB0090 [1,0,0,0,0,0|3,0,0]=4 21 B8R0.1 C=CCNC(=O)COC WXVL_AK00561SB0090 [1,0,0,0,0,0|3,0,0]=4 22 B8R0.1 C=CCNC(=O)CSC WXVL_AK00561SB1267 [1,0,0,0,0,0|3,0,0]=4 23 B8R0.1 C=CCNC(=O)CSC WXVL_AK00561SB1267 [1,0,0,0,0,0|3,0,0]=4 24 B8R0.1 CCNC(=O)CCOC WXVL_AK00476SB0156 [1,0,0,0,0,0|2,0,1]=4 25 B8R0.1 CCNC(=O)CCOC WXVL_AK00476SB0156 [1,0,0,0,0,0|2,0,1]=4 26 B8R0.1 CCNC(=O)CCSC WXVL_AK00476SB0361 [1,0,0,0,0,0|2,0,1]=4 27 B8R0.1 CCNC(=O)CCSC WXVL_AK00476SB0361 [1,0,0,0,0,0|2,0,1]=4 28 B8R0.3 C/C=C(\C)/C(=O)NCC WXVL_AK00476SB0343 [1,0,0,0,0,0|1,0,2]=4 29 B8R0.3 C/C=C(\C)/C(=O)NCC WXVL_AK00476SB0343 [1,0,0,0,0,0|1,0,2]=4 30 B8R0.3 CCC(=O)N(C)CC#N WXVL_AN2942SB0064 [1,0,0,0,0,0|2,0,1]=4 31 B8R0.3 CCC(=O)N(C)CC#N WXVL_AN2942SB0064 [1,0,0,0,0,0|2,0,1]=4 32 B8R0.3 CCC(=O)N(C)CCO WXVL_AN2670SB0064 [1,0,0,0,0,0|2,0,1]=4 33 B8R0.3 CCC(=O)N(C)CCO WXVL_AN2670SB0064 [1,0,0,0,0,0|2,0,1]=4 34 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [1,0,0,0,0,0|1,0,2]=4 35 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [1,0,0,0,0,0|1,0,2]=4 36 B8R0.3 CCNC(=O)C(C)CC WXVL_AK00476SB0054 [1,0,0,0,0,0|1,0,1]=3 37 B8R0.3 CCNC(=O)C(C)CC WXVL_AK00476SB0054 [1,0,0,0,0,0|1,0,1]=3 38 B8R0.3 CCNC(=O)[C@@H](C)OC WXVL_AK00476SB2926 [1,0,0,0,0,0|2,0,1]=4 39 B8R0.3 CCNC(=O)[C@@H](C)OC WXVL_AK00476SB2926 [1,0,0,0,0,0|2,0,1]=4 40 B8R0.3 CCNC(=O)[C@@H](O)CC WXVL_AK00476SB3573 [1,0,0,0,0,0|2,0,1]=4 41 B8R0.3 CCNC(=O)[C@@H](O)CC WXVL_AK00476SB3573 [1,0,0,0,0,0|2,0,1]=4 42 B8R0.3 CCNC(=O)[C@H](C)CC WXVL_AK00476SB00054 [1,0,0,0,0,0|1,0,1]=3 43 B8R0.3 CCNC(=O)[C@H](C)CC WXVL_AK00476SB00054 [1,0,0,0,0,0|1,0,1]=3 44 B8R0.3 CNC(=O)[C@H](C)NC=O WXVL_AK00442SB5176 [1,0,0,0,0,0|3,0,0]=4 45 B8R0.3 CNC(=O)[C@H](C)NC=O WXVL_AK00442SB5176 [1,0,0,0,0,0|3,0,0]=4 46 B10R0.19 C=CCNC(=O)C(=O)OCC WXVL_AK00561SB4144 [0,1,0,0,0,0|1,0,1]=3 47 B10R0.19 C=CCNC(=O)C(=O)OCC WXVL_AK00561SB4144 [0,1,0,0,0,0|1,0,1]=3 48 B10R0.19 C=CCOC(C)C(=O)NCC WXVL_AK00476SBD933 [0,1,0,0,0,0|1,0,0]=2 49 B10R0.19 C=CCOC(C)C(=O)NCC WXVL_AK00476SBD933 [0,1,0,0,0,0|1,0,0]=2 50 B10R0.19 CCCC(C)C(=O)NCCF WXVL_AK00466SB0352 [0,1,0,0,0,0|1,0,2]=4 51 B10R0.19 CCCC(C)C(=O)NCCF WXVL_AK00466SB0352 [0,1,0,0,0,0|1,0,2]=4 52 B10R0.19 CCCNC(=O)C(C)CCC WXVL_AK00504SB0352 [0,1,0,0,0,0|1,0,2]=4 53 B10R0.19 CCCNC(=O)C(C)CCC WXVL_AK00504SB0352 [0,1,0,0,0,0|1,0,2]=4 54 B10R0.19 CCCNC(=O)[C@H](C)NC=O WXVL_AK00504SB5176 [0,1,0,0,0,0|3,0,0]=4 55 B10R0.19 CCCNC(=O)[C@H](C)NC=O WXVL_AK00504SB5176 [0,1,0,0,0,0|3,0,0]=4 56 B10R0.19 CCOCC(=O)N(C)CC#N WXVL_AN2942SB0091 [0,1,0,0,0,0|2,0,1]=4 57 B10R0.19 CCOCC(=O)N(C)CC#N WXVL_AN2942SB0091 [0,1,0,0,0,0|2,0,1]=4 58 B10R0.19 CCOCC(=O)N(C)CCO WXVL_AN2670SB0091 [0,1,0,0,0,0|2,0,1]=4 59 B10R0.19 CCOCC(=O)N(C)CCO WXVL_AN2670SB0091 [0,1,0,0,0,0|2,0,1]=4 60 B10R0.19 C[C@H](NC=O)C(=O)NCCF WXVL_AK00466SB5176 [0,1,0,0,0,0|3,0,0]=4 61 B10R0.19 C[C@H](NC=O)C(=O)NCCF WXVL_AK00466SB5176 [0,1,0,0,0,0|3,0,0]=4 62 B10R0.32 CC(C)NC(=O)[C@H](C)NC=O WXVL_AK0030SB5176 [0,1,0,0,0,0|3,0,0]=4 63 B10R0.32 CC(C)NC(=O)[C@H](C)NC=O WXVL_AK0030SB5176 [0,1,0,0,0,0|3,0,0]=4 64 B10R0.32 CCCC(C)C(=O)NC(C)C WXVL_AK0030SB0352 [0,1,0,0,0,0|1,0,2]=4 65 B10R0.32 CCCC(C)C(=O)NC(C)C WXVL_AK0030SB0352 [0,1,0,0,0,0|1,0,2]=4 66 B10R0.32 CCNC(=O)C(C)NC(=O)C WXVL_AK00476SB0373 [0,1,0,0,0,0|2,0,1]=4 67 B10R0.32 CCNC(=O)C(C)NC(=O)C WXVL_AK00476SB0373 [0,1,0,0,0,0|2,0,1]=4 68 B10R0.32 CCOC(=O)[C@H](C)NC(=O)C WXVL_AK1648SB0150 [0,1,0,0,0,0|1,0,1]=3 69 B10R0.32 CCOC(=O)[C@H](C)NC(=O)C WXVL_AK1648SB0150 [0,1,0,0,0,0|1,0,1]=3 70 B10R0.129 C=CCC(C)(C)C(=O)NCC WXVL_AK00476SB0363 [0,1,0,0,0,0|1,0,0]=2 71 B10R0.129 C=CCC(C)(C)C(=O)NCC WXVL_AK00476SB0363 [0,1,0,0,0,0|1,0,0]=2 72 B10R0.129 CCCC(C)(C)C(=O)NCC WXVL_AK00476SB0372 [0,1,0,0,0,0|1,0,2]=4 73 B10R0.129 CCCC(C)(C)C(=O)NCC WXVL_AK00476SB0372 [0,1,0,0,0,0|1,0,2]=4 74 B10R0.129 CCNC(=O)C(C)(C)CSC WXVL_AK00476SBF473 [0,1,0,0,0,0|2,0,1]=4 75 B10R0.129 CCNC(=O)C(C)(C)CSC WXVL_AK00476SBF473 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.11 CCNC(=O)C1CCCC1 WXVL_AK00476SB0043 [0,0,0,1,0,0|1,0,2]=4 77 B10R1.11 CCNC(=O)C1CCCC1 WXVL_AK00476SB0043 [0,0,0,1,0,0|1,0,2]=4 78 B10R1.140 C=C1CC(C1)C(=O)NCC WXVL_AK00476SB0804 [0,0,0,1,0,0|1,0,0]=2 79 B10R1.140 C=C1CC(C1)C(=O)NCC WXVL_AK00476SB0804 [0,0,0,1,0,0|1,0,0]=2 80 B10R1.140 CCNC(=O)C1CC(=O)N1 WXVL_AK00476SB3574 [0,0,0,1,0,0|3,0,0]=4 81 B10R1.140 CCNC(=O)C1CC(=O)N1 WXVL_AK00476SB3574 [0,0,0,1,0,0|3,0,0]=4 82 B10R1.140 CCNC(=O)C1CN(C1)C WXVL_AK00476SB0021 [0,0,0,1,0,0|2,0,1]=4 83 B10R1.140 CCNC(=O)C1CN(C1)C WXVL_AK00476SB0021 [0,0,0,1,0,0|2,0,1]=4 84 B10R1.140 CCNC(=O)[C@H]1C[C@@H](C1)O WXVL_AK00476SB3648 [0,0,0,1,0,0|2,0,1]=4 85 B10R1.140 CCNC(=O)[C@H]1C[C@@H](C1)O WXVL_AK00476SB3648 [0,0,0,1,0,0|2,0,1]=4 86 B10R1.140 CCNC(=O)[C@H]1C[C@H](C1)O WXVL_AK00476SB0837 [0,0,0,1,0,0|2,0,1]=4 87 B10R1.140 CCNC(=O)[C@H]1C[C@H](C1)O WXVL_AK00476SB0837 [0,0,0,1,0,0|2,0,1]=4 88 B10R1.401 CCNC(=O)C1(CCC1)C WXVL_AK00476SB0805 [0,0,0,1,0,0|1,0,2]=4 89 B10R1.401 CCNC(=O)C1(CCC1)C WXVL_AK00476SB0805 [0,0,0,1,0,0|1,0,2]=4 90 B10R1.401 CCNC(=O)C1(COC1)C WXVL_AK00476SB0214 [0,0,0,1,0,0|2,0,1]=4 91 B10R1.401 CCNC(=O)C1(COC1)C WXVL_AK00476SB0214 [0,0,0,1,0,0|2,0,1]=4 92 B10R0.2 CCCC(=O)NC(C)CCO WXVL_AK1288SB0073 [0,0,0,0,0,1|2,0,1]=4 93 B10R0.2 CCCC(=O)NC(C)CCO WXVL_AK1288SB0073 [0,0,0,0,0,1|2,0,1]=4 94 B10R0.2 CCCC(=O)N[C@@H](C)CC#N WXVL_AK00595SB0073 [0,0,0,0,0,1|2,0,1]=4 95 B10R0.2 CCCC(=O)N[C@@H](C)CC#N WXVL_AK00595SB0073 [0,0,0,0,0,1|2,0,1]=4 96 B10R0.2 CCCC(=O)N[C@@H](C)CCC WXVL_AK00682SB0073 [0,0,0,0,0,1|1,0,2]=4 97 B10R0.2 CCCC(=O)N[C@@H](C)CCC WXVL_AK00682SB0073 [0,0,0,0,0,1|1,0,2]=4 98 B10R0.2 CCCC(=O)N[C@@H](C)COC WXVL_AK0137SB0073 [0,0,0,0,0,1|2,0,1]=4 99 B10R0.2 CCCC(=O)N[C@@H](C)COC WXVL_AK0137SB0073 [0,0,0,0,0,1|2,0,1]=4 100 B10R0.2 CCCC(=O)N[C@H](C)COC WXVL_AK00613SB0073 [0,0,0,0,0,1|2,0,1]=4 101 B10R0.2 CCCC(=O)N[C@H](C)COC WXVL_AK00613SB0073 [0,0,0,0,0,1|2,0,1]=4 102 B7R0.3 C=CCCC(=O)NC WXVL_AK00442SB1035 [2,0,0,0,0,0|1,0,0]=3 103 B7R0.3 C=CCCC(=O)NC WXVL_AK00442SB1035 [2,0,0,0,0,0|1,0,0]=3 104 B7R0.3 C=CCNC(=O)CC WXVL_AK00561SB0064 [2,0,0,0,0,0|1,0,0]=3 105 B7R0.3 C=CCNC(=O)CC WXVL_AK00561SB0064 [2,0,0,0,0,0|1,0,0]=3 106 B7R0.3 C=CCNC(=O)CO WXVL_AK00561SB2706 [2,0,0,0,0,0|2,0,0]=4 107 B7R0.3 C=CCNC(=O)CO WXVL_AK00561SB2706 [2,0,0,0,0,0|2,0,0]=4 108 B7R0.7 C=CCC(=O)NCC WXVL_AK00476SB2732 [2,0,0,0,0,0|1,0,0]=3 109 B7R0.7 C=CCC(=O)NCC WXVL_AK00476SB2732 [2,0,0,0,0,0|1,0,0]=3 110 B7R0.7 CCCC(=O)NCC WXVL_AK00476SB0073 [2,0,0,0,0,0|1,0,1]=4 111 B7R0.7 CCCC(=O)NCC WXVL_AK00476SB0073 [2,0,0,0,0,0|1,0,1]=4 112 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [2,0,0,0,0,0|2,0,0]=4 113 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [2,0,0,0,0,0|2,0,0]=4 114 B7R0.5 CCNC(=O)C(C)C WXVL_AK00476SB0052 [2,0,0,0,0,0|1,0,0]=3 115 B7R0.5 CCNC(=O)C(C)C WXVL_AK00476SB0052 [2,0,0,0,0,0|1,0,0]=3 116 B7R0.5 CCNC(=O)C(C)S WXVL_AK00476SB2708 [2,0,0,0,0,0|2,0,0]=4 117 B7R0.5 CCNC(=O)C(C)S WXVL_AK00476SB2708 [2,0,0,0,0,0|2,0,0]=4 118 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [2,0,0,0,0,0|2,0,0]=4 119 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [2,0,0,0,0,0|2,0,0]=4 120 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [2,0,0,0,0,0|1,0,1]=4 121 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [2,0,0,0,0,0|1,0,1]=4 122 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [2,0,0,0,0,0|1,0,1]=4 123 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [2,0,0,0,0,0|1,0,1]=4 124 B9R0.4 C=CCCC(=O)NC(C)C WXVL_AK0030SB1035 [1,1,0,0,0,0|1,0,0]=3 125 B9R0.4 C=CCCC(=O)NC(C)C WXVL_AK0030SB1035 [1,1,0,0,0,0|1,0,0]=3 126 B9R0.4 C=CCNC(=O)CC(C)C WXVL_AK00561SB0063 [1,1,0,0,0,0|2,0,0]=4 127 B9R0.4 C=CCNC(=O)CC(C)C WXVL_AK00561SB0063 [1,1,0,0,0,0|2,0,0]=4 128 B9R0.4 C=CCNC(=O)CC(C)O WXVL_AK00561SB3643 [1,1,0,0,0,0|2,0,0]=4 129 B9R0.4 C=CCNC(=O)CC(C)O WXVL_AK00561SB3643 [1,1,0,0,0,0|2,0,0]=4 130 B9R0.5 C=CCCCC(=O)NCC WXVL_AK00476SB2920 [1,1,0,0,0,0|1,0,0]=3 131 B9R0.5 C=CCCCC(=O)NCC WXVL_AK00476SB2920 [1,1,0,0,0,0|1,0,0]=3 132 B9R0.5 C=CCCNC(=O)/C=C/C WXVL_AK00138SB0340 [1,1,0,0,0,0|1,0,1]=4 133 B9R0.5 C=CCCNC(=O)/C=C/C WXVL_AK00138SB0340 [1,1,0,0,0,0|1,0,1]=4 134 B9R0.5 C=CCCNC(=O)C#CC WXVL_AK00138SB1240 [1,1,0,0,0,0|1,0,1]=4 135 B9R0.5 C=CCCNC(=O)C#CC WXVL_AK00138SB1240 [1,1,0,0,0,0|1,0,1]=4 136 B9R0.5 C=CCCNC(=O)CCC WXVL_AK00138SB0073 [1,1,0,0,0,0|1,0,0]=3 137 B9R0.5 C=CCCNC(=O)CCC WXVL_AK00138SB0073 [1,1,0,0,0,0|1,0,0]=3 138 B9R0.5 C=CCCNC(=O)COC WXVL_AK00138SB0090 [1,1,0,0,0,0|2,0,0]=4 139 B9R0.5 C=CCCNC(=O)COC WXVL_AK00138SB0090 [1,1,0,0,0,0|2,0,0]=4 140 B9R0.5 C=CCCNC(=O)CSC WXVL_AK00138SB1267 [1,1,0,0,0,0|2,0,0]=4 141 B9R0.5 C=CCCNC(=O)CSC WXVL_AK00138SB1267 [1,1,0,0,0,0|2,0,0]=4 142 B9R0.8 C=CCNC(=O)C(=O)CC WXVL_AK00561SB0344 [1,1,0,0,0,0|2,0,0]=4 143 B9R0.8 C=CCNC(=O)C(=O)CC WXVL_AK00561SB0344 [1,1,0,0,0,0|2,0,0]=4 144 B9R0.8 C=CCNC(=O)C(C)CC WXVL_AK00561SB0054 [1,1,0,0,0,0|2,0,0]=4 145 B9R0.8 C=CCNC(=O)C(C)CC WXVL_AK00561SB0054 [1,1,0,0,0,0|2,0,0]=4 146 B9R0.8 C=CCNC(=O)[C@@H](O)CC WXVL_AK00561SB3573 [1,1,0,0,0,0|2,0,0]=4 147 B9R0.8 C=CCNC(=O)[C@@H](O)CC WXVL_AK00561SB3573 [1,1,0,0,0,0|2,0,0]=4 148 B9R0.8 C=CCNC(=O)[C@H](C)CC WXVL_AK00561SB00054 [1,1,0,0,0,0|2,0,0]=4 149 B9R0.8 C=CCNC(=O)[C@H](C)CC WXVL_AK00561SB00054 [1,1,0,0,0,0|2,0,0]=4 150 B9R0.18 C=CCCC(=O)NCC#N WXVL_AK0683SB1035 [1,1,0,0,0,0|1,0,1]=4 151 B9R0.18 C=CCCC(=O)NCC#N WXVL_AK0683SB1035 [1,1,0,0,0,0|1,0,1]=4 152 B9R0.18 C=CCCC(=O)NCC=C WXVL_AK00561SB1035 [1,1,0,0,0,0|1,0,1]=4 153 B9R0.18 C=CCCC(=O)NCC=C WXVL_AK00561SB1035 [1,1,0,0,0,0|1,0,1]=4 154 B9R0.18 C=CCCC(=O)NCCC WXVL_AK00504SB1035 [1,1,0,0,0,0|1,0,0]=3 155 B9R0.18 C=CCCC(=O)NCCC WXVL_AK00504SB1035 [1,1,0,0,0,0|1,0,0]=3 156 B9R0.18 C=CCCC(=O)NCCF WXVL_AK00466SB1035 [1,1,0,0,0,0|1,0,0]=3 157 B9R0.18 C=CCCC(=O)NCCF WXVL_AK00466SB1035 [1,1,0,0,0,0|1,0,0]=3 158 B9R0.18 C=CCNC(=O)CCOC WXVL_AK00561SB0156 [1,1,0,0,0,0|2,0,0]=4 159 B9R0.18 C=CCNC(=O)CCOC WXVL_AK00561SB0156 [1,1,0,0,0,0|2,0,0]=4 160 B9R0.18 C=CCNC(=O)CCSC WXVL_AK00561SB0361 [1,1,0,0,0,0|2,0,0]=4 161 B9R0.18 C=CCNC(=O)CCSC WXVL_AK00561SB0361 [1,1,0,0,0,0|2,0,0]=4 162 B9R0.18 C=CCNC(=O)COCC WXVL_AK00561SB0091 [1,1,0,0,0,0|1,0,0]=3 163 B9R0.18 C=CCNC(=O)COCC WXVL_AK00561SB0091 [1,1,0,0,0,0|1,0,0]=3 164 B9R0.18 C=CCNC(=O)CSCC WXVL_AK00561SB0002 [1,1,0,0,0,0|1,1,0]=4 165 B9R0.18 C=CCNC(=O)CSCC WXVL_AK00561SB0002 [1,1,0,0,0,0|1,1,0]=4 166 B9R0.18 C=CCNC(=O)NCCCl WXVL_AK00561YV0092 [1,1,0,0,0,0|2,0,0]=4 167 B9R0.18 C=CCNC(=O)NCCCl WXVL_AK00561YV0092 [1,1,0,0,0,0|2,0,0]=4 168 B9R0.34 C=CC(C)NC(=O)CCC WXVL_AK00769SB0073 [1,1,0,0,0,0|2,0,0]=4 169 B9R0.34 C=CC(C)NC(=O)CCC WXVL_AK00769SB0073 [1,1,0,0,0,0|2,0,0]=4 170 B9R0.48 C=C(C)CNC(=O)CCC WXVL_AK0761SB0073 [1,1,0,0,0,0|2,0,0]=4 171 B9R0.48 C=C(C)CNC(=O)CCC WXVL_AK0761SB0073 [1,1,0,0,0,0|2,0,0]=4 172 B9R0.48 CCNC(=O)CCC(=O)C WXVL_AK00476SB0072 [1,1,0,0,0,0|1,0,1]=4 173 B9R0.48 CCNC(=O)CCC(=O)C WXVL_AK00476SB0072 [1,1,0,0,0,0|1,0,1]=4 174 B9R0.48 CCNC(=O)CCC(=O)N WXVL_AK00476SB0358 [1,1,0,0,0,0|2,0,0]=4 175 B9R0.48 CCNC(=O)CCC(=O)N WXVL_AK00476SB0358 [1,1,0,0,0,0|2,0,0]=4 176 B9R0.19 CCNC(=O)C(C)(C)CC WXVL_AK00476SB0355 [1,1,0,0,0,0|1,0,1]=4 177 B9R0.19 CCNC(=O)C(C)(C)CC WXVL_AK00476SB0355 [1,1,0,0,0,0|1,0,1]=4 178 B9R0.19 CCNC(=O)C(C)(C)CCl WXVL_AK00476SB3392 [1,1,0,0,0,0|2,0,0]=4 179 B9R0.19 CCNC(=O)C(C)(C)CCl WXVL_AK00476SB3392 [1,1,0,0,0,0|2,0,0]=4 180 B9R0.19 CCNC(=O)C(C)(O)CC WXVL_AK00476SB3009 [1,1,0,0,0,0|1,0,1]=4 181 B9R0.19 CCNC(=O)C(C)(O)CC WXVL_AK00476SB3009 [1,1,0,0,0,0|1,0,1]=4 182 B9R0.23 CCC(C)C(=O)NC(C)C WXVL_AK0030SB0054 [1,1,0,0,0,0|1,0,1]=4 183 B9R0.23 CCC(C)C(=O)NC(C)C WXVL_AK0030SB0054 [1,1,0,0,0,0|1,0,1]=4 184 B9R0.23 CC[C@@H](C)C(=O)NC(C)C WXVL_AK0030SB00054 [1,1,0,0,0,0|1,0,1]=4 185 B9R0.23 CC[C@@H](C)C(=O)NC(C)C WXVL_AK0030SB00054 [1,1,0,0,0,0|1,0,1]=4 186 B9R0.37 CCNC(=O)C(CC)CC WXVL_AK00476SB0055 [1,1,0,0,0,0|1,0,1]=4 187 B9R0.37 CCNC(=O)C(CC)CC WXVL_AK00476SB0055 [1,1,0,0,0,0|1,0,1]=4 188 B9R0.60 C=CCC(C)(C)C(=O)NC WXVL_AK00442SB0363 [1,1,0,0,0,0|1,0,0]=3 189 B9R0.60 C=CCC(C)(C)C(=O)NC WXVL_AK00442SB0363 [1,1,0,0,0,0|1,0,0]=3 190 B11R0.5 C=CCNC(=O)CC(=O)OCC WXVL_AK00561SB3094 [0,1,0,0,0,1|1,0,1]=4 191 B11R0.5 C=CCNC(=O)CC(=O)OCC WXVL_AK00561SB3094 [0,1,0,0,0,1|1,0,1]=4 192 B11R0.5 CCC[C@H](C)NC(=O)COCC WXVL_AK00682SB0091 [0,1,0,0,0,1|0,0,2]=4 193 B11R0.5 CCC[C@H](C)NC(=O)COCC WXVL_AK00682SB0091 [0,1,0,0,0,1|0,0,2]=4 194 B11R0.5 CCOCC(=O)NC(C)CCO WXVL_AK1288SB0091 [0,1,0,0,0,1|1,0,1]=4 195 B11R0.5 CCOCC(=O)NC(C)CCO WXVL_AK1288SB0091 [0,1,0,0,0,1|1,0,1]=4 196 B11R0.5 CCOCC(=O)N[C@@H](C)CC#N WXVL_AK00595SB0091 [0,1,0,0,0,1|1,0,1]=4 197 B11R0.5 CCOCC(=O)N[C@@H](C)CC#N WXVL_AK00595SB0091 [0,1,0,0,0,1|1,0,1]=4 198 B11R0.5 CCOCC(=O)N[C@@H](C)COC WXVL_AK0137SB0091 [0,1,0,0,0,1|1,0,1]=4 199 B11R0.5 CCOCC(=O)N[C@@H](C)COC WXVL_AK0137SB0091 [0,1,0,0,0,1|1,0,1]=4 200 B11R0.5 CCOCC(=O)N[C@H](C)COC WXVL_AK00613SB0091 [0,1,0,0,0,1|1,0,1]=4 201 B11R0.5 CCOCC(=O)N[C@H](C)COC WXVL_AK00613SB0091 [0,1,0,0,0,1|1,0,1]=4 202 B11R0.182 C=CCC(CO)NC(=O)/C=C/C WXVL_AK00621SB0340 [0,1,0,0,0,1|1,0,1]=4 203 B11R0.182 C=CCC(CO)NC(=O)/C=C/C WXVL_AK00621SB0340 [0,1,0,0,0,1|1,0,1]=4 204 B11R0.182 C=CCC(CO)NC(=O)C#CC WXVL_AK00621SB1240 [0,1,0,0,0,1|1,0,1]=4 205 B11R0.182 C=CCC(CO)NC(=O)C#CC WXVL_AK00621SB1240 [0,1,0,0,0,1|1,0,1]=4 206 B11R0.182 C=CCC(CO)NC(=O)CCC WXVL_AK00621SB0073 [0,1,0,0,0,1|1,0,0]=3 207 B11R0.182 C=CCC(CO)NC(=O)CCC WXVL_AK00621SB0073 [0,1,0,0,0,1|1,0,0]=3 208 B11R0.182 C=CCC(CO)NC(=O)COC WXVL_AK00621SB0090 [0,1,0,0,0,1|2,0,0]=4 209 B11R0.182 C=CCC(CO)NC(=O)COC WXVL_AK00621SB0090 [0,1,0,0,0,1|2,0,0]=4 210 B11R0.182 C=CCC(CO)NC(=O)CSC WXVL_AK00621SB1267 [0,1,0,0,0,1|2,0,0]=4 211 B11R0.182 C=CCC(CO)NC(=O)CSC WXVL_AK00621SB1267 [0,1,0,0,0,1|2,0,0]=4 212 B11R0.11 C=CCNC(=O)C(C)OCC=C WXVL_AK00561SBD933 [0,2,0,0,0,0|1,0,1]=4 213 B11R0.11 C=CCNC(=O)C(C)OCC=C WXVL_AK00561SBD933 [0,2,0,0,0,0|1,0,1]=4 214 B11R0.11 C=CCOC(C)C(=O)NCC#N WXVL_AK0683SBD933 [0,2,0,0,0,0|1,0,1]=4 215 B11R0.11 C=CCOC(C)C(=O)NCC#N WXVL_AK0683SBD933 [0,2,0,0,0,0|1,0,1]=4 216 B11R0.11 C=CCOC(C)C(=O)NCCC WXVL_AK00504SBD933 [0,2,0,0,0,0|1,0,0]=3 217 B11R0.11 C=CCOC(C)C(=O)NCCC WXVL_AK00504SBD933 [0,2,0,0,0,0|1,0,0]=3 218 B11R0.11 C=CCOC(C)C(=O)NCCF WXVL_AK00466SBD933 [0,2,0,0,0,0|1,0,0]=3 219 B11R0.11 C=CCOC(C)C(=O)NCCF WXVL_AK00466SBD933 [0,2,0,0,0,0|1,0,0]=3 220 B11R0.12 C=CCC(C)(C)C(=O)NCC#N WXVL_AK0683SB0363 [0,2,0,0,0,0|1,0,1]=4 221 B11R0.12 C=CCC(C)(C)C(=O)NCC#N WXVL_AK0683SB0363 [0,2,0,0,0,0|1,0,1]=4 222 B11R0.12 C=CCC(C)(C)C(=O)NCCC WXVL_AK00504SB0363 [0,2,0,0,0,0|1,0,0]=3 223 B11R0.12 C=CCC(C)(C)C(=O)NCCC WXVL_AK00504SB0363 [0,2,0,0,0,0|1,0,0]=3 224 B11R0.12 C=CCC(C)(C)C(=O)NCCF WXVL_AK00466SB0363 [0,2,0,0,0,0|1,0,0]=3 225 B11R0.12 C=CCC(C)(C)C(=O)NCCF WXVL_AK00466SB0363 [0,2,0,0,0,0|1,0,0]=3 226 B11R0.12 C=CCNC(=O)C(C)(C)CC=C WXVL_AK00561SB0363 [0,2,0,0,0,0|1,0,1]=4 227 B11R0.12 C=CCNC(=O)C(C)(C)CC=C WXVL_AK00561SB0363 [0,2,0,0,0,0|1,0,1]=4 228 B11R0.43 C#CC(=O)N[C@@H](C)C(=O)OCC WXVL_AK1648SB0338 [0,2,0,0,0,0|1,0,1]=4 229 B11R0.43 C#CC(=O)N[C@@H](C)C(=O)OCC WXVL_AK1648SB0338 [0,2,0,0,0,0|1,0,1]=4 230 B11R0.43 C=CC(C)NC(=O)C(=O)OCC WXVL_AK00769SB4144 [0,2,0,0,0,0|1,0,1]=4 231 B11R0.43 C=CC(C)NC(=O)C(=O)OCC WXVL_AK00769SB4144 [0,2,0,0,0,0|1,0,1]=4 232 B11R0.43 CCOC(=O)[C@H](C)NC(=O)CC WXVL_AK1648SB0064 [0,2,0,0,0,0|1,0,1]=4 233 B11R0.43 CCOC(=O)[C@H](C)NC(=O)CC WXVL_AK1648SB0064 [0,2,0,0,0,0|1,0,1]=4 234 B11R0.43 CCOC(=O)[C@H](C)NC(=O)CO WXVL_AK1648SB2706 [0,2,0,0,0,0|1,0,1]=4 235 B11R0.43 CCOC(=O)[C@H](C)NC(=O)CO WXVL_AK1648SB2706 [0,2,0,0,0,0|1,0,1]=4 236 B11R0.59 C=C(C)CNC(=O)C(=O)OCC WXVL_AK0761SB4144 [0,2,0,0,0,0|1,0,1]=4 237 B11R0.59 C=C(C)CNC(=O)C(=O)OCC WXVL_AK0761SB4144 [0,2,0,0,0,0|1,0,1]=4 238 B11R0.68 C=CCOC(C)C(=O)NC(C)C WXVL_AK0030SBD933 [0,2,0,0,0,0|1,0,0]=3 239 B11R0.68 C=CCOC(C)C(=O)NC(C)C WXVL_AK0030SBD933 [0,2,0,0,0,0|1,0,0]=3 240 B11R0.155 C=CCCNC(=O)C(=O)OCC WXVL_AK00138SB4144 [0,2,0,0,0,0|1,0,1]=4 241 B11R0.155 C=CCCNC(=O)C(=O)OCC WXVL_AK00138SB4144 [0,2,0,0,0,0|1,0,1]=4 242 B11R0.56 CCOC(=O)[C@H](CO)NC(=O)C WXVL_AK0757SB0150 [0,2,0,0,0,0|1,0,1]=4 243 B11R0.56 CCOC(=O)[C@H](CO)NC(=O)C WXVL_AK0757SB0150 [0,2,0,0,0,0|1,0,1]=4 244 B11R0.99 C=CCC(C)(C)C(=O)NC(C)C WXVL_AK0030SB0363 [0,2,0,0,0,0|1,0,0]=3 245 B11R0.99 C=CCC(C)(C)C(=O)NC(C)C WXVL_AK0030SB0363 [0,2,0,0,0,0|1,0,0]=3 246 B11R0.149 CC(=O)N[C@@H](C)C(=O)OC(C)C WXVL_AK0771SB0150 [0,2,0,0,0,0|1,0,1]=4 247 B11R0.149 CC(=O)N[C@@H](C)C(=O)OC(C)C WXVL_AK0771SB0150 [0,2,0,0,0,0|1,0,1]=4 248 B11R0.61 C=CCN(CC=C)C(=O)CCC WXVL_AN00537SB0073 [0,2,0,0,0,0|2,0,0]=4 249 B9R1.100 C=CCNC(=O)C1CC1 WXVL_AK00561SB0038 [1,0,0,1,0,0|2,0,0]=4 250 B9R1.100 C=CCNC(=O)C1CC1 WXVL_AK00561SB0038 [1,0,0,1,0,0|2,0,0]=4 251 B9R1.74 CCNC(=O)C1(CC1)C WXVL_AK00476SB0040 [1,0,0,1,0,0|1,0,1]=4 252 B9R1.74 CCNC(=O)C1(CC1)C WXVL_AK00476SB0040 [1,0,0,1,0,0|1,0,1]=4 253 B9R1.82 C=C1CC(C1)C(=O)NC WXVL_AK00442SB0804 [1,0,0,1,0,0|1,0,0]=3 254 B9R1.82 C=C1CC(C1)C(=O)NC WXVL_AK00442SB0804 [1,0,0,1,0,0|1,0,0]=3 255 B11R1.15 CCNC(=O)C1CNC(=O)C1 WXVL_AK00476SB0366 [0,1,0,1,0,0|2,0,0]=4 256 B11R1.15 CCNC(=O)C1CNC(=O)C1 WXVL_AK00476SB0366 [0,1,0,1,0,0|2,0,0]=4 257 B11R1.16 CCNC(=O)C1CC=CCC1 WXVL_AK00476SB3640 [0,1,0,1,0,0|1,0,0]=3 258 B11R1.16 CCNC(=O)C1CC=CCC1 WXVL_AK00476SB3640 [0,1,0,1,0,0|1,0,0]=3 259 B11R1.287 C=C1CC(C1)C(=O)NCC#N WXVL_AK0683SB0804 [0,1,0,1,0,0|1,0,1]=4 260 B11R1.287 C=C1CC(C1)C(=O)NCC#N WXVL_AK0683SB0804 [0,1,0,1,0,0|1,0,1]=4 261 B11R1.287 C=C1CC(C1)C(=O)NCCC WXVL_AK00504SB0804 [0,1,0,1,0,0|1,0,0]=3 262 B11R1.287 C=C1CC(C1)C(=O)NCCC WXVL_AK00504SB0804 [0,1,0,1,0,0|1,0,0]=3 263 B11R1.287 C=C1CC(C1)C(=O)NCCF WXVL_AK00466SB0804 [0,1,0,1,0,0|1,0,0]=3 264 B11R1.287 C=C1CC(C1)C(=O)NCCF WXVL_AK00466SB0804 [0,1,0,1,0,0|1,0,0]=3 265 B11R1.287 C=CCNC(=O)C1CC(=C)C1 WXVL_AK00561SB0804 [0,1,0,1,0,0|1,0,1]=4 266 B11R1.287 C=CCNC(=O)C1CC(=C)C1 WXVL_AK00561SB0804 [0,1,0,1,0,0|1,0,1]=4 267 B11R1.152 C=C1CC(C1)C(=O)NC(C)C WXVL_AK0030SB0804 [0,1,0,1,0,0|1,0,0]=3 268 B11R1.152 C=C1CC(C1)C(=O)NC(C)C WXVL_AK0030SB0804 [0,1,0,1,0,0|1,0,0]=3