0 B11R1.20 CC(=O)NC1CCN(CC1)C WXVL_AK0287SB0150 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.20 CC(=O)NC1CCN(CC1)C WXVL_AK0287SB0150 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.20 CN1CCC(CC1)CC(=O)N WXVL_AK0084SB0212 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.20 CN1CCC(CC1)CC(=O)N WXVL_AK0084SB0212 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.18 CC(=O)NC1CCCCC1 WXVL_AK00480SB0150 [1,0,0,0,0,0|0,0,1]=2 5 B10R1.18 CC(=O)NC1CCCCC1 WXVL_AK00480SB0150 [1,0,0,0,0,0|0,0,1]=2 6 B10R1.18 CC(=O)NC1CCCOC1 WXVL_AK1073SB0150 [1,0,0,0,0,0|1,0,1]=3 7 B10R1.18 CC(=O)NC1CCCOC1 WXVL_AK1073SB0150 [1,0,0,0,0,0|1,0,1]=3 8 B10R1.18 NC(=O)CC1CCOCC1 WXVL_AK0084SB0194 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.18 NC(=O)CC1CCOCC1 WXVL_AK0084SB0194 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.4 CC(=O)NC1CCC(CC1)C#N WXVL_AK00177SB0150 [0,1,0,0,0,0|1,0,1]=3 11 B12R1.4 CC(=O)NC1CCC(CC1)C#N WXVL_AK00177SB0150 [0,1,0,0,0,0|1,0,1]=3 12 B12R1.4 CCC1CCC(CC1)NC(=O)C WXVL_AK1084SB0150 [0,1,0,0,0,0|1,0,1]=3 13 B12R1.4 CCC1CCC(CC1)NC(=O)C WXVL_AK1084SB0150 [0,1,0,0,0,0|1,0,1]=3 14 B12R1.20 C=C1CCN(CC1)C(=O)C(=O)C WXVL_AN00121SB0051 [0,1,0,0,0,0|3,0,0]=4 15 B12R1.20 C=C1CCN(CC1)C(=O)C(=O)C WXVL_AN00121SB0051 [0,1,0,0,0,0|3,0,0]=4 16 B12R1.20 CC(=O)C(=O)N1CCS(=O)CC1 WXVL_AN00655SB0051 [0,1,0,0,0,0|3,0,0]=4 17 B12R1.49 C#CC(=O)NC1CCN(CC1)C WXVL_AK0287SB0338 [0,1,0,0,0,0|2,0,1]=4 18 B12R1.49 C#CC(=O)NC1CCN(CC1)C WXVL_AK0287SB0338 [0,1,0,0,0,0|2,0,1]=4 19 B12R1.49 CCC(=O)NC1CCN(CC1)C WXVL_AK0287SB0064 [0,1,0,0,0,0|2,0,0]=3 20 B12R1.49 CCC(=O)NC1CCN(CC1)C WXVL_AK0287SB0064 [0,1,0,0,0,0|2,0,0]=3 21 B12R1.49 CN1CCC(CC1)NC(=O)CO WXVL_AK0287SB2706 [0,1,0,0,0,0|2,0,0]=3 22 B12R1.49 CN1CCC(CC1)NC(=O)CO WXVL_AK0287SB2706 [0,1,0,0,0,0|2,0,0]=3 23 B12R1.49 CNC(=O)CC1CCN(CC1)C WXVL_AK00442SB0212 [0,1,0,0,0,0|3,0,0]=4 24 B12R1.49 CNC(=O)CC1CCN(CC1)C WXVL_AK00442SB0212 [0,1,0,0,0,0|3,0,0]=4 25 B12R1.49 CNC(=O)N[C@H]1CC[C@@H](CC1)C WXVL_AK00442YV0200 [0,1,0,0,0,0|1,0,1]=3 26 B12R1.49 CNC(=O)N[C@H]1CC[C@@H](CC1)C WXVL_AK00442YV0200 [0,1,0,0,0,0|1,0,1]=3 27 B12R1.233 CC(=O)NC1CCC(=O)NC1=O WXVL_AK1450SB0150 [0,1,0,0,0,0|1,0,1]=3 28 B12R1.233 CC(=O)NC1CCC(=O)NC1=O WXVL_AK1450SB0150 [0,1,0,0,0,0|1,0,1]=3 29 B10R0.55 C#CC(=O)NCCNC(=O)C WXVL_AK0057SB0338 [0,0,1,0,0,0|1,0,2]=4 30 B10R0.55 C#CC(=O)NCCNC(=O)C WXVL_AK0057SB0338 [0,0,1,0,0,0|1,0,2]=4 31 B10R0.55 CC(=O)NCCNC(=O)CO WXVL_AK0057SB2706 [0,0,1,0,0,0|2,0,0]=3 32 B10R0.55 CC(=O)NCCNC(=O)CO WXVL_AK0057SB2706 [0,0,1,0,0,0|2,0,0]=3 33 B10R0.55 CCC(=O)NCCNC(=O)C WXVL_AK0057SB0064 [0,0,1,0,0,0|1,0,0]=2 34 B10R0.55 CCC(=O)NCCNC(=O)C WXVL_AK0057SB0064 [0,0,1,0,0,0|1,0,0]=2 35 B10R0.55 COC(=O)CCCCC(=O)N WXVL_AK0084SB1209 [0,0,1,0,0,0|3,0,0]=4 36 B10R0.55 COC(=O)CCCCC(=O)N WXVL_AK0084SB1209 [0,0,1,0,0,0|3,0,0]=4 37 B10R0.55 COC(=O)CCCNC(=O)C WXVL_AK00444SB0150 [0,0,1,0,0,0|1,0,0]=2 38 B10R0.55 COC(=O)CCCNC(=O)C WXVL_AK00444SB0150 [0,0,1,0,0,0|1,0,0]=2 39 B10R0.87 CCCC[C@H](CO)NC(=O)C WXVL_AK00635SB0150 [0,0,1,0,0,0|2,0,1]=4 40 B10R0.87 CCCC[C@H](CO)NC(=O)C WXVL_AK00635SB0150 [0,0,1,0,0,0|2,0,1]=4 41 B10R0.87 CSCC[C@@H](CO)NC(=O)C WXVL_AK1021SB0150 [0,0,1,0,0,0|3,0,0]=4 42 B10R0.87 CSCC[C@@H](CO)NC(=O)C WXVL_AK1021SB0150 [0,0,1,0,0,0|3,0,0]=4 43 B12R2.1392 CC(=O)N1CC2CCC1CC2 WXVL_AN3285SB0150 [0,0,0,1,0,0|1,0,1]=3 44 B12R2.1392 CC(=O)N1CC2CCC1CC2 WXVL_AN3285SB0150 [0,0,0,1,0,0|1,0,1]=3 45 B12R2.1392 CC(=O)N1CC2CCC1CO2 WXVL_AN00597SB0150 [0,0,0,1,0,0|2,0,1]=4 46 B10R1.13 C=C1CCC(CC1)C(=O)N WXVL_AK0084SB2180 [0,0,0,0,1,0|2,0,0]=3 47 B10R1.13 C=C1CCC(CC1)C(=O)N WXVL_AK0084SB2180 [0,0,0,0,1,0|2,0,0]=3 48 B10R1.13 C=C1CCN(CC1)C(=O)C WXVL_AN00121SB0150 [0,0,0,0,1,0|2,0,0]=3 49 B10R1.13 C=C1CCN(CC1)C(=O)C WXVL_AN00121SB0150 [0,0,0,0,1,0|2,0,0]=3 50 B10R1.13 CC(=O)N1CCC(CC1)Br WXVL_AN00579SB0150 [0,0,0,0,1,0|2,0,1]=4 51 B10R1.13 CC(=O)N1CCC(CC1)C WXVL_AN0025SB0150 [0,0,0,0,1,0|2,0,1]=4 52 B10R1.13 CC(=O)N1CCC(CC1)C WXVL_AN0025SB0150 [0,0,0,0,1,0|2,0,1]=4 53 B10R1.13 CC(=O)N1CCC(CC1)F WXVL_AN0279SB0150 [0,0,0,0,1,0|2,0,1]=4 54 B10R1.13 CC(=O)N1CCC(CC1)O WXVL_AN0023SB0150 [0,0,0,0,1,0|1,0,2]=4 55 B10R1.13 CC(=O)N1CCC(CC1)O WXVL_AN0023SB0150 [0,0,0,0,1,0|1,0,2]=4 56 B10R1.13 CC(=O)N1CCN(CC1)C WXVL_AN00865SB0150 [0,0,0,0,1,0|3,0,0]=4 57 B10R1.13 CC(=O)N1CCS(=O)CC1 WXVL_AN00655SB0150 [0,0,0,0,1,0|2,0,0]=3 58 B10R1.13 CC1=CCC(CC1)C(=O)N WXVL_AK0084SB0831 [0,0,0,0,1,0|2,0,1]=4 59 B10R1.13 CC1=CCC(CC1)C(=O)N WXVL_AK0084SB0831 [0,0,0,0,1,0|2,0,1]=4 60 B10R1.13 CN1CCC(CC1)C(=O)N WXVL_AK0084SB00008 [0,0,0,0,1,0|3,0,0]=4 61 B10R1.13 CN1CCC(CC1)C(=O)N WXVL_AK0084SB00008 [0,0,0,0,1,0|3,0,0]=4 62 B10R1.13 NC(=O)C1CCC(=O)NC1 WXVL_AK0084SB0208 [0,0,0,0,1,0|2,0,0]=3 63 B10R1.13 NC(=O)C1CCC(=O)NC1 WXVL_AK0084SB0208 [0,0,0,0,1,0|2,0,0]=3 64 B10R1.13 NC(=O)C1CCC(CC1)O WXVL_AK0084SB3089 [0,0,0,0,1,0|1,0,2]=4 65 B10R1.13 NC(=O)C1CCC(CC1)O WXVL_AK0084SB3089 [0,0,0,0,1,0|1,0,2]=4 66 B10R1.54 CC(=O)NC1CNC(=O)C1 WXVL_AK3081SB0150 [0,0,0,0,1,0|1,0,0]=2 67 B10R1.54 CC(=O)NC1CNC(=O)C1 WXVL_AK3081SB0150 [0,0,0,0,1,0|1,0,0]=2 68 B10R1.54 CC(=O)N[C@@H]1COC(=O)C1 WXVL_AK00458SB0150 [0,0,0,0,1,0|1,0,0]=2 69 B10R1.54 CC(=O)N[C@@H]1COC(=O)C1 WXVL_AK00458SB0150 [0,0,0,0,1,0|1,0,0]=2 70 B12R1.21 CC(=O)NCC1CCC(=O)NC1 WXVL_AK2042SB0150 [0,0,0,0,0,1|1,0,0]=2 71 B12R1.21 CC(=O)NCC1CCC(=O)NC1 WXVL_AK2042SB0150 [0,0,0,0,0,1|1,0,0]=2 72 B12R1.21 CC(=O)NCC1CCN(CC1)C WXVL_AK0402SB0150 [0,0,0,0,0,1|2,0,0]=3 73 B12R1.21 CC(=O)NCC1CCN(CC1)C WXVL_AK0402SB0150 [0,0,0,0,0,1|2,0,0]=3 74 B12R1.21 CC(=O)NCC1CNC(=O)CO1 WXVL_AK2622SB0150 [0,0,0,0,0,1|2,0,0]=3 75 B12R1.21 CC(=O)NCC1CNC(=O)CO1 WXVL_AK2622SB0150 [0,0,0,0,0,1|2,0,0]=3 76 B12R1.21 CC(=O)NC[C@H]1CC[C@@H](CC1)O WXVL_AK5708SB0150 [0,0,0,0,0,1|0,0,2]=3 77 B12R1.21 CC(=O)NC[C@H]1CC[C@@H](CC1)O WXVL_AK5708SB0150 [0,0,0,0,0,1|0,0,2]=3 78 B9R0.2 CC(=O)NCCCCCO WXVL_AK0077SB0150 [1,0,1,0,0,0|1,0,1]=4 79 B9R0.2 CC(=O)NCCCCCO WXVL_AK0077SB0150 [1,0,1,0,0,0|1,0,1]=4 80 B9R0.2 CCCCCCNC(=O)C WXVL_AK0286SB0150 [1,0,1,0,0,0|0,0,1]=3 81 B9R0.2 CCCCCCNC(=O)C WXVL_AK0286SB0150 [1,0,1,0,0,0|0,0,1]=3 82 B9R0.2 CCOCCCNC(=O)C WXVL_AK0072SB0150 [1,0,1,0,0,0|1,0,0]=3 83 B9R0.2 CCOCCCNC(=O)C WXVL_AK0072SB0150 [1,0,1,0,0,0|1,0,0]=3 84 B9R0.55 CC(=O)NCCNC(=O)C WXVL_AK0057SB0150 [1,0,1,0,0,0|1,0,0]=3 85 B9R0.55 CC(=O)NCCNC(=O)C WXVL_AK0057SB0150 [1,0,1,0,0,0|1,0,0]=3 86 B9R0.14 C=CCC(CO)NC(=O)C WXVL_AK00621SB0150 [1,0,1,0,0,0|1,0,1]=4 87 B9R0.14 C=CCC(CO)NC(=O)C WXVL_AK00621SB0150 [1,0,1,0,0,0|1,0,1]=4 88 B9R0.14 CCC[C@@H](CO)NC(=O)C WXVL_AK2551SB0150 [1,0,1,0,0,0|1,0,1]=4 89 B9R0.14 CCC[C@@H](CO)NC(=O)C WXVL_AK2551SB0150 [1,0,1,0,0,0|1,0,1]=4 90 B11R0.29 CC(=O)NCCNC(=O)C(=O)C WXVL_AK0057SB0051 [0,1,1,0,0,0|1,0,1]=4 91 B11R0.29 CC(=O)NCCNC(=O)C(=O)C WXVL_AK0057SB0051 [0,1,1,0,0,0|1,0,1]=4 92 B11R0.29 CC(=O)NCCNC(=O)C(C)C WXVL_AK0057SB0052 [0,1,1,0,0,0|1,0,0]=3 93 B11R0.29 CC(=O)NCCNC(=O)C(C)C WXVL_AK0057SB0052 [0,1,1,0,0,0|1,0,0]=3 94 B11R0.29 CC(=O)NCCNC(=O)C(C)S WXVL_AK0057SB2708 [0,1,1,0,0,0|1,0,0]=3 95 B11R0.29 CC(=O)NCCNC(=O)C(C)S WXVL_AK0057SB2708 [0,1,1,0,0,0|1,0,0]=3 96 B11R0.29 CC(=O)NCCNC(=O)C(F)F WXVL_AK0057SB0079 [0,1,1,0,0,0|2,0,0]=4 97 B11R0.29 CC(=O)NCCNC(=O)C(F)F WXVL_AK0057SB0079 [0,1,1,0,0,0|2,0,0]=4 98 B11R0.29 CC(=O)NCCNC(=O)[C@@H](C)O WXVL_AK0057SB1085 [0,1,1,0,0,0|1,0,0]=3 99 B11R0.29 CC(=O)NCCNC(=O)[C@@H](C)O WXVL_AK0057SB1085 [0,1,1,0,0,0|1,0,0]=3 100 B11R0.106 C#CC(=O)NCCCC(=O)OC WXVL_AK00444SB0338 [0,1,1,0,0,0|1,0,1]=4 101 B11R0.106 C#CC(=O)NCCCC(=O)OC WXVL_AK00444SB0338 [0,1,1,0,0,0|1,0,1]=4 102 B11R0.106 CCC(=O)NCCCC(=O)OC WXVL_AK00444SB0064 [0,1,1,0,0,0|1,0,0]=3 103 B11R0.106 CCC(=O)NCCCC(=O)OC WXVL_AK00444SB0064 [0,1,1,0,0,0|1,0,0]=3 104 B11R0.106 CNC(=O)CCCCC(=O)OC WXVL_AK00442SB1209 [0,1,1,0,0,0|2,0,0]=4 105 B11R0.106 CNC(=O)CCCCC(=O)OC WXVL_AK00442SB1209 [0,1,1,0,0,0|2,0,0]=4 106 B11R0.106 COC(=O)CCCNC(=O)CO WXVL_AK00444SB2706 [0,1,1,0,0,0|1,0,0]=3 107 B11R0.106 COC(=O)CCCNC(=O)CO WXVL_AK00444SB2706 [0,1,1,0,0,0|1,0,0]=3 108 B11R0.114 CCC(=O)NCCNS(=O)(=O)C WXVL_AK00064SB0064 [0,1,1,0,0,0|2,0,0]=4 109 B11R0.114 CCC(=O)NCCNS(=O)(=O)C WXVL_AK00064SB0064 [0,1,1,0,0,0|2,0,0]=4 110 B11R0.127 CCS(=O)(=O)NCCNC(=O)C WXVL_AK0057HU0028 [0,1,1,0,0,0|2,0,0]=4 111 B11R0.127 CCS(=O)(=O)NCCNC(=O)C WXVL_AK0057HU0028 [0,1,1,0,0,0|2,0,0]=4 112 B11R0.176 C#CCC(=O)NCCNC(=O)C WXVL_AK0057SB3070 [0,1,1,0,0,0|1,0,1]=4 113 B11R0.176 C#CCC(=O)NCCNC(=O)C WXVL_AK0057SB3070 [0,1,1,0,0,0|1,0,1]=4 114 B11R0.176 C/C=C/C(=O)NCCNC(=O)C WXVL_AK0057SB0340 [0,1,1,0,0,0|1,0,1]=4 115 B11R0.176 C/C=C/C(=O)NCCNC(=O)C WXVL_AK0057SB0340 [0,1,1,0,0,0|1,0,1]=4 116 B11R0.176 C=CCC(=O)NCCNC(=O)C WXVL_AK0057SB2732 [0,1,1,0,0,0|1,0,1]=4 117 B11R0.176 C=CCC(=O)NCCNC(=O)C WXVL_AK0057SB2732 [0,1,1,0,0,0|1,0,1]=4 118 B11R0.176 CC#CC(=O)NCCNC(=O)C WXVL_AK0057SB1240 [0,1,1,0,0,0|1,0,1]=4 119 B11R0.176 CC#CC(=O)NCCNC(=O)C WXVL_AK0057SB1240 [0,1,1,0,0,0|1,0,1]=4 120 B11R0.176 CC(=O)NCCNC(=O)CC#N WXVL_AK0057SB0057 [0,1,1,0,0,0|1,0,1]=4 121 B11R0.176 CC(=O)NCCNC(=O)CC#N WXVL_AK0057SB0057 [0,1,1,0,0,0|1,0,1]=4 122 B11R0.176 CCCC(=O)NCCNC(=O)C WXVL_AK0057SB0073 [0,1,1,0,0,0|1,0,0]=3 123 B11R0.176 CCCC(=O)NCCNC(=O)C WXVL_AK0057SB0073 [0,1,1,0,0,0|1,0,0]=3 124 B11R0.176 COCC(=O)NCCNC(=O)C WXVL_AK0057SB0090 [0,1,1,0,0,0|1,0,0]=3 125 B11R0.176 COCC(=O)NCCNC(=O)C WXVL_AK0057SB0090 [0,1,1,0,0,0|1,0,0]=3 126 B11R0.176 CSCC(=O)NCCNC(=O)C WXVL_AK0057SB1267 [0,1,1,0,0,0|1,0,0]=3 127 B11R0.176 CSCC(=O)NCCNC(=O)C WXVL_AK0057SB1267 [0,1,1,0,0,0|1,0,0]=3 128 B11R1.40 C#CC(=O)NC1CCCCC1 WXVL_AK00480SB0338 [1,1,0,0,0,0|0,0,2]=4 129 B11R1.40 C#CC(=O)NC1CCCCC1 WXVL_AK00480SB0338 [1,1,0,0,0,0|0,0,2]=4 130 B11R1.40 CCC(=O)NC1CCCCC1 WXVL_AK00480SB0064 [1,1,0,0,0,0|0,0,1]=3 131 B11R1.40 CCC(=O)NC1CCCCC1 WXVL_AK00480SB0064 [1,1,0,0,0,0|0,0,1]=3 132 B11R1.40 CCC(=O)NC1CCCOC1 WXVL_AK1073SB0064 [1,1,0,0,0,0|1,0,1]=4 133 B11R1.40 CCC(=O)NC1CCCOC1 WXVL_AK1073SB0064 [1,1,0,0,0,0|1,0,1]=4 134 B11R1.40 CNC(=O)CC1CCOCC1 WXVL_AK00442SB0194 [1,1,0,0,0,0|2,0,0]=4 135 B11R1.40 CNC(=O)CC1CCOCC1 WXVL_AK00442SB0194 [1,1,0,0,0,0|2,0,0]=4 136 B11R1.40 O=C(CO)NC1CCCCC1 WXVL_AK00480SB2706 [1,1,0,0,0,0|0,0,1]=3 137 B11R1.40 O=C(CO)NC1CCCCC1 WXVL_AK00480SB2706 [1,1,0,0,0,0|0,0,1]=3 138 B11R1.40 O=C(CO)NC1CCCOC1 WXVL_AK1073SB2706 [1,1,0,0,0,0|1,0,1]=4 139 B11R1.40 O=C(CO)NC1CCCOC1 WXVL_AK1073SB2706 [1,1,0,0,0,0|1,0,1]=4 140 B11R1.157 CC(=O)N[C@H]1CCCN(C1)C WXVL_AK2061SB0150 [1,1,0,0,0,0|1,0,1]=4 141 B11R1.157 CC(=O)N[C@H]1CCCN(C1)C WXVL_AK2061SB0150 [1,1,0,0,0,0|1,0,1]=4 142 B11R1.157 CC(=O)N[C@H]1CCC[C@H](C1)O WXVL_AK2614SB0150 [1,1,0,0,0,0|0,0,1]=3 143 B11R1.157 CC(=O)N[C@H]1CCC[C@H](C1)O WXVL_AK2614SB0150 [1,1,0,0,0,0|0,0,1]=3 144 B11R1.928 CC(=O)NC1(CCCCC1)C WXVL_AK0295SB0150 [1,1,0,0,0,0|0,0,1]=3 145 B11R1.928 CC(=O)NC1(CCCCC1)C WXVL_AK0295SB0150 [1,1,0,0,0,0|0,0,1]=3 146 B11R1.3 CC(=O)N1CCN(CC1)C=O WXVL_AN3592SB0150 [0,1,0,0,1,0|2,0,0]=4 147 B11R1.19 NS(=O)(=O)C1CCC(=O)CC1 WXVL_AK0084HU0442 [0,1,0,0,1,0|2,0,0]=4 148 B11R1.19 NS(=O)(=O)C1CCC(=O)CC1 WXVL_AK0084HU0442 [0,1,0,0,1,0|2,0,0]=4 149 B11R1.21 CC(=O)N1CCC(=O)C(C1)C WXVL_AN0338SB0150 [0,1,0,0,1,0|1,0,0]=3 150 B11R1.727 CC(=O)N1CCS(=O)(=O)CC1 WXVL_AN00044SB0150 [0,1,0,0,1,0|2,0,0]=4 151 B11R1.727 CC(=O)N1CCS(=O)(=O)CC1 WXVL_AN00044SB0150 [0,1,0,0,1,0|2,0,0]=4 152 B11R1.39 C#CC(=O)NC1CNC(=O)C1 WXVL_AK3081SB0338 [0,1,0,0,1,0|1,0,1]=4 153 B11R1.39 C#CC(=O)NC1CNC(=O)C1 WXVL_AK3081SB0338 [0,1,0,0,1,0|1,0,1]=4 154 B11R1.39 C#CC(=O)N[C@@H]1COC(=O)C1 WXVL_AK00458SB0338 [0,1,0,0,1,0|1,0,1]=4 155 B11R1.39 C#CC(=O)N[C@@H]1COC(=O)C1 WXVL_AK00458SB0338 [0,1,0,0,1,0|1,0,1]=4 156 B11R1.39 CCC(=O)NC1CNC(=O)C1 WXVL_AK3081SB0064 [0,1,0,0,1,0|1,0,0]=3 157 B11R1.39 CCC(=O)NC1CNC(=O)C1 WXVL_AK3081SB0064 [0,1,0,0,1,0|1,0,0]=3 158 B11R1.39 CCC(=O)N[C@@H]1COC(=O)C1 WXVL_AK00458SB0064 [0,1,0,0,1,0|1,0,0]=3 159 B11R1.39 CCC(=O)N[C@@H]1COC(=O)C1 WXVL_AK00458SB0064 [0,1,0,0,1,0|1,0,0]=3 160 B11R1.39 O=C(CO)N[C@@H]1COC(=O)C1 WXVL_AK00458SB2706 [0,1,0,0,1,0|1,0,0]=3 161 B11R1.39 O=C(CO)N[C@@H]1COC(=O)C1 WXVL_AK00458SB2706 [0,1,0,0,1,0|1,0,0]=3 162 B11R1.39 O=C1CC(CN1)NC(=O)CO WXVL_AK3081SB2706 [0,1,0,0,1,0|1,0,0]=3 163 B11R1.39 O=C1CC(CN1)NC(=O)CO WXVL_AK3081SB2706 [0,1,0,0,1,0|1,0,0]=3 164 B11R1.710 CC(=O)NC1CCC(C1)(F)F WXVL_AK00463SB0150 [0,1,0,0,1,0|1,0,1]=4 165 B11R1.710 CC(=O)NC1CCC(C1)(F)F WXVL_AK00463SB0150 [0,1,0,0,1,0|1,0,1]=4 166 B11R1.710 CC(=O)NC1CCS(=O)(=O)C1 WXVL_AK0410SB0150 [0,1,0,0,1,0|1,0,0]=3 167 B11R1.710 CC(=O)NC1CCS(=O)(=O)C1 WXVL_AK0410SB0150 [0,1,0,0,1,0|1,0,0]=3 168 B13R1.3 CC(=O)NCC1CCC(CC1)CN WXVL_AK4159SB0150 [0,1,0,0,0,1|1,0,1]=4 169 B13R1.3 CC(=O)NCC1CCC(CC1)CN WXVL_AK4159SB0150 [0,1,0,0,0,1|1,0,1]=4 170 B13R1.3 CC(=O)NC[C@H]1CC[C@@H](CC1)CO WXVL_AK9244SB0150 [0,1,0,0,0,1|0,0,2]=4 171 B13R1.3 CC(=O)NC[C@H]1CC[C@@H](CC1)CO WXVL_AK9244SB0150 [0,1,0,0,0,1|0,0,2]=4 172 B13R1.14 C#CC(=O)NCC1CCC(=O)NC1 WXVL_AK2042SB0338 [0,1,0,0,0,1|1,0,1]=4 173 B13R1.14 C#CC(=O)NCC1CCC(=O)NC1 WXVL_AK2042SB0338 [0,1,0,0,0,1|1,0,1]=4 174 B13R1.14 CCC(=O)NCC1CCC(=O)NC1 WXVL_AK2042SB0064 [0,1,0,0,0,1|1,0,0]=3 175 B13R1.14 CCC(=O)NCC1CCC(=O)NC1 WXVL_AK2042SB0064 [0,1,0,0,0,1|1,0,0]=3 176 B13R1.14 CCC(=O)NCC1CCN(CC1)C WXVL_AK0402SB0064 [0,1,0,0,0,1|2,0,0]=4 177 B13R1.14 CCC(=O)NCC1CCN(CC1)C WXVL_AK0402SB0064 [0,1,0,0,0,1|2,0,0]=4 178 B13R1.14 CCC(=O)NCC1CNC(=O)CO1 WXVL_AK2622SB0064 [0,1,0,0,0,1|2,0,0]=4 179 B13R1.14 CCC(=O)NCC1CNC(=O)CO1 WXVL_AK2622SB0064 [0,1,0,0,0,1|2,0,0]=4 180 B13R1.14 CCC(=O)NC[C@H]1CC[C@@H](CC1)O WXVL_AK5708SB0064 [0,1,0,0,0,1|0,0,2]=4 181 B13R1.14 CCC(=O)NC[C@H]1CC[C@@H](CC1)O WXVL_AK5708SB0064 [0,1,0,0,0,1|0,0,2]=4 182 B13R1.14 CN1CCC(CC1)CNC(=O)CO WXVL_AK0402SB2706 [0,1,0,0,0,1|2,0,0]=4 183 B13R1.14 CN1CCC(CC1)CNC(=O)CO WXVL_AK0402SB2706 [0,1,0,0,0,1|2,0,0]=4 184 B13R1.14 O=C(CO)NCC1CCC(=O)NC1 WXVL_AK2042SB2706 [0,1,0,0,0,1|1,0,0]=3 185 B13R1.14 O=C(CO)NCC1CCC(=O)NC1 WXVL_AK2042SB2706 [0,1,0,0,0,1|1,0,0]=3 186 B13R1.14 O=C(CO)NCC1CNC(=O)CO1 WXVL_AK2622SB2706 [0,1,0,0,0,1|2,0,0]=4 187 B13R1.14 O=C(CO)NCC1CNC(=O)CO1 WXVL_AK2622SB2706 [0,1,0,0,0,1|2,0,0]=4 188 B13R1.14 O=C(CO)NC[C@H]1CC[C@@H](CC1)O WXVL_AK5708SB2706 [0,1,0,0,0,1|0,0,2]=4 189 B13R1.14 O=C(CO)NC[C@H]1CC[C@@H](CC1)O WXVL_AK5708SB2706 [0,1,0,0,0,1|0,0,2]=4 190 B13R1.133 CC(=O)C(=O)NC1CCN(CC1)C WXVL_AK0287SB0051 [0,1,0,0,0,1|2,0,0]=4 191 B13R1.133 CC(=O)C(=O)NC1CCN(CC1)C WXVL_AK0287SB0051 [0,1,0,0,0,1|2,0,0]=4 192 B13R1.341 CC(=O)NCC1CCC(CC1)(F)F WXVL_AK00646SB0150 [0,1,0,0,0,1|1,0,1]=4 193 B13R1.341 CC(=O)NCC1CCC(CC1)(F)F WXVL_AK00646SB0150 [0,1,0,0,0,1|1,0,1]=4 194 B13R1.341 CC(=O)NCC1CCS(=O)(=O)CC1 WXVL_AK2047SB0150 [0,1,0,0,0,1|1,0,0]=3 195 B13R1.341 CC(=O)NCC1CCS(=O)(=O)CC1 WXVL_AK2047SB0150 [0,1,0,0,0,1|1,0,0]=3 196 B13R1.3795 CC(=O)C(=O)N1CCNC(=O)CC1 WXVL_AN00585SB0051 [0,1,0,0,0,1|2,0,0]=4 197 B13R1.5 CCC(=O)NC1CCC(CC1)C#N WXVL_AK00177SB0064 [0,2,0,0,0,0|1,0,1]=4 198 B13R1.5 CCC(=O)NC1CCC(CC1)C#N WXVL_AK00177SB0064 [0,2,0,0,0,0|1,0,1]=4 199 B13R1.5 CCC(=O)NC1CCC(CC1)CC WXVL_AK1084SB0064 [0,2,0,0,0,0|1,0,1]=4 200 B13R1.5 CCC(=O)NC1CCC(CC1)CC WXVL_AK1084SB0064 [0,2,0,0,0,0|1,0,1]=4 201 B13R1.5 CCC1CCC(CC1)NC(=O)CO WXVL_AK1084SB2706 [0,2,0,0,0,0|1,0,1]=4 202 B13R1.5 CCC1CCC(CC1)NC(=O)CO WXVL_AK1084SB2706 [0,2,0,0,0,0|1,0,1]=4 203 B13R1.5 N#CC1CCC(CC1)NC(=O)CO WXVL_AK00177SB2706 [0,2,0,0,0,0|1,0,1]=4 204 B13R1.5 N#CC1CCC(CC1)NC(=O)CO WXVL_AK00177SB2706 [0,2,0,0,0,0|1,0,1]=4 205 B13R1.510 CC(=O)C(=O)N1CCC(=O)C(C1)C WXVL_AN0338SB0051 [0,2,0,0,0,0|2,0,0]=4 206 B13R1.19 C#CCC(=O)NC1CCN(CC1)C WXVL_AK0287SB3070 [0,2,0,0,0,0|2,0,0]=4 207 B13R1.19 C#CCC(=O)NC1CCN(CC1)C WXVL_AK0287SB3070 [0,2,0,0,0,0|2,0,0]=4 208 B13R1.19 C/C=C/C(=O)NC1CCN(CC1)C WXVL_AK0287SB0340 [0,2,0,0,0,0|2,0,0]=4 209 B13R1.19 C/C=C/C(=O)NC1CCN(CC1)C WXVL_AK0287SB0340 [0,2,0,0,0,0|2,0,0]=4 210 B13R1.19 C=CCC(=O)NC1CCN(CC1)C WXVL_AK0287SB2732 [0,2,0,0,0,0|2,0,0]=4 211 B13R1.19 C=CCC(=O)NC1CCN(CC1)C WXVL_AK0287SB2732 [0,2,0,0,0,0|2,0,0]=4 212 B13R1.19 CC#CC(=O)NC1CCN(CC1)C WXVL_AK0287SB1240 [0,2,0,0,0,0|2,0,0]=4 213 B13R1.19 CC#CC(=O)NC1CCN(CC1)C WXVL_AK0287SB1240 [0,2,0,0,0,0|2,0,0]=4 214 B13R1.19 CCCC(=O)NC1CCN(CC1)C WXVL_AK0287SB0073 [0,2,0,0,0,0|2,0,0]=4 215 B13R1.19 CCCC(=O)NC1CCN(CC1)C WXVL_AK0287SB0073 [0,2,0,0,0,0|2,0,0]=4 216 B13R1.19 CCNC(=O)N[C@H]1CC[C@@H](CC1)C WXVL_AK00476YV0200 [0,2,0,0,0,0|1,0,1]=4 217 B13R1.19 CCNC(=O)N[C@H]1CC[C@@H](CC1)C WXVL_AK00476YV0200 [0,2,0,0,0,0|1,0,1]=4 218 B13R1.19 CN1CCC(CC1)NC(=O)CC#N WXVL_AK0287SB0057 [0,2,0,0,0,0|2,0,0]=4 219 B13R1.19 CN1CCC(CC1)NC(=O)CC#N WXVL_AK0287SB0057 [0,2,0,0,0,0|2,0,0]=4 220 B13R1.19 COCC(=O)NC1CCN(CC1)C WXVL_AK0287SB0090 [0,2,0,0,0,0|2,0,0]=4 221 B13R1.19 COCC(=O)NC1CCN(CC1)C WXVL_AK0287SB0090 [0,2,0,0,0,0|2,0,0]=4 222 B13R1.19 CSCC(=O)NC1CCN(CC1)C WXVL_AK0287SB1267 [0,2,0,0,0,0|2,0,0]=4 223 B13R1.19 CSCC(=O)NC1CCN(CC1)C WXVL_AK0287SB1267 [0,2,0,0,0,0|2,0,0]=4 224 B13R1.2679 CCC(=O)NC1CCC(=O)NC1=O WXVL_AK1450SB0064 [0,2,0,0,0,0|1,0,1]=4 225 B13R1.2679 CCC(=O)NC1CCC(=O)NC1=O WXVL_AK1450SB0064 [0,2,0,0,0,0|1,0,1]=4 226 B13R1.2679 O=C1CCC(C(=O)N1)NC(=O)CO WXVL_AK1450SB2706 [0,2,0,0,0,0|1,0,1]=4 227 B13R1.2679 O=C1CCC(C(=O)N1)NC(=O)CO WXVL_AK1450SB2706 [0,2,0,0,0,0|1,0,1]=4 228 B11R1.23 CCC(=O)N1CCNC(=O)C1 WXVL_AN0102SB0064 [0,0,1,1,0,0|1,0,0]=3 229 B11R1.23 CCC(=O)N1CCNC(=O)C1 WXVL_AN0102SB0064 [0,0,1,1,0,0|1,0,0]=3 230 B11R1.23 CCC(=O)N1CCOC(=O)C1 WXVL_AN4960SB0064 [0,0,1,1,0,0|2,0,0]=4 231 B11R1.23 CNC(=O)C1CCNC(=O)C1 WXVL_AK00442SB2983 [0,0,1,1,0,0|1,0,0]=3 232 B11R1.23 CNC(=O)C1CCNC(=O)C1 WXVL_AK00442SB2983 [0,0,1,1,0,0|1,0,0]=3 233 B11R1.23 O=C1CN(CCN1)C(=O)CO WXVL_AN0102SB2706 [0,0,1,1,0,0|2,0,0]=4 234 B11R1.23 O=C1CN(CCN1)C(=O)CO WXVL_AN0102SB2706 [0,0,1,1,0,0|2,0,0]=4 235 B11R1.75 CC(=O)NCC1CCC(C1)F WXVL_AK00226SB0150 [0,0,1,1,0,0|1,0,1]=4 236 B11R1.75 CC(=O)NCC1CCC(C1)F WXVL_AK00226SB0150 [0,0,1,1,0,0|1,0,1]=4 237 B11R1.75 CC(=O)NC[C@H]1CCC(=O)N1 WXVL_AK00538SB0150 [0,0,1,1,0,0|1,0,0]=3 238 B11R1.75 CC(=O)NC[C@H]1CCC(=O)N1 WXVL_AK00538SB0150 [0,0,1,1,0,0|1,0,0]=3 239 B11R1.159 CC(=O)N1CCCC(C1C)O WXVL_ANJ336SB0150 [0,0,1,1,0,0|0,0,2]=4 240 B11R1.159 CC(=O)N1CCCC(C1C)O WXVL_ANJ336SB0150 [0,0,1,1,0,0|0,0,2]=4 241 B11R1.159 CC(=O)N1CCNC(=O)[C@@H]1C WXVL_AN5008SB0150 [0,0,1,1,0,0|1,0,0]=3 242 B11R1.565 CC(=O)N1CCCC(CC1)C WXVL_AN00326SB0150 [0,0,1,1,0,0|1,0,1]=4 243 B11R1.565 CC(=O)N1CCCC(CC1)C WXVL_AN00326SB0150 [0,0,1,1,0,0|1,0,1]=4 244 B11R1.565 CC(=O)N1CCNC(=O)CC1 WXVL_AN00585SB0150 [0,0,1,1,0,0|1,0,0]=3 245 B11R1.74 CC(=O)N1CC(=O)NC(C1)C WXVL_AN0336SB0150 [0,0,1,1,0,0|1,0,0]=3 246 B11R1.74 CC(=O)N1CC(=O)NC(C1)C WXVL_AN0336SB0150 [0,0,1,1,0,0|1,0,0]=3 247 B11R2.824 CC(=O)N1C2CCC1CC2 WXVL_AN00445SB0150 [1,0,0,1,0,0|0,0,1]=3 248 B11R2.824 CC(=O)N1C2CCC1CC2 WXVL_AN00445SB0150 [1,0,0,1,0,0|0,0,1]=3 249 B11R2.1824 CC(=O)N1C2COCC1C2 WXVL_AN00557SB0150 [1,0,0,1,0,0|1,0,1]=4 250 B11R2.845 CC(=O)N1CC2CCC1C2 WXVL_AN3504SB0150 [0,0,0,1,1,0|1,0,1]=4 251 B13R2.13858 CC(=O)NCC12CCN(C1)CC2 WXVL_AK00067SB0150 [0,0,0,1,0,1|2,0,0]=4 252 B13R2.13858 CC(=O)NCC12CCN(C1)CC2 WXVL_AK00067SB0150 [0,0,0,1,0,1|2,0,0]=4 253 B13R2.5559 CC(=O)N1CCN2CCC1CC2 WXVL_AN3774SB0150 [0,1,0,1,0,0|2,0,0]=4 254 B13R2.1153 CCC(=O)N1CC2CCC1CC2 WXVL_AN3285SB0064 [0,1,0,1,0,0|1,0,1]=4 255 B13R2.1153 CCC(=O)N1CC2CCC1CC2 WXVL_AN3285SB0064 [0,1,0,1,0,0|1,0,1]=4 256 B13R2.1153 O=C(CO)N1CC2CCC1CC2 WXVL_AN3285SB2706 [0,1,0,1,0,0|1,0,1]=4 257 B13R2.1153 O=C(CO)N1CC2CCC1CC2 WXVL_AN3285SB2706 [0,1,0,1,0,0|1,0,1]=4 258 B9R0.1 CCC(=O)NCCC(=O)N WXVL_AK00443SB0064 [0,0,1,0,1,0|2,0,0]=4 259 B9R0.1 CCC(=O)NCCC(=O)N WXVL_AK00443SB0064 [0,0,1,0,1,0|2,0,0]=4 260 B9R0.1 CNC(=O)CCNC(=O)C WXVL_AK00442SB0374 [0,0,1,0,1,0|1,0,0]=3 261 B9R0.1 CNC(=O)CCNC(=O)C WXVL_AK00442SB0374 [0,0,1,0,1,0|1,0,0]=3 262 B9R0.7 CC(=O)N(C)CCC(=O)N WXVL_AK0084SB1414 [0,0,1,0,1,0|2,0,0]=4 263 B9R0.7 CC(=O)N(C)CCC(=O)N WXVL_AK0084SB1414 [0,0,1,0,1,0|2,0,0]=4 264 B9R0.53 CC(=O)NC(C)CN(C)C WXVL_AK0938SB0150 [0,0,1,0,1,0|2,0,0]=4 265 B9R0.53 CC(=O)NC(C)CN(C)C WXVL_AK0938SB0150 [0,0,1,0,1,0|2,0,0]=4 266 B9R1.6 CC(=O)N1CCOCC1 WXVL_AN00478SB0150 [1,0,0,0,1,0|2,0,0]=4 267 B9R1.6 CC(=O)N1CCOCC1 WXVL_AN00478SB0150 [1,0,0,0,1,0|2,0,0]=4 268 B9R1.6 CC(=O)N1CCSCC1 WXVL_AN0896SB0150 [1,0,0,0,1,0|2,0,0]=4 269 B9R1.6 NC(=O)C1CC=CCC1 WXVL_AK0084SB3640 [1,0,0,0,1,0|1,0,1]=4 270 B9R1.6 NC(=O)C1CC=CCC1 WXVL_AK0084SB3640 [1,0,0,0,1,0|1,0,1]=4 271 B9R1.6 NC(=O)C1CCCCC1 WXVL_AK0084SB0047 [1,0,0,0,1,0|1,0,1]=4 272 B9R1.6 NC(=O)C1CCCCC1 WXVL_AK0084SB0047 [1,0,0,0,1,0|1,0,1]=4 273 B9R1.6 NC(=O)C1CCOCC1 WXVL_AK0084SB0149 [1,0,0,0,1,0|2,0,0]=4 274 B9R1.6 NC(=O)C1CCOCC1 WXVL_AK0084SB0149 [1,0,0,0,1,0|2,0,0]=4 275 B9R1.6 NC(=O)C1CCSCC1 WXVL_AK0084SB0752 [1,0,0,0,1,0|2,0,0]=4 276 B9R1.6 NC(=O)C1CCSCC1 WXVL_AK0084SB0752 [1,0,0,0,1,0|2,0,0]=4 277 B9R1.13 NC(=O)CC1CCCC1 WXVL_AK0084SB0044 [1,0,0,0,1,0|2,0,0]=4 278 B9R1.13 NC(=O)CC1CCCC1 WXVL_AK0084SB0044 [1,0,0,0,1,0|2,0,0]=4 279 B9R1.35 NC(=O)C1CNC(=O)C1 WXVL_AK0084SB0366 [0,0,0,0,2,0|2,0,0]=4 280 B9R1.35 NC(=O)C1CNC(=O)C1 WXVL_AK0084SB0366 [0,0,0,0,2,0|2,0,0]=4 281 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 WXVL_AK0084SB0126 [0,0,0,0,2,0|2,0,0]=4 282 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 WXVL_AK0084SB0126 [0,0,0,0,2,0|2,0,0]=4 283 B9R1.53 CC(=O)NC1CC(C1)C WXVL_AK0309SB0150 [0,0,0,0,2,0|1,0,1]=4 284 B9R1.53 CC(=O)NC1CC(C1)C WXVL_AK0309SB0150 [0,0,0,0,2,0|1,0,1]=4 285 B9R1.53 CC(=O)NC1CC(C1)F WXVL_AK0307SB0150 [0,0,0,0,2,0|1,0,1]=4 286 B9R1.53 CC(=O)NC1CC(C1)F WXVL_AK0307SB0150 [0,0,0,0,2,0|1,0,1]=4 287 B9R1.53 CC(=O)NC1CC(C1)O WXVL_AK0306SB0150 [0,0,0,0,2,0|0,0,2]=4 288 B9R1.53 CC(=O)NC1CC(C1)O WXVL_AK0306SB0150 [0,0,0,0,2,0|0,0,2]=4 289 B9R1.53 CC(=O)NC1CN(C1)C WXVL_AK1377SB0150 [0,0,0,0,2,0|2,0,0]=4 290 B9R1.53 CC(=O)NC1CN(C1)C WXVL_AK1377SB0150 [0,0,0,0,2,0|2,0,0]=4 291 B9R1.53 CC(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB0150 [0,0,0,0,2,0|0,0,2]=4 292 B9R1.53 CC(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB0150 [0,0,0,0,2,0|0,0,2]=4 293 B11R0.6 CC(=O)NC(C)CCCC(C)C WXVL_AK00574SB0150 [0,0,1,0,0,1|1,0,1]=4 294 B11R0.6 CC(=O)NC(C)CCCC(C)C WXVL_AK00574SB0150 [0,0,1,0,0,1|1,0,1]=4 295 B11R1.91 CC(=O)NCC1CCCCO1 WXVL_AK1232SB0150 [1,0,0,0,0,1|1,0,1]=4 296 B11R1.91 CC(=O)NCC1CCCCO1 WXVL_AK1232SB0150 [1,0,0,0,0,1|1,0,1]=4 297 B11R1.91 CC(=O)NCC1CCCOC1 WXVL_AK00150SB0150 [1,0,0,0,0,1|1,0,1]=4 298 B11R1.91 CC(=O)NCC1CCCOC1 WXVL_AK00150SB0150 [1,0,0,0,0,1|1,0,1]=4 299 B11R1.91 CC(=O)NCC1CCOCC1 WXVL_AK0150SB0150 [1,0,0,0,0,1|1,0,0]=3 300 B11R1.91 CC(=O)NCC1CCOCC1 WXVL_AK0150SB0150 [1,0,0,0,0,1|1,0,0]=3 301 B11R1.91 CC(=O)NCC1CCSCC1 WXVL_AK00654SB0150 [1,0,0,0,0,1|1,0,0]=3 302 B11R1.91 CC(=O)NCC1CCSCC1 WXVL_AK00654SB0150 [1,0,0,0,0,1|1,0,0]=3