0 B10R0.91 C#CCCC(=O)NCCCC WXVL_AK00588SB2189 [0,0,0,0,0,0|2,0,2]=4 1 B10R0.91 C#CCCC(=O)NCCCC WXVL_AK00588SB2189 [0,0,0,0,0,0|2,0,2]=4 2 B10R0.91 C#CCCCC(=O)NCC=C WXVL_AK00561SB2709 [0,0,0,0,0,0|1,0,2]=3 3 B10R0.91 C#CCCCC(=O)NCC=C WXVL_AK00561SB2709 [0,0,0,0,0,0|1,0,2]=3 4 B10R0.91 C#CCCNC(=O)CCC=C WXVL_AK3109SB1035 [0,0,0,0,0,0|2,0,2]=4 5 B10R0.91 C#CCCNC(=O)CCC=C WXVL_AK3109SB1035 [0,0,0,0,0,0|2,0,2]=4 6 B10R0.91 C=CCCC(=O)NCCC#N WXVL_AK0087SB1035 [0,0,0,0,0,0|3,0,1]=4 7 B10R0.91 C=CCCC(=O)NCCC#N WXVL_AK0087SB1035 [0,0,0,0,0,0|3,0,1]=4 8 B10R0.91 C=CCCC(=O)NCCCC WXVL_AK00588SB1035 [0,0,0,0,0,0|2,0,0]=2 9 B10R0.91 C=CCCC(=O)NCCCC WXVL_AK00588SB1035 [0,0,0,0,0,0|2,0,0]=2 10 B10R0.91 C=CCCC(=O)NCCCO WXVL_AK0073SB1035 [0,0,0,0,0,0|3,0,0]=3 11 B10R0.91 C=CCCC(=O)NCCCO WXVL_AK0073SB1035 [0,0,0,0,0,0|3,0,0]=3 12 B10R0.91 C=CCCC(=O)NCCSC WXVL_AK00440SB1035 [0,0,0,0,0,0|3,0,0]=3 13 B10R0.91 C=CCCC(=O)NCCSC WXVL_AK00440SB1035 [0,0,0,0,0,0|3,0,0]=3 14 B10R0.91 C=CCCCC(=O)NCC=C WXVL_AK00561SB2920 [0,0,0,0,0,0|1,0,2]=3 15 B10R0.91 C=CCCCC(=O)NCC=C WXVL_AK00561SB2920 [0,0,0,0,0,0|1,0,2]=3 16 B10R0.91 C=CCCNC(=O)CCC=C WXVL_AK00138SB1035 [0,0,0,0,0,0|2,0,2]=4 17 B10R0.91 C=CCCNC(=O)CCC=C WXVL_AK00138SB1035 [0,0,0,0,0,0|2,0,2]=4 18 B10R0.91 C=CCNC(=O)/C=C/OCC WXVL_AK00561SB3226 [0,0,0,0,0,0|2,0,2]=4 19 B10R0.91 C=CCNC(=O)/C=C/OCC WXVL_AK00561SB3226 [0,0,0,0,0,0|2,0,2]=4 20 B10R0.91 C=CCNC(=O)C/C=C/CC WXVL_AK00561SB0349 [0,0,0,0,0,0|1,0,2]=3 21 B10R0.91 C=CCNC(=O)C/C=C/CC WXVL_AK00561SB0349 [0,0,0,0,0,0|1,0,2]=3 22 B10R0.91 C=CCNC(=O)CCCCBr WXVL_AK00561SB3153 [0,0,0,0,0,0|2,0,0]=2 23 B10R0.91 C=CCNC(=O)CCCCBr WXVL_AK00561SB3153 [0,0,0,0,0,0|2,0,0]=2 24 B10R0.91 C=CCNC(=O)CCCCCl WXVL_AK00561SB0379 [0,0,0,0,0,0|2,0,0]=2 25 B10R0.91 C=CCNC(=O)CCCCCl WXVL_AK00561SB0379 [0,0,0,0,0,0|2,0,0]=2 26 B10R0.91 C=CCNC(=O)NCCCCl WXVL_AK00561YV0130 [0,0,0,0,0,0|3,0,0]=3 27 B10R0.91 C=CCNC(=O)NCCCCl WXVL_AK00561YV0130 [0,0,0,0,0,0|3,0,0]=3 28 B10R0.91 CCCCNC(=O)CCOC WXVL_AK00588SB0156 [0,0,0,0,0,0|3,0,1]=4 29 B10R0.91 CCCCNC(=O)CCOC WXVL_AK00588SB0156 [0,0,0,0,0,0|3,0,1]=4 30 B10R0.91 CCCCNC(=O)CCSC WXVL_AK00588SB0361 [0,0,0,0,0,0|3,0,1]=4 31 B10R0.91 CCCCNC(=O)CCSC WXVL_AK00588SB0361 [0,0,0,0,0,0|3,0,1]=4 32 B10R0.91 CCCCNC(=O)NCCCl WXVL_AK00588YV0092 [0,0,0,0,0,0|3,0,1]=4 33 B10R0.91 CCCCNC(=O)NCCCl WXVL_AK00588YV0092 [0,0,0,0,0,0|3,0,1]=4 34 B10R0.91 CCCNC(=O)CCCCBr WXVL_AK00504SB3153 [0,0,0,0,0,0|2,0,2]=4 35 B10R0.91 CCCNC(=O)CCCCBr WXVL_AK00504SB3153 [0,0,0,0,0,0|2,0,2]=4 36 B10R0.91 CCCNC(=O)CCCCCl WXVL_AK00504SB0379 [0,0,0,0,0,0|2,0,2]=4 37 B10R0.91 CCCNC(=O)CCCCCl WXVL_AK00504SB0379 [0,0,0,0,0,0|2,0,2]=4 38 B10R0.91 N#CCNC(=O)CCCCBr WXVL_AK0683SB3153 [0,0,0,0,0,0|3,0,1]=4 39 B10R0.91 N#CCNC(=O)CCCCBr WXVL_AK0683SB3153 [0,0,0,0,0,0|3,0,1]=4 40 B10R0.91 N#CCNC(=O)CCCCCl WXVL_AK0683SB0379 [0,0,0,0,0,0|3,0,1]=4 41 B10R0.91 N#CCNC(=O)CCCCCl WXVL_AK0683SB0379 [0,0,0,0,0,0|3,0,1]=4 42 B10R0.91 O=C(CCCCBr)NCCF WXVL_AK00466SB3153 [0,0,0,0,0,0|3,0,1]=4 43 B10R0.91 O=C(CCCCBr)NCCF WXVL_AK00466SB3153 [0,0,0,0,0,0|3,0,1]=4 44 B10R0.91 O=C(CCCCCl)NCCF WXVL_AK00466SB0379 [0,0,0,0,0,0|3,0,1]=4 45 B10R0.91 O=C(CCCCCl)NCCF WXVL_AK00466SB0379 [0,0,0,0,0,0|3,0,1]=4 46 B9R0.5 C#CCC(=O)NCCCC WXVL_AK00588SB3070 [1,0,0,0,0,0|1,0,2]=4 47 B9R0.5 C#CCC(=O)NCCCC WXVL_AK00588SB3070 [1,0,0,0,0,0|1,0,2]=4 48 B9R0.5 C#CCCNC(=O)CC=C WXVL_AK3109SB2732 [1,0,0,0,0,0|1,0,2]=4 49 B9R0.5 C#CCCNC(=O)CC=C WXVL_AK3109SB2732 [1,0,0,0,0,0|1,0,2]=4 50 B9R0.5 C/C=C/C(=O)NCCCC WXVL_AK00588SB0340 [1,0,0,0,0,0|1,0,2]=4 51 B9R0.5 C/C=C/C(=O)NCCCC WXVL_AK00588SB0340 [1,0,0,0,0,0|1,0,2]=4 52 B9R0.5 C=CCC(=O)NCCC#N WXVL_AK0087SB2732 [1,0,0,0,0,0|2,0,1]=4 53 B9R0.5 C=CCC(=O)NCCC#N WXVL_AK0087SB2732 [1,0,0,0,0,0|2,0,1]=4 54 B9R0.5 C=CCC(=O)NCCCC WXVL_AK00588SB2732 [1,0,0,0,0,0|1,0,0]=2 55 B9R0.5 C=CCC(=O)NCCCC WXVL_AK00588SB2732 [1,0,0,0,0,0|1,0,0]=2 56 B9R0.5 C=CCC(=O)NCCCO WXVL_AK0073SB2732 [1,0,0,0,0,0|2,0,0]=3 57 B9R0.5 C=CCC(=O)NCCCO WXVL_AK0073SB2732 [1,0,0,0,0,0|2,0,0]=3 58 B9R0.5 C=CCC(=O)NCCSC WXVL_AK00440SB2732 [1,0,0,0,0,0|2,0,0]=3 59 B9R0.5 C=CCC(=O)NCCSC WXVL_AK00440SB2732 [1,0,0,0,0,0|2,0,0]=3 60 B9R0.5 C=CCCNC(=O)CC=C WXVL_AK00138SB2732 [1,0,0,0,0,0|1,0,2]=4 61 B9R0.5 C=CCCNC(=O)CC=C WXVL_AK00138SB2732 [1,0,0,0,0,0|1,0,2]=4 62 B9R0.5 CCCCNC(=O)CC#N WXVL_AK00588SB0057 [1,0,0,0,0,0|2,0,1]=4 63 B9R0.5 CCCCNC(=O)CC#N WXVL_AK00588SB0057 [1,0,0,0,0,0|2,0,1]=4 64 B9R0.5 CCCCNC(=O)CCC WXVL_AK00588SB0073 [1,0,0,0,0,0|1,0,2]=4 65 B9R0.5 CCCCNC(=O)CCC WXVL_AK00588SB0073 [1,0,0,0,0,0|1,0,2]=4 66 B9R0.5 CCCCNC(=O)COC WXVL_AK00588SB0090 [1,0,0,0,0,0|2,0,1]=4 67 B9R0.5 CCCCNC(=O)COC WXVL_AK00588SB0090 [1,0,0,0,0,0|2,0,1]=4 68 B9R0.5 CCCCNC(=O)CSC WXVL_AK00588SB1267 [1,0,0,0,0,0|2,0,1]=4 69 B9R0.5 CCCCNC(=O)CSC WXVL_AK00588SB1267 [1,0,0,0,0,0|2,0,1]=4 70 B9R0.5 CCNC(=O)CCCCBr WXVL_AK00476SB3153 [1,0,0,0,0,0|2,0,1]=4 71 B9R0.5 CCNC(=O)CCCCBr WXVL_AK00476SB3153 [1,0,0,0,0,0|2,0,1]=4 72 B9R0.5 CCNC(=O)CCCCCl WXVL_AK00476SB0379 [1,0,0,0,0,0|2,0,1]=4 73 B9R0.5 CCNC(=O)CCCCCl WXVL_AK00476SB0379 [1,0,0,0,0,0|2,0,1]=4 74 B9R0.18 C#CCCC(=O)NCC=C WXVL_AK00561SB2189 [1,0,0,0,0,0|1,0,2]=4 75 B9R0.18 C#CCCC(=O)NCC=C WXVL_AK00561SB2189 [1,0,0,0,0,0|1,0,2]=4 76 B9R0.18 C=CCCC(=O)NCC=C WXVL_AK00561SB1035 [1,0,0,0,0,0|1,0,2]=4 77 B9R0.18 C=CCCC(=O)NCC=C WXVL_AK00561SB1035 [1,0,0,0,0,0|1,0,2]=4 78 B9R0.18 C=CCCC(=O)NCCC WXVL_AK00504SB1035 [1,0,0,0,0,0|2,0,0]=3 79 B9R0.18 C=CCCC(=O)NCCC WXVL_AK00504SB1035 [1,0,0,0,0,0|2,0,0]=3 80 B9R0.18 C=CCCC(=O)NCCF WXVL_AK00466SB1035 [1,0,0,0,0,0|3,0,0]=4 81 B9R0.18 C=CCCC(=O)NCCF WXVL_AK00466SB1035 [1,0,0,0,0,0|3,0,0]=4 82 B9R0.18 C=CCNC(=O)CCOC WXVL_AK00561SB0156 [1,0,0,0,0,0|2,0,0]=3 83 B9R0.18 C=CCNC(=O)CCOC WXVL_AK00561SB0156 [1,0,0,0,0,0|2,0,0]=3 84 B9R0.18 C=CCNC(=O)CCSC WXVL_AK00561SB0361 [1,0,0,0,0,0|2,0,0]=3 85 B9R0.18 C=CCNC(=O)CCSC WXVL_AK00561SB0361 [1,0,0,0,0,0|2,0,0]=3 86 B9R0.18 C=CCNC(=O)COCC WXVL_AK00561SB0091 [1,0,0,0,0,0|2,0,0]=3 87 B9R0.18 C=CCNC(=O)COCC WXVL_AK00561SB0091 [1,0,0,0,0,0|2,0,0]=3 88 B9R0.18 C=CCNC(=O)CSCC WXVL_AK00561SB0002 [1,0,0,0,0,0|2,0,0]=3 89 B9R0.18 C=CCNC(=O)CSCC WXVL_AK00561SB0002 [1,0,0,0,0,0|2,0,0]=3 90 B9R0.18 C=CCNC(=O)NCCCl WXVL_AK00561YV0092 [1,0,0,0,0,0|3,0,0]=4 91 B9R0.18 C=CCNC(=O)NCCCl WXVL_AK00561YV0092 [1,0,0,0,0,0|3,0,0]=4 92 B11R0.5 C=CCCC(=O)NC(C)CCO WXVL_AK1288SB1035 [0,1,0,0,0,0|3,0,0]=4 93 B11R0.5 C=CCCC(=O)NC(C)CCO WXVL_AK1288SB1035 [0,1,0,0,0,0|3,0,0]=4 94 B11R0.5 C=CCCC(=O)N[C@@H](C)CCC WXVL_AK00682SB1035 [0,1,0,0,0,0|2,0,0]=3 95 B11R0.5 C=CCCC(=O)N[C@@H](C)CCC WXVL_AK00682SB1035 [0,1,0,0,0,0|2,0,0]=3 96 B11R0.5 C=CCCC(=O)N[C@@H](C)COC WXVL_AK0137SB1035 [0,1,0,0,0,0|3,0,0]=4 97 B11R0.5 C=CCCC(=O)N[C@@H](C)COC WXVL_AK0137SB1035 [0,1,0,0,0,0|3,0,0]=4 98 B11R0.5 C=CCCC(=O)N[C@H](C)COC WXVL_AK00613SB1035 [0,1,0,0,0,0|3,0,0]=4 99 B11R0.5 C=CCCC(=O)N[C@H](C)COC WXVL_AK00613SB1035 [0,1,0,0,0,0|3,0,0]=4 100 B11R0.5 C=CCNC(=O)CC(=O)OCC WXVL_AK00561SB3094 [0,1,0,0,0,0|2,0,1]=4 101 B11R0.5 C=CCNC(=O)CC(=O)OCC WXVL_AK00561SB3094 [0,1,0,0,0,0|2,0,1]=4 102 B11R0.11 C=CCCC(=O)N(C)CCOC WXVL_AN0085SB1035 [0,1,0,0,0,0|3,0,0]=4 103 B11R0.11 C=CCCC(=O)N(C)CCOC WXVL_AN0085SB1035 [0,1,0,0,0,0|3,0,0]=4 104 B11R0.11 C=CCNC(=O)C(O)CCCC WXVL_AK00561SB3429 [0,1,0,0,0,0|1,0,0]=2 105 B11R0.11 C=CCNC(=O)C(O)CCCC WXVL_AK00561SB3429 [0,1,0,0,0,0|1,0,0]=2 106 B11R0.11 CCCCC(O)C(=O)NCC#N WXVL_AK0683SB3429 [0,1,0,0,0,0|2,0,1]=4 107 B11R0.11 CCCCC(O)C(=O)NCC#N WXVL_AK0683SB3429 [0,1,0,0,0,0|2,0,1]=4 108 B11R0.11 CCCCC(O)C(=O)NCCC WXVL_AK00504SB3429 [0,1,0,0,0,0|1,0,2]=4 109 B11R0.11 CCCCC(O)C(=O)NCCC WXVL_AK00504SB3429 [0,1,0,0,0,0|1,0,2]=4 110 B11R0.11 CCCCC(O)C(=O)NCCF WXVL_AK00466SB3429 [0,1,0,0,0,0|2,0,1]=4 111 B11R0.11 CCCCC(O)C(=O)NCCF WXVL_AK00466SB3429 [0,1,0,0,0,0|2,0,1]=4 112 B11R0.46 C#CCCCC(=O)NCC(=C)C WXVL_AK0761SB2709 [0,1,0,0,0,0|1,0,2]=4 113 B11R0.46 C#CCCCC(=O)NCC(=C)C WXVL_AK0761SB2709 [0,1,0,0,0,0|1,0,2]=4 114 B11R0.46 C=C(C)CNC(=O)C/C=C/CC WXVL_AK0761SB0349 [0,1,0,0,0,0|1,0,2]=4 115 B11R0.46 C=C(C)CNC(=O)C/C=C/CC WXVL_AK0761SB0349 [0,1,0,0,0,0|1,0,2]=4 116 B11R0.46 C=C(C)CNC(=O)CCCCBr WXVL_AK0761SB3153 [0,1,0,0,0,0|2,0,0]=3 117 B11R0.46 C=C(C)CNC(=O)CCCCBr WXVL_AK0761SB3153 [0,1,0,0,0,0|2,0,0]=3 118 B11R0.46 C=C(C)CNC(=O)CCCCCl WXVL_AK0761SB0379 [0,1,0,0,0,0|2,0,0]=3 119 B11R0.46 C=C(C)CNC(=O)CCCCCl WXVL_AK0761SB0379 [0,1,0,0,0,0|2,0,0]=3 120 B11R0.46 C=C(C)CNC(=O)NCCCCl WXVL_AK0761YV0130 [0,1,0,0,0,0|3,0,0]=4 121 B11R0.46 C=C(C)CNC(=O)NCCCCl WXVL_AK0761YV0130 [0,1,0,0,0,0|3,0,0]=4 122 B11R0.46 C=CCCCC(=O)NCC(=C)C WXVL_AK0761SB2920 [0,1,0,0,0,0|1,0,2]=4 123 B11R0.46 C=CCCCC(=O)NCC(=C)C WXVL_AK0761SB2920 [0,1,0,0,0,0|1,0,2]=4 124 B11R0.46 CCCCNC(=O)CCC(=O)C WXVL_AK00588SB0072 [0,1,0,0,0,0|2,0,1]=4 125 B11R0.46 CCCCNC(=O)CCC(=O)C WXVL_AK00588SB0072 [0,1,0,0,0,0|2,0,1]=4 126 B11R0.46 CCCCNC(=O)CCC(=O)N WXVL_AK00588SB0358 [0,1,0,0,0,0|3,0,0]=4 127 B11R0.46 CCCCNC(=O)CCC(=O)N WXVL_AK00588SB0358 [0,1,0,0,0,0|3,0,0]=4 128 B11R0.46 NC(=O)CNC(=O)CCCCBr WXVL_AK0147SB3153 [0,1,0,0,0,0|3,0,0]=4 129 B11R0.46 NC(=O)CNC(=O)CCCCBr WXVL_AK0147SB3153 [0,1,0,0,0,0|3,0,0]=4 130 B11R0.46 NC(=O)CNC(=O)CCCCCl WXVL_AK0147SB0379 [0,1,0,0,0,0|3,0,0]=4 131 B11R0.46 NC(=O)CNC(=O)CCCCCl WXVL_AK0147SB0379 [0,1,0,0,0,0|3,0,0]=4 132 B11R0.70 C=CCCC(=O)NC[C@@H](C)OC WXVL_AK00704SB1035 [0,1,0,0,0,0|3,0,0]=4 133 B11R0.70 C=CCCC(=O)NC[C@@H](C)OC WXVL_AK00704SB1035 [0,1,0,0,0,0|3,0,0]=4 134 B11R0.70 C=CCCC(=O)NC[C@@H](F)CO WXVL_AK00590SB1035 [0,1,0,0,0,0|3,0,0]=4 135 B11R0.70 C=CCCC(=O)NC[C@@H](F)CO WXVL_AK00590SB1035 [0,1,0,0,0,0|3,0,0]=4 136 B11R0.70 C=CCCC(=O)NC[C@H](O)CO WXVL_AK00483SB1035 [0,1,0,0,0,0|3,0,0]=4 137 B11R0.70 C=CCCC(=O)NC[C@H](O)CO WXVL_AK00483SB1035 [0,1,0,0,0,0|3,0,0]=4 138 B11R0.70 C=CCNC(=O)CCC(=O)OC WXVL_AK00561SB0069 [0,1,0,0,0,0|2,0,1]=4 139 B11R0.70 C=CCNC(=O)CCC(=O)OC WXVL_AK00561SB0069 [0,1,0,0,0,0|2,0,1]=4 140 B11R0.81 C#CCCC(=O)NCCCCC WXVL_AK0076SB2189 [0,1,0,0,0,0|1,0,2]=4 141 B11R0.81 C#CCCC(=O)NCCCCC WXVL_AK0076SB2189 [0,1,0,0,0,0|1,0,2]=4 142 B11R0.81 C#CCCCNC(=O)CCC=C WXVL_AK00218SB1035 [0,1,0,0,0,0|1,0,2]=4 143 B11R0.81 C#CCCCNC(=O)CCC=C WXVL_AK00218SB1035 [0,1,0,0,0,0|1,0,2]=4 144 B11R0.81 C#CCOCCC(=O)NCC=C WXVL_AK00561SBD927 [0,1,0,0,0,0|1,0,2]=4 145 B11R0.81 C#CCOCCC(=O)NCC=C WXVL_AK00561SBD927 [0,1,0,0,0,0|1,0,2]=4 146 B11R0.81 C=CCCC(=O)NCCCCC WXVL_AK0076SB1035 [0,1,0,0,0,0|1,0,0]=2 147 B11R0.81 C=CCCC(=O)NCCCCC WXVL_AK0076SB1035 [0,1,0,0,0,0|1,0,0]=2 148 B11R0.81 C=CCCC(=O)NCCCCO WXVL_AK0075SB1035 [0,1,0,0,0,0|2,0,0]=3 149 B11R0.81 C=CCCC(=O)NCCCCO WXVL_AK0075SB1035 [0,1,0,0,0,0|2,0,0]=3 150 B11R0.81 C=CCCC(=O)NCCCOC WXVL_AK00637SB1035 [0,1,0,0,0,0|2,0,0]=3 151 B11R0.81 C=CCCC(=O)NCCCOC WXVL_AK00637SB1035 [0,1,0,0,0,0|2,0,0]=3 152 B11R0.81 C=CCCC(=O)NCCCSC WXVL_AK0965SB1035 [0,1,0,0,0,0|2,0,0]=3 153 B11R0.81 C=CCCC(=O)NCCCSC WXVL_AK0965SB1035 [0,1,0,0,0,0|2,0,0]=3 154 B11R0.81 C=CCCC(=O)NCCSCC WXVL_AK00494SB1035 [0,1,0,0,0,0|2,0,0]=3 155 B11R0.81 C=CCCC(=O)NCCSCC WXVL_AK00494SB1035 [0,1,0,0,0,0|2,0,0]=3 156 B11R0.81 C=CCNC(=O)CCCCCBr WXVL_AK00561SB2192 [0,1,0,0,0,0|1,0,0]=2 157 B11R0.81 C=CCNC(=O)CCCCCBr WXVL_AK00561SB2192 [0,1,0,0,0,0|1,0,0]=2 158 B11R0.81 C=CCNC(=O)CCCCCO WXVL_AK00561SB2973 [0,1,0,0,0,0|1,0,0]=2 159 B11R0.81 C=CCNC(=O)CCCCCO WXVL_AK00561SB2973 [0,1,0,0,0,0|1,0,0]=2 160 B11R0.81 C=CCNC(=O)COCCOC WXVL_AK00561SB0159 [0,1,0,0,0,0|2,0,0]=3 161 B11R0.81 C=CCNC(=O)COCCOC WXVL_AK00561SB0159 [0,1,0,0,0,0|2,0,0]=3 162 B11R0.81 CCCCCNC(=O)CCOC WXVL_AK0076SB0156 [0,1,0,0,0,0|2,0,1]=4 163 B11R0.81 CCCCCNC(=O)CCOC WXVL_AK0076SB0156 [0,1,0,0,0,0|2,0,1]=4 164 B11R0.81 CCCCCNC(=O)CCSC WXVL_AK0076SB0361 [0,1,0,0,0,0|2,0,1]=4 165 B11R0.81 CCCCCNC(=O)CCSC WXVL_AK0076SB0361 [0,1,0,0,0,0|2,0,1]=4 166 B11R0.81 CCCCCNC(=O)NCCCl WXVL_AK0076YV0092 [0,1,0,0,0,0|2,0,1]=4 167 B11R0.81 CCCCCNC(=O)NCCCl WXVL_AK0076YV0092 [0,1,0,0,0,0|2,0,1]=4 168 B11R0.81 CCCNC(=O)CCCCCBr WXVL_AK00504SB2192 [0,1,0,0,0,0|1,0,2]=4 169 B11R0.81 CCCNC(=O)CCCCCBr WXVL_AK00504SB2192 [0,1,0,0,0,0|1,0,2]=4 170 B11R0.81 CCCNC(=O)CCCCCO WXVL_AK00504SB2973 [0,1,0,0,0,0|1,0,2]=4 171 B11R0.81 CCCNC(=O)CCCCCO WXVL_AK00504SB2973 [0,1,0,0,0,0|1,0,2]=4 172 B11R0.81 N#CCNC(=O)CCCCCBr WXVL_AK0683SB2192 [0,1,0,0,0,0|2,0,1]=4 173 B11R0.81 N#CCNC(=O)CCCCCBr WXVL_AK0683SB2192 [0,1,0,0,0,0|2,0,1]=4 174 B11R0.81 N#CCNC(=O)CCCCCO WXVL_AK0683SB2973 [0,1,0,0,0,0|2,0,1]=4 175 B11R0.81 N#CCNC(=O)CCCCCO WXVL_AK0683SB2973 [0,1,0,0,0,0|2,0,1]=4 176 B11R0.81 O=C(CCCCCBr)NCCF WXVL_AK00466SB2192 [0,1,0,0,0,0|2,0,1]=4 177 B11R0.81 O=C(CCCCCBr)NCCF WXVL_AK00466SB2192 [0,1,0,0,0,0|2,0,1]=4 178 B11R0.81 O=C(CCCCCO)NCCF WXVL_AK00466SB2973 [0,1,0,0,0,0|2,0,1]=4 179 B11R0.81 O=C(CCCCCO)NCCF WXVL_AK00466SB2973 [0,1,0,0,0,0|2,0,1]=4 180 B11R0.140 C#CCCCC(=O)NCCC=C WXVL_AK00138SB2709 [0,1,0,0,0,0|1,0,2]=4 181 B11R0.140 C#CCCCC(=O)NCCC=C WXVL_AK00138SB2709 [0,1,0,0,0,0|1,0,2]=4 182 B11R0.140 C/C=C/C=C/C(=O)NCCCC WXVL_AK00588SB0348 [0,1,0,0,0,0|2,0,1]=4 183 B11R0.140 C/C=C/C=C/C(=O)NCCCC WXVL_AK00588SB0348 [0,1,0,0,0,0|2,0,1]=4 184 B11R0.140 C=CCCCC(=O)NCCC=C WXVL_AK00138SB2920 [0,1,0,0,0,0|1,0,2]=4 185 B11R0.140 C=CCCCC(=O)NCCC=C WXVL_AK00138SB2920 [0,1,0,0,0,0|1,0,2]=4 186 B11R0.140 C=CCCCC(=O)NCCCC WXVL_AK00588SB2920 [0,1,0,0,0,0|2,0,0]=3 187 B11R0.140 C=CCCCC(=O)NCCCC WXVL_AK00588SB2920 [0,1,0,0,0,0|2,0,0]=3 188 B11R0.140 C=CCCCC(=O)NCCCO WXVL_AK0073SB2920 [0,1,0,0,0,0|3,0,0]=4 189 B11R0.140 C=CCCCC(=O)NCCCO WXVL_AK0073SB2920 [0,1,0,0,0,0|3,0,0]=4 190 B11R0.140 C=CCCCC(=O)NCCSC WXVL_AK00440SB2920 [0,1,0,0,0,0|3,0,0]=4 191 B11R0.140 C=CCCCC(=O)NCCSC WXVL_AK00440SB2920 [0,1,0,0,0,0|3,0,0]=4 192 B11R0.140 C=CCCNC(=O)C/C=C/CC WXVL_AK00138SB0349 [0,1,0,0,0,0|1,0,2]=4 193 B11R0.140 C=CCCNC(=O)C/C=C/CC WXVL_AK00138SB0349 [0,1,0,0,0,0|1,0,2]=4 194 B11R0.140 C=CCCNC(=O)CCCCBr WXVL_AK00138SB3153 [0,1,0,0,0,0|2,0,0]=3 195 B11R0.140 C=CCCNC(=O)CCCCBr WXVL_AK00138SB3153 [0,1,0,0,0,0|2,0,0]=3 196 B11R0.140 C=CCCNC(=O)CCCCCl WXVL_AK00138SB0379 [0,1,0,0,0,0|2,0,0]=3 197 B11R0.140 C=CCCNC(=O)CCCCCl WXVL_AK00138SB0379 [0,1,0,0,0,0|2,0,0]=3 198 B11R0.140 C=CCCNC(=O)NCCCCl WXVL_AK00138YV0130 [0,1,0,0,0,0|3,0,0]=4 199 B11R0.140 C=CCCNC(=O)NCCCCl WXVL_AK00138YV0130 [0,1,0,0,0,0|3,0,0]=4 200 B11R0.147 C=CCCC(=O)NCCC(C)C WXVL_AK0068SB1035 [0,1,0,0,0,0|2,0,0]=3 201 B11R0.147 C=CCCC(=O)NCCC(C)C WXVL_AK0068SB1035 [0,1,0,0,0,0|2,0,0]=3 202 B11R0.147 C=CCCC(=O)NCCN(C)C WXVL_AK0058SB1035 [0,1,0,0,0,0|3,0,0]=4 203 B11R0.147 C=CCCC(=O)NCCN(C)C WXVL_AK0058SB1035 [0,1,0,0,0,0|3,0,0]=4 204 B11R0.147 C=CCNC(=O)CCC=C(C)C WXVL_AK00561SB00030 [0,1,0,0,0,0|1,0,2]=4 205 B11R0.147 C=CCNC(=O)CCC=C(C)C WXVL_AK00561SB00030 [0,1,0,0,0,0|1,0,2]=4 206 B11R0.147 C=CCNC(=O)CCCC(C)C WXVL_AK00561SB1301 [0,1,0,0,0,0|1,0,0]=2 207 B11R0.147 C=CCNC(=O)CCCC(C)C WXVL_AK00561SB1301 [0,1,0,0,0,0|1,0,0]=2 208 B11R0.147 C=CCNC(=O)CCCN(C)C WXVL_AK00561SB00055 [0,1,0,0,0,0|2,0,0]=3 209 B11R0.147 C=CCNC(=O)CCCN(C)C WXVL_AK00561SB00055 [0,1,0,0,0,0|2,0,0]=3 210 B11R0.147 C=CCNC(=O)CCNC(=O)C WXVL_AK00561SB0374 [0,1,0,0,0,0|2,0,1]=4 211 B11R0.147 C=CCNC(=O)CCNC(=O)C WXVL_AK00561SB0374 [0,1,0,0,0,0|2,0,1]=4 212 B11R0.147 CC(C)CCCC(=O)NCC#N WXVL_AK0683SB1301 [0,1,0,0,0,0|2,0,1]=4 213 B11R0.147 CC(C)CCCC(=O)NCC#N WXVL_AK0683SB1301 [0,1,0,0,0,0|2,0,1]=4 214 B11R0.147 CC(C)CCCC(=O)NCCF WXVL_AK00466SB1301 [0,1,0,0,0,0|2,0,1]=4 215 B11R0.147 CC(C)CCCC(=O)NCCF WXVL_AK00466SB1301 [0,1,0,0,0,0|2,0,1]=4 216 B11R0.147 CCCNC(=O)CCCC(C)C WXVL_AK00504SB1301 [0,1,0,0,0,0|1,0,2]=4 217 B11R0.147 CCCNC(=O)CCCC(C)C WXVL_AK00504SB1301 [0,1,0,0,0,0|1,0,2]=4 218 B11R0.154 C#CCCCC(=O)NC(C)C=C WXVL_AK00769SB2709 [0,1,0,0,0,0|1,0,2]=4 219 B11R0.154 C#CCCCC(=O)NC(C)C=C WXVL_AK00769SB2709 [0,1,0,0,0,0|1,0,2]=4 220 B11R0.154 C=CC(C)NC(=O)C/C=C/CC WXVL_AK00769SB0349 [0,1,0,0,0,0|1,0,2]=4 221 B11R0.154 C=CC(C)NC(=O)C/C=C/CC WXVL_AK00769SB0349 [0,1,0,0,0,0|1,0,2]=4 222 B11R0.154 C=CC(C)NC(=O)CCCCBr WXVL_AK00769SB3153 [0,1,0,0,0,0|2,0,0]=3 223 B11R0.154 C=CC(C)NC(=O)CCCCBr WXVL_AK00769SB3153 [0,1,0,0,0,0|2,0,0]=3 224 B11R0.154 C=CC(C)NC(=O)CCCCCl WXVL_AK00769SB0379 [0,1,0,0,0,0|2,0,0]=3 225 B11R0.154 C=CC(C)NC(=O)CCCCCl WXVL_AK00769SB0379 [0,1,0,0,0,0|2,0,0]=3 226 B11R0.154 C=CC(C)NC(=O)NCCCCl WXVL_AK00769YV0130 [0,1,0,0,0,0|3,0,0]=4 227 B11R0.154 C=CC(C)NC(=O)NCCCCl WXVL_AK00769YV0130 [0,1,0,0,0,0|3,0,0]=4 228 B11R0.154 C=CCCCC(=O)NC(C)C=C WXVL_AK00769SB2920 [0,1,0,0,0,0|1,0,2]=4 229 B11R0.154 C=CCCCC(=O)NC(C)C=C WXVL_AK00769SB2920 [0,1,0,0,0,0|1,0,2]=4 230 B11R0.321 C=CCNS(=O)(=O)CCCCCl WXVL_AK00561HU0456 [0,1,0,0,0,0|3,0,0]=4 231 B11R0.321 C=CCNS(=O)(=O)CCCCCl WXVL_AK00561HU0456 [0,1,0,0,0,0|3,0,0]=4 232 B11R0.321 C=CCNS(=O)(=O)CCOCC WXVL_AK00561HU0315 [0,1,0,0,0,0|3,0,0]=4 233 B11R0.321 C=CCNS(=O)(=O)CCOCC WXVL_AK00561HU0315 [0,1,0,0,0,0|3,0,0]=4 234 B11R1.29 C=CCCC(=O)N1CCCC1 WXVL_AN0008SB1035 [0,0,0,1,0,0|2,0,0]=3 235 B11R1.29 C=CCCC(=O)N1CCCC1 WXVL_AN0008SB1035 [0,0,0,1,0,0|2,0,0]=3 236 B11R1.29 C=CCNC(=O)C1CCCC1 WXVL_AK00561SB0043 [0,0,0,1,0,0|1,0,0]=2 237 B11R1.29 C=CCNC(=O)C1CCCC1 WXVL_AK00561SB0043 [0,0,0,1,0,0|1,0,0]=2 238 B11R1.29 C=CCNC(=O)C1CCCO1 WXVL_AK00561SB1033 [0,0,0,1,0,0|2,0,0]=3 239 B11R1.29 C=CCNC(=O)C1CCCO1 WXVL_AK00561SB1033 [0,0,0,1,0,0|2,0,0]=3 240 B11R1.29 C=CCNC(=O)C1CCCS1 WXVL_AK00561SB0022 [0,0,0,1,0,0|2,0,0]=3 241 B11R1.29 C=CCNC(=O)C1CCCS1 WXVL_AK00561SB0022 [0,0,0,1,0,0|2,0,0]=3 242 B11R1.29 C=CCNC(=O)[C@H]1CCCO1 WXVL_AK00561SB00043 [0,0,0,1,0,0|2,0,0]=3 243 B11R1.29 C=CCNC(=O)[C@H]1CCCO1 WXVL_AK00561SB00043 [0,0,0,1,0,0|2,0,0]=3 244 B11R1.29 CCCNC(=O)C1CCCC1 WXVL_AK00504SB0043 [0,0,0,1,0,0|1,0,2]=4 245 B11R1.29 CCCNC(=O)C1CCCC1 WXVL_AK00504SB0043 [0,0,0,1,0,0|1,0,2]=4 246 B11R1.29 N#CCNC(=O)C1CCCC1 WXVL_AK0683SB0043 [0,0,0,1,0,0|2,0,1]=4 247 B11R1.29 N#CCNC(=O)C1CCCC1 WXVL_AK0683SB0043 [0,0,0,1,0,0|2,0,1]=4 248 B11R1.29 O=C(NCCF)C1CCCC1 WXVL_AK00466SB0043 [0,0,0,1,0,0|2,0,1]=4 249 B11R1.29 O=C(NCCF)C1CCCC1 WXVL_AK00466SB0043 [0,0,0,1,0,0|2,0,1]=4 250 B11R1.284 C=CCCC(=O)NC1CNC1 WXVL_AK1291SB1035 [0,0,0,1,0,0|3,0,0]=4 251 B11R1.284 C=CCCC(=O)NC1CNC1 WXVL_AK1291SB1035 [0,0,0,1,0,0|3,0,0]=4 252 B11R1.284 C=CCCC(=O)NC1CSC1 WXVL_AK2089SB1035 [0,0,0,1,0,0|3,0,0]=4 253 B11R1.284 C=CCCC(=O)NC1CSC1 WXVL_AK2089SB1035 [0,0,0,1,0,0|3,0,0]=4 254 B11R1.284 C=CCNC(=O)CC1CCC1 WXVL_AK00561SB2207 [0,0,0,1,0,0|1,0,0]=2 255 B11R1.284 C=CCNC(=O)CC1CCC1 WXVL_AK00561SB2207 [0,0,0,1,0,0|1,0,0]=2 256 B11R1.284 CCCNC(=O)CC1CCC1 WXVL_AK00504SB2207 [0,0,0,1,0,0|1,0,2]=4 257 B11R1.284 CCCNC(=O)CC1CCC1 WXVL_AK00504SB2207 [0,0,0,1,0,0|1,0,2]=4 258 B11R1.284 N#CCNC(=O)CC1CCC1 WXVL_AK0683SB2207 [0,0,0,1,0,0|2,0,1]=4 259 B11R1.284 N#CCNC(=O)CC1CCC1 WXVL_AK0683SB2207 [0,0,0,1,0,0|2,0,1]=4 260 B11R1.284 O=C(CC1CCC1)NCCF WXVL_AK00466SB2207 [0,0,0,1,0,0|2,0,1]=4 261 B11R1.284 O=C(CC1CCC1)NCCF WXVL_AK00466SB2207 [0,0,0,1,0,0|2,0,1]=4 262 B11R1.285 C=CCNC(=O)C=CC1CC1 WXVL_AK00561SB4216 [0,0,0,1,0,0|1,0,2]=4 263 B11R1.285 C=CCNC(=O)C=CC1CC1 WXVL_AK00561SB4216 [0,0,0,1,0,0|1,0,2]=4 264 B11R1.285 C=CCNC(=O)CCC1CC1 WXVL_AK00561SB5360 [0,0,0,1,0,0|1,0,0]=2 265 B11R1.285 C=CCNC(=O)CCC1CC1 WXVL_AK00561SB5360 [0,0,0,1,0,0|1,0,0]=2 266 B11R1.285 CCCNC(=O)CCC1CC1 WXVL_AK00504SB5360 [0,0,0,1,0,0|1,0,2]=4 267 B11R1.285 CCCNC(=O)CCC1CC1 WXVL_AK00504SB5360 [0,0,0,1,0,0|1,0,2]=4 268 B11R1.285 N#CCNC(=O)CCC1CC1 WXVL_AK0683SB5360 [0,0,0,1,0,0|2,0,1]=4 269 B11R1.285 N#CCNC(=O)CCC1CC1 WXVL_AK0683SB5360 [0,0,0,1,0,0|2,0,1]=4 270 B11R1.285 O=C(CCC1CC1)NCCF WXVL_AK00466SB5360 [0,0,0,1,0,0|2,0,1]=4 271 B11R1.285 O=C(CCC1CC1)NCCF WXVL_AK00466SB5360 [0,0,0,1,0,0|2,0,1]=4 272 B8R0.1 C=CCC(=O)NCCC WXVL_AK00504SB2732 [2,0,0,0,0,0|1,0,0]=3 273 B8R0.1 C=CCC(=O)NCCC WXVL_AK00504SB2732 [2,0,0,0,0,0|1,0,0]=3 274 B8R0.1 C=CCC(=O)NCCF WXVL_AK00466SB2732 [2,0,0,0,0,0|2,0,0]=4 275 B8R0.1 C=CCC(=O)NCCF WXVL_AK00466SB2732 [2,0,0,0,0,0|2,0,0]=4 276 B8R0.1 C=CCCC(=O)NCC WXVL_AK00476SB1035 [2,0,0,0,0,0|2,0,0]=4 277 B8R0.1 C=CCCC(=O)NCC WXVL_AK00476SB1035 [2,0,0,0,0,0|2,0,0]=4 278 B8R0.1 C=CCNC(=O)CCC WXVL_AK00561SB0073 [2,0,0,0,0,0|1,0,0]=3 279 B8R0.1 C=CCNC(=O)CCC WXVL_AK00561SB0073 [2,0,0,0,0,0|1,0,0]=3 280 B8R0.1 C=CCNC(=O)COC WXVL_AK00561SB0090 [2,0,0,0,0,0|2,0,0]=4 281 B8R0.1 C=CCNC(=O)COC WXVL_AK00561SB0090 [2,0,0,0,0,0|2,0,0]=4 282 B8R0.1 C=CCNC(=O)CSC WXVL_AK00561SB1267 [2,0,0,0,0,0|2,0,0]=4 283 B8R0.1 C=CCNC(=O)CSC WXVL_AK00561SB1267 [2,0,0,0,0,0|2,0,0]=4 284 B8R0.6 CCCCNC(=O)CC WXVL_AK00588SB0064 [2,0,0,0,0,0|1,0,1]=4 285 B8R0.6 CCCCNC(=O)CC WXVL_AK00588SB0064 [2,0,0,0,0,0|1,0,1]=4 286 B8R0.6 CCCCNC(=O)CO WXVL_AK00588SB2706 [2,0,0,0,0,0|2,0,0]=4 287 B8R0.6 CCCCNC(=O)CO WXVL_AK00588SB2706 [2,0,0,0,0,0|2,0,0]=4 288 B8R0.6 CNC(=O)CCCCBr WXVL_AK00442SB3153 [2,0,0,0,0,0|2,0,0]=4 289 B8R0.6 CNC(=O)CCCCBr WXVL_AK00442SB3153 [2,0,0,0,0,0|2,0,0]=4 290 B8R0.6 CNC(=O)CCCCCl WXVL_AK00442SB0379 [2,0,0,0,0,0|2,0,0]=4 291 B8R0.6 CNC(=O)CCCCCl WXVL_AK00442SB0379 [2,0,0,0,0,0|2,0,0]=4 292 B10R0.1 C#CCC(=O)NCCCCC WXVL_AK0076SB3070 [1,1,0,0,0,0|0,0,2]=4 293 B10R0.1 C#CCC(=O)NCCCCC WXVL_AK0076SB3070 [1,1,0,0,0,0|0,0,2]=4 294 B10R0.1 C#CCCCNC(=O)CC=C WXVL_AK00218SB2732 [1,1,0,0,0,0|0,0,2]=4 295 B10R0.1 C#CCCCNC(=O)CC=C WXVL_AK00218SB2732 [1,1,0,0,0,0|0,0,2]=4 296 B10R0.1 C/C=C/C(=O)NCCCCC WXVL_AK0076SB0340 [1,1,0,0,0,0|0,0,2]=4 297 B10R0.1 C/C=C/C(=O)NCCCCC WXVL_AK0076SB0340 [1,1,0,0,0,0|0,0,2]=4 298 B10R0.1 C=CCC(=O)NCCCCC WXVL_AK0076SB2732 [1,1,0,0,0,0|0,0,0]=2 299 B10R0.1 C=CCC(=O)NCCCCC WXVL_AK0076SB2732 [1,1,0,0,0,0|0,0,0]=2 300 B10R0.1 C=CCC(=O)NCCCCO WXVL_AK0075SB2732 [1,1,0,0,0,0|1,0,0]=3 301 B10R0.1 C=CCC(=O)NCCCCO WXVL_AK0075SB2732 [1,1,0,0,0,0|1,0,0]=3 302 B10R0.1 C=CCC(=O)NCCCOC WXVL_AK00637SB2732 [1,1,0,0,0,0|1,0,0]=3 303 B10R0.1 C=CCC(=O)NCCCOC WXVL_AK00637SB2732 [1,1,0,0,0,0|1,0,0]=3 304 B10R0.1 C=CCC(=O)NCCCSC WXVL_AK0965SB2732 [1,1,0,0,0,0|1,0,0]=3 305 B10R0.1 C=CCC(=O)NCCCSC WXVL_AK0965SB2732 [1,1,0,0,0,0|1,0,0]=3 306 B10R0.1 C=CCC(=O)NCCSCC WXVL_AK00494SB2732 [1,1,0,0,0,0|1,0,0]=3 307 B10R0.1 C=CCC(=O)NCCSCC WXVL_AK00494SB2732 [1,1,0,0,0,0|1,0,0]=3 308 B10R0.1 CCCCCNC(=O)CC#N WXVL_AK0076SB0057 [1,1,0,0,0,0|1,0,1]=4 309 B10R0.1 CCCCCNC(=O)CC#N WXVL_AK0076SB0057 [1,1,0,0,0,0|1,0,1]=4 310 B10R0.1 CCCCCNC(=O)CCC WXVL_AK0076SB0073 [1,1,0,0,0,0|0,0,2]=4 311 B10R0.1 CCCCCNC(=O)CCC WXVL_AK0076SB0073 [1,1,0,0,0,0|0,0,2]=4 312 B10R0.1 CCCCCNC(=O)COC WXVL_AK0076SB0090 [1,1,0,0,0,0|1,0,1]=4 313 B10R0.1 CCCCCNC(=O)COC WXVL_AK0076SB0090 [1,1,0,0,0,0|1,0,1]=4 314 B10R0.1 CCCCCNC(=O)CSC WXVL_AK0076SB1267 [1,1,0,0,0,0|1,0,1]=4 315 B10R0.1 CCCCCNC(=O)CSC WXVL_AK0076SB1267 [1,1,0,0,0,0|1,0,1]=4 316 B10R0.1 CCNC(=O)CCCCCBr WXVL_AK00476SB2192 [1,1,0,0,0,0|1,0,1]=4 317 B10R0.1 CCNC(=O)CCCCCBr WXVL_AK00476SB2192 [1,1,0,0,0,0|1,0,1]=4 318 B10R0.1 CCNC(=O)CCCCCO WXVL_AK00476SB2973 [1,1,0,0,0,0|1,0,1]=4 319 B10R0.1 CCNC(=O)CCCCCO WXVL_AK00476SB2973 [1,1,0,0,0,0|1,0,1]=4 320 B10R0.2 C=CCC(=O)NC(C)CCO WXVL_AK1288SB2732 [1,1,0,0,0,0|2,0,0]=4 321 B10R0.2 C=CCC(=O)NC(C)CCO WXVL_AK1288SB2732 [1,1,0,0,0,0|2,0,0]=4 322 B10R0.2 C=CCC(=O)N[C@@H](C)CCC WXVL_AK00682SB2732 [1,1,0,0,0,0|1,0,0]=3 323 B10R0.2 C=CCC(=O)N[C@@H](C)CCC WXVL_AK00682SB2732 [1,1,0,0,0,0|1,0,0]=3 324 B10R0.2 C=CCC(=O)N[C@@H](C)COC WXVL_AK0137SB2732 [1,1,0,0,0,0|2,0,0]=4 325 B10R0.2 C=CCC(=O)N[C@@H](C)COC WXVL_AK0137SB2732 [1,1,0,0,0,0|2,0,0]=4 326 B10R0.2 C=CCC(=O)N[C@H](C)COC WXVL_AK00613SB2732 [1,1,0,0,0,0|2,0,0]=4 327 B10R0.2 C=CCC(=O)N[C@H](C)COC WXVL_AK00613SB2732 [1,1,0,0,0,0|2,0,0]=4 328 B10R0.3 C=CCC(=O)NCCC(C)C WXVL_AK0068SB2732 [1,1,0,0,0,0|1,0,0]=3 329 B10R0.3 C=CCC(=O)NCCC(C)C WXVL_AK0068SB2732 [1,1,0,0,0,0|1,0,0]=3 330 B10R0.3 C=CCC(=O)NCCN(C)C WXVL_AK0058SB2732 [1,1,0,0,0,0|2,0,0]=4 331 B10R0.3 C=CCC(=O)NCCN(C)C WXVL_AK0058SB2732 [1,1,0,0,0,0|2,0,0]=4 332 B10R0.3 CCNC(=O)CCCC(C)C WXVL_AK00476SB1301 [1,1,0,0,0,0|1,0,1]=4 333 B10R0.3 CCNC(=O)CCCC(C)C WXVL_AK00476SB1301 [1,1,0,0,0,0|1,0,1]=4 334 B10R0.19 C=CCC(=O)N(C)CCOC WXVL_AN0085SB2732 [1,1,0,0,0,0|2,0,0]=4 335 B10R0.19 C=CCC(=O)N(C)CCOC WXVL_AN0085SB2732 [1,1,0,0,0,0|2,0,0]=4 336 B10R0.19 CCCCC(O)C(=O)NCC WXVL_AK00476SB3429 [1,1,0,0,0,0|1,0,1]=4 337 B10R0.19 CCCCC(O)C(=O)NCC WXVL_AK00476SB3429 [1,1,0,0,0,0|1,0,1]=4 338 B10R0.108 C=CCC(=O)NC[C@@H](C)OC WXVL_AK00704SB2732 [1,1,0,0,0,0|2,0,0]=4 339 B10R0.108 C=CCC(=O)NC[C@@H](C)OC WXVL_AK00704SB2732 [1,1,0,0,0,0|2,0,0]=4 340 B10R0.108 C=CCC(=O)NC[C@@H](F)CO WXVL_AK00590SB2732 [1,1,0,0,0,0|2,0,0]=4 341 B10R0.108 C=CCC(=O)NC[C@@H](F)CO WXVL_AK00590SB2732 [1,1,0,0,0,0|2,0,0]=4 342 B10R0.108 C=CCC(=O)NC[C@H](O)CO WXVL_AK00483SB2732 [1,1,0,0,0,0|2,0,0]=4 343 B10R0.108 C=CCC(=O)NC[C@H](O)CO WXVL_AK00483SB2732 [1,1,0,0,0,0|2,0,0]=4 344 B10R0.156 C=CCS(=O)(=O)NCCCC WXVL_AK00588HU0152 [1,1,0,0,0,0|2,0,0]=4 345 B10R0.156 C=CCS(=O)(=O)NCCCC WXVL_AK00588HU0152 [1,1,0,0,0,0|2,0,0]=4 346 B10R0.18 C=CC(C)NC(=O)CCOC WXVL_AK00769SB0156 [1,1,0,0,0,0|2,0,0]=4 347 B10R0.18 C=CC(C)NC(=O)CCOC WXVL_AK00769SB0156 [1,1,0,0,0,0|2,0,0]=4 348 B10R0.18 C=CC(C)NC(=O)CCSC WXVL_AK00769SB0361 [1,1,0,0,0,0|2,0,0]=4 349 B10R0.18 C=CC(C)NC(=O)CCSC WXVL_AK00769SB0361 [1,1,0,0,0,0|2,0,0]=4 350 B10R0.18 C=CC(C)NC(=O)COCC WXVL_AK00769SB0091 [1,1,0,0,0,0|2,0,0]=4 351 B10R0.18 C=CC(C)NC(=O)COCC WXVL_AK00769SB0091 [1,1,0,0,0,0|2,0,0]=4 352 B10R0.18 C=CC(C)NC(=O)CSCC WXVL_AK00769SB0002 [1,1,0,0,0,0|2,0,0]=4 353 B10R0.18 C=CC(C)NC(=O)CSCC WXVL_AK00769SB0002 [1,1,0,0,0,0|2,0,0]=4 354 B10R0.18 C=CCCC(=O)N[C@@H](C)CC WXVL_AK00678SB1035 [1,1,0,0,0,0|2,0,0]=4 355 B10R0.18 C=CCCC(=O)N[C@@H](C)CC WXVL_AK00678SB1035 [1,1,0,0,0,0|2,0,0]=4 356 B10R0.18 C=CCNC(=O)CC(C)CC WXVL_AK00561SB0353 [1,1,0,0,0,0|1,0,0]=3 357 B10R0.18 C=CCNC(=O)CC(C)CC WXVL_AK00561SB0353 [1,1,0,0,0,0|1,0,0]=3 358 B10R0.18 C=CCNC(=O)CC(O)CC WXVL_AK00561SB4092 [1,1,0,0,0,0|1,0,0]=3 359 B10R0.18 C=CCNC(=O)CC(O)CC WXVL_AK00561SB4092 [1,1,0,0,0,0|1,0,0]=3 360 B10R0.18 C=CCNC(=O)C[C@H](C)CC WXVL_AK00561SB8650 [1,1,0,0,0,0|1,0,0]=3 361 B10R0.18 C=CCNC(=O)C[C@H](C)CC WXVL_AK00561SB8650 [1,1,0,0,0,0|1,0,0]=3 362 B10R0.78 C=C(C)CNC(=O)CCOC WXVL_AK0761SB0156 [1,1,0,0,0,0|2,0,0]=4 363 B10R0.78 C=C(C)CNC(=O)CCOC WXVL_AK0761SB0156 [1,1,0,0,0,0|2,0,0]=4 364 B10R0.78 C=C(C)CNC(=O)CCSC WXVL_AK0761SB0361 [1,1,0,0,0,0|2,0,0]=4 365 B10R0.78 C=C(C)CNC(=O)CCSC WXVL_AK0761SB0361 [1,1,0,0,0,0|2,0,0]=4 366 B10R0.78 C=C(C)CNC(=O)COCC WXVL_AK0761SB0091 [1,1,0,0,0,0|2,0,0]=4 367 B10R0.78 C=C(C)CNC(=O)COCC WXVL_AK0761SB0091 [1,1,0,0,0,0|2,0,0]=4 368 B10R0.78 C=C(C)CNC(=O)CSCC WXVL_AK0761SB0002 [1,1,0,0,0,0|2,0,0]=4 369 B10R0.78 C=C(C)CNC(=O)CSCC WXVL_AK0761SB0002 [1,1,0,0,0,0|2,0,0]=4 370 B10R0.78 C=CCCC(=O)NCC(C)C WXVL_AK00544SB1035 [1,1,0,0,0,0|2,0,0]=4 371 B10R0.78 C=CCCC(=O)NCC(C)C WXVL_AK00544SB1035 [1,1,0,0,0,0|2,0,0]=4 372 B10R0.78 C=CCCC(=O)NCC(C)O WXVL_AK0052SB1035 [1,1,0,0,0,0|2,0,0]=4 373 B10R0.78 C=CCCC(=O)NCC(C)O WXVL_AK0052SB1035 [1,1,0,0,0,0|2,0,0]=4 374 B10R0.78 C=CCCC(=O)NC[C@H](C)O WXVL_AK0113SB1035 [1,1,0,0,0,0|2,0,0]=4 375 B10R0.78 C=CCCC(=O)NC[C@H](C)O WXVL_AK0113SB1035 [1,1,0,0,0,0|2,0,0]=4 376 B10R0.78 C=CCNC(=O)CCC(=O)C WXVL_AK00561SB0072 [1,1,0,0,0,0|1,0,1]=4 377 B10R0.78 C=CCNC(=O)CCC(=O)C WXVL_AK00561SB0072 [1,1,0,0,0,0|1,0,1]=4 378 B10R0.78 C=CCNC(=O)CCC(C)C WXVL_AK00561SB0354 [1,1,0,0,0,0|1,0,0]=3 379 B10R0.78 C=CCNC(=O)CCC(C)C WXVL_AK00561SB0354 [1,1,0,0,0,0|1,0,0]=3 380 B10R0.78 C=CCNC(=O)CCN(C)C WXVL_AK00561SB00052 [1,1,0,0,0,0|2,0,0]=4 381 B10R0.78 C=CCNC(=O)CCN(C)C WXVL_AK00561SB00052 [1,1,0,0,0,0|2,0,0]=4 382 B10R0.78 C=CCNC(=O)COC(C)C WXVL_AK00561SB0213 [1,1,0,0,0,0|2,0,0]=4 383 B10R0.78 C=CCNC(=O)COC(C)C WXVL_AK00561SB0213 [1,1,0,0,0,0|2,0,0]=4 384 B10R0.116 C=CCNS(=O)(=O)CCCC WXVL_AK00561HU0031 [1,1,0,0,0,0|2,0,0]=4 385 B10R0.116 C=CCNS(=O)(=O)CCCC WXVL_AK00561HU0031 [1,1,0,0,0,0|2,0,0]=4 386 B12R0.132 C=CCCC(=O)N[C@H](CO)CCC WXVL_AK2551SB1035 [0,2,0,0,0,0|2,0,0]=4 387 B12R0.132 C=CCCC(=O)N[C@H](CO)CCC WXVL_AK2551SB1035 [0,2,0,0,0,0|2,0,0]=4 388 B12R0.239 C=CCCCC(=O)N[C@@H](C)CCC WXVL_AK00682SB2920 [0,2,0,0,0,0|2,0,0]=4 389 B12R0.239 C=CCCCC(=O)N[C@@H](C)CCC WXVL_AK00682SB2920 [0,2,0,0,0,0|2,0,0]=4 390 B12R0.98 C=C(C)CNC(=O)C(O)CCCC WXVL_AK0761SB3429 [0,2,0,0,0,0|1,0,0]=3 391 B12R0.98 C=C(C)CNC(=O)C(O)CCCC WXVL_AK0761SB3429 [0,2,0,0,0,0|1,0,0]=3 392 B12R0.98 CCCCC(O)C(=O)NCC(=O)N WXVL_AK0147SB3429 [0,2,0,0,0,0|2,0,0]=4 393 B12R0.98 CCCCC(O)C(=O)NCC(=O)N WXVL_AK0147SB3429 [0,2,0,0,0,0|2,0,0]=4 394 B12R0.252 C=CC(C)NC(=O)C(O)CCCC WXVL_AK00769SB3429 [0,2,0,0,0,0|1,0,0]=3 395 B12R0.252 C=CC(C)NC(=O)C(O)CCCC WXVL_AK00769SB3429 [0,2,0,0,0,0|1,0,0]=3 396 B12R0.648 C=CCCNC(=O)C(O)CCCC WXVL_AK00138SB3429 [0,2,0,0,0,0|1,0,0]=3 397 B12R0.648 C=CCCNC(=O)C(O)CCCC WXVL_AK00138SB3429 [0,2,0,0,0,0|1,0,0]=3 398 B12R0.648 C=CCNC(=O)C(C)CCCCC WXVL_AK00561SB0394 [0,2,0,0,0,0|1,0,0]=3 399 B12R0.648 C=CCNC(=O)C(C)CCCCC WXVL_AK00561SB0394 [0,2,0,0,0,0|1,0,0]=3 400 B12R0.648 C=CCOC(C)C(=O)NCCCC WXVL_AK00588SBD933 [0,2,0,0,0,0|1,0,0]=3 401 B12R0.648 C=CCOC(C)C(=O)NCCCC WXVL_AK00588SBD933 [0,2,0,0,0,0|1,0,0]=3 402 B12R0.648 C=CCOC(C)C(=O)NCCCO WXVL_AK0073SBD933 [0,2,0,0,0,0|2,0,0]=4 403 B12R0.648 C=CCOC(C)C(=O)NCCCO WXVL_AK0073SBD933 [0,2,0,0,0,0|2,0,0]=4 404 B12R0.648 C=CCOC(C)C(=O)NCCSC WXVL_AK00440SBD933 [0,2,0,0,0,0|2,0,0]=4 405 B12R0.648 C=CCOC(C)C(=O)NCCSC WXVL_AK00440SBD933 [0,2,0,0,0,0|2,0,0]=4 406 B12R0.44 C=C(C)CNC(=O)CCCC(C)C WXVL_AK0761SB1301 [0,2,0,0,0,0|1,0,0]=3 407 B12R0.44 C=C(C)CNC(=O)CCCC(C)C WXVL_AK0761SB1301 [0,2,0,0,0,0|1,0,0]=3 408 B12R0.44 C=C(C)CNC(=O)CCCN(C)C WXVL_AK0761SB00055 [0,2,0,0,0,0|2,0,0]=4 409 B12R0.44 C=C(C)CNC(=O)CCCN(C)C WXVL_AK0761SB00055 [0,2,0,0,0,0|2,0,0]=4 410 B12R0.44 CC(C)CCCC(=O)NCC(=O)N WXVL_AK0147SB1301 [0,2,0,0,0,0|2,0,0]=4 411 B12R0.44 CC(C)CCCC(=O)NCC(=O)N WXVL_AK0147SB1301 [0,2,0,0,0,0|2,0,0]=4 412 B12R0.255 C=C(C)CNC(=O)CCCCCBr WXVL_AK0761SB2192 [0,2,0,0,0,0|1,0,0]=3 413 B12R0.255 C=C(C)CNC(=O)CCCCCBr WXVL_AK0761SB2192 [0,2,0,0,0,0|1,0,0]=3 414 B12R0.255 C=C(C)CNC(=O)CCCCCO WXVL_AK0761SB2973 [0,2,0,0,0,0|1,0,0]=3 415 B12R0.255 C=C(C)CNC(=O)CCCCCO WXVL_AK0761SB2973 [0,2,0,0,0,0|1,0,0]=3 416 B12R0.255 C=C(C)CNC(=O)COCCOC WXVL_AK0761SB0159 [0,2,0,0,0,0|2,0,0]=4 417 B12R0.255 C=C(C)CNC(=O)COCCOC WXVL_AK0761SB0159 [0,2,0,0,0,0|2,0,0]=4 418 B12R0.255 CCCCCNC(=O)CCC(=O)C WXVL_AK0076SB0072 [0,2,0,0,0,0|1,0,1]=4 419 B12R0.255 CCCCCNC(=O)CCC(=O)C WXVL_AK0076SB0072 [0,2,0,0,0,0|1,0,1]=4 420 B12R0.255 CCCCCNC(=O)CCC(=O)N WXVL_AK0076SB0358 [0,2,0,0,0,0|2,0,0]=4 421 B12R0.255 CCCCCNC(=O)CCC(=O)N WXVL_AK0076SB0358 [0,2,0,0,0,0|2,0,0]=4 422 B12R0.255 NC(=O)CNC(=O)CCCCCBr WXVL_AK0147SB2192 [0,2,0,0,0,0|2,0,0]=4 423 B12R0.255 NC(=O)CNC(=O)CCCCCBr WXVL_AK0147SB2192 [0,2,0,0,0,0|2,0,0]=4 424 B12R0.255 NC(=O)CNC(=O)CCCCCO WXVL_AK0147SB2973 [0,2,0,0,0,0|2,0,0]=4 425 B12R0.255 NC(=O)CNC(=O)CCCCCO WXVL_AK0147SB2973 [0,2,0,0,0,0|2,0,0]=4 426 B12R0.47 C/C=C/C=C/C(=O)NCCCCC WXVL_AK0076SB0348 [0,2,0,0,0,0|1,0,1]=4 427 B12R0.47 C/C=C/C=C/C(=O)NCCCCC WXVL_AK0076SB0348 [0,2,0,0,0,0|1,0,1]=4 428 B12R0.47 C=CCCCC(=O)NCCCCC WXVL_AK0076SB2920 [0,2,0,0,0,0|1,0,0]=3 429 B12R0.47 C=CCCCC(=O)NCCCCC WXVL_AK0076SB2920 [0,2,0,0,0,0|1,0,0]=3 430 B12R0.47 C=CCCCC(=O)NCCCCO WXVL_AK0075SB2920 [0,2,0,0,0,0|2,0,0]=4 431 B12R0.47 C=CCCCC(=O)NCCCCO WXVL_AK0075SB2920 [0,2,0,0,0,0|2,0,0]=4 432 B12R0.47 C=CCCCC(=O)NCCCOC WXVL_AK00637SB2920 [0,2,0,0,0,0|2,0,0]=4 433 B12R0.47 C=CCCCC(=O)NCCCOC WXVL_AK00637SB2920 [0,2,0,0,0,0|2,0,0]=4 434 B12R0.47 C=CCCCC(=O)NCCCSC WXVL_AK0965SB2920 [0,2,0,0,0,0|2,0,0]=4 435 B12R0.47 C=CCCCC(=O)NCCCSC WXVL_AK0965SB2920 [0,2,0,0,0,0|2,0,0]=4 436 B12R0.47 C=CCCCC(=O)NCCSCC WXVL_AK00494SB2920 [0,2,0,0,0,0|2,0,0]=4 437 B12R0.47 C=CCCCC(=O)NCCSCC WXVL_AK00494SB2920 [0,2,0,0,0,0|2,0,0]=4 438 B12R0.47 C=CCCNC(=O)CCCCCBr WXVL_AK00138SB2192 [0,2,0,0,0,0|1,0,0]=3 439 B12R0.47 C=CCCNC(=O)CCCCCBr WXVL_AK00138SB2192 [0,2,0,0,0,0|1,0,0]=3 440 B12R0.47 C=CCCNC(=O)CCCCCO WXVL_AK00138SB2973 [0,2,0,0,0,0|1,0,0]=3 441 B12R0.47 C=CCCNC(=O)CCCCCO WXVL_AK00138SB2973 [0,2,0,0,0,0|1,0,0]=3 442 B12R0.47 C=CCCNC(=O)COCCOC WXVL_AK00138SB0159 [0,2,0,0,0,0|2,0,0]=4 443 B12R0.47 C=CCCNC(=O)COCCOC WXVL_AK00138SB0159 [0,2,0,0,0,0|2,0,0]=4 444 B12R0.95 C=CCCC(=O)NCCOC(C)C WXVL_AK0128SB1035 [0,2,0,0,0,0|2,0,0]=4 445 B12R0.95 C=CCCC(=O)NCCOC(C)C WXVL_AK0128SB1035 [0,2,0,0,0,0|2,0,0]=4 446 B12R0.102 C=CCCC(=O)NCCC(C)CO WXVL_AK4143SB1035 [0,2,0,0,0,0|2,0,0]=4 447 B12R0.102 C=CCCC(=O)NCCC(C)CO WXVL_AK4143SB1035 [0,2,0,0,0,0|2,0,0]=4 448 B12R0.113 C=CC(C)NC(=O)CCCCCBr WXVL_AK00769SB2192 [0,2,0,0,0,0|1,0,0]=3 449 B12R0.113 C=CC(C)NC(=O)CCCCCBr WXVL_AK00769SB2192 [0,2,0,0,0,0|1,0,0]=3 450 B12R0.113 C=CC(C)NC(=O)CCCCCO WXVL_AK00769SB2973 [0,2,0,0,0,0|1,0,0]=3 451 B12R0.113 C=CC(C)NC(=O)CCCCCO WXVL_AK00769SB2973 [0,2,0,0,0,0|1,0,0]=3 452 B12R0.113 C=CC(C)NC(=O)COCCOC WXVL_AK00769SB0159 [0,2,0,0,0,0|2,0,0]=4 453 B12R0.113 C=CC(C)NC(=O)COCCOC WXVL_AK00769SB0159 [0,2,0,0,0,0|2,0,0]=4 454 B12R0.206 C#CCCCCNC(=O)CCC=C WXVL_AK00614SB1035 [0,2,0,0,0,0|1,0,1]=4 455 B12R0.206 C#CCCCCNC(=O)CCC=C WXVL_AK00614SB1035 [0,2,0,0,0,0|1,0,1]=4 456 B12R0.206 C=CCCC(=O)NCCCCCC WXVL_AK0286SB1035 [0,2,0,0,0,0|1,0,0]=3 457 B12R0.206 C=CCCC(=O)NCCCCCC WXVL_AK0286SB1035 [0,2,0,0,0,0|1,0,0]=3 458 B12R0.206 C=CCCC(=O)NCCCCCO WXVL_AK0077SB1035 [0,2,0,0,0,0|1,0,0]=3 459 B12R0.206 C=CCCC(=O)NCCCCCO WXVL_AK0077SB1035 [0,2,0,0,0,0|1,0,0]=3 460 B12R0.206 C=CCCC(=O)NCCCOCC WXVL_AK0072SB1035 [0,2,0,0,0,0|1,0,0]=3 461 B12R0.206 C=CCCC(=O)NCCCOCC WXVL_AK0072SB1035 [0,2,0,0,0,0|1,0,0]=3 462 B12R0.206 C=CCCC(=O)NCCNCCO WXVL_AK0954SB1035 [0,2,0,0,0,0|2,0,0]=4 463 B12R0.206 C=CCCC(=O)NCCNCCO WXVL_AK0954SB1035 [0,2,0,0,0,0|2,0,0]=4 464 B12R0.206 C=CCNC(=O)/C=C/CCCCC WXVL_AK00561SB3331 [0,2,0,0,0,0|1,0,0]=3 465 B12R0.206 C=CCNC(=O)/C=C/CCCCC WXVL_AK00561SB3331 [0,2,0,0,0,0|1,0,0]=3 466 B12R0.206 C=CCNC(=O)CCCCCCBr WXVL_AK00561SB1386 [0,2,0,0,0,0|1,0,0]=3 467 B12R0.206 C=CCNC(=O)CCCCCCBr WXVL_AK00561SB1386 [0,2,0,0,0,0|1,0,0]=3 468 B12R0.206 C=CCNC(=O)CCCCCCC WXVL_AK00561SB0393 [0,2,0,0,0,0|1,0,0]=3 469 B12R0.206 C=CCNC(=O)CCCCCCC WXVL_AK00561SB0393 [0,2,0,0,0,0|1,0,0]=3 470 B12R0.233 C=CCCCC(=O)NCCC(C)C WXVL_AK0068SB2920 [0,2,0,0,0,0|2,0,0]=4 471 B12R0.233 C=CCCCC(=O)NCCC(C)C WXVL_AK0068SB2920 [0,2,0,0,0,0|2,0,0]=4 472 B12R0.233 C=CCCNC(=O)CCCC(C)C WXVL_AK00138SB1301 [0,2,0,0,0,0|1,0,0]=3 473 B12R0.233 C=CCCNC(=O)CCCC(C)C WXVL_AK00138SB1301 [0,2,0,0,0,0|1,0,0]=3 474 B12R0.233 C=CCCNC(=O)CCCN(C)C WXVL_AK00138SB00055 [0,2,0,0,0,0|2,0,0]=4 475 B12R0.233 C=CCCNC(=O)CCCN(C)C WXVL_AK00138SB00055 [0,2,0,0,0,0|2,0,0]=4 476 B12R0.233 CCCCNC(=O)CCC=C(C)C WXVL_AK00588SB00030 [0,2,0,0,0,0|2,0,0]=4 477 B12R0.233 CCCCNC(=O)CCC=C(C)C WXVL_AK00588SB00030 [0,2,0,0,0,0|2,0,0]=4 478 B12R0.104 C=CCCC(=O)NCCC(C)(C)O WXVL_AK1558SB1035 [0,2,0,0,0,0|2,0,0]=4 479 B12R0.104 C=CCCC(=O)NCCC(C)(C)O WXVL_AK1558SB1035 [0,2,0,0,0,0|2,0,0]=4 480 B12R0.104 C=CCNC(=O)CCCC(F)(F)F WXVL_AK00561SB1398 [0,2,0,0,0,0|2,0,0]=4 481 B12R0.104 C=CCNC(=O)CCCC(F)(F)F WXVL_AK00561SB1398 [0,2,0,0,0,0|2,0,0]=4 482 B12R0.240 C=CC(C)NC(=O)CCCC(C)C WXVL_AK00769SB1301 [0,2,0,0,0,0|1,0,0]=3 483 B12R0.240 C=CC(C)NC(=O)CCCC(C)C WXVL_AK00769SB1301 [0,2,0,0,0,0|1,0,0]=3 484 B12R0.240 C=CC(C)NC(=O)CCCN(C)C WXVL_AK00769SB00055 [0,2,0,0,0,0|2,0,0]=4 485 B12R0.240 C=CC(C)NC(=O)CCCN(C)C WXVL_AK00769SB00055 [0,2,0,0,0,0|2,0,0]=4 486 B12R0.144 C=C[C@@H](CO)NC(=O)CCCCBr WXVL_AK00581SB3153 [0,2,0,0,0,0|2,0,0]=4 487 B12R0.144 C=C[C@@H](CO)NC(=O)CCCCBr WXVL_AK00581SB3153 [0,2,0,0,0,0|2,0,0]=4 488 B12R0.144 C=C[C@@H](CO)NC(=O)CCCCCl WXVL_AK00581SB0379 [0,2,0,0,0,0|2,0,0]=4 489 B12R0.144 C=C[C@@H](CO)NC(=O)CCCCCl WXVL_AK00581SB0379 [0,2,0,0,0,0|2,0,0]=4 490 B12R0.294 C=CCC(C)(C)C(=O)NCCCC WXVL_AK00588SB0363 [0,2,0,0,0,0|2,0,0]=4 491 B12R0.294 C=CCC(C)(C)C(=O)NCCCC WXVL_AK00588SB0363 [0,2,0,0,0,0|2,0,0]=4 492 B10R1.11 C=CCC(=O)N1CCCC1 WXVL_AN0008SB2732 [1,0,0,1,0,0|1,0,0]=3 493 B10R1.11 C=CCC(=O)N1CCCC1 WXVL_AN0008SB2732 [1,0,0,1,0,0|1,0,0]=3 494 B10R1.11 CCNC(=O)C1CCCC1 WXVL_AK00476SB0043 [1,0,0,1,0,0|1,0,1]=4 495 B10R1.11 CCNC(=O)C1CCCC1 WXVL_AK00476SB0043 [1,0,0,1,0,0|1,0,1]=4 496 B10R1.137 C=CCC(=O)NC1CNC1 WXVL_AK1291SB2732 [1,0,0,1,0,0|2,0,0]=4 497 B10R1.137 C=CCC(=O)NC1CNC1 WXVL_AK1291SB2732 [1,0,0,1,0,0|2,0,0]=4 498 B10R1.137 C=CCC(=O)NC1CSC1 WXVL_AK2089SB2732 [1,0,0,1,0,0|2,0,0]=4 499 B10R1.137 C=CCC(=O)NC1CSC1 WXVL_AK2089SB2732 [1,0,0,1,0,0|2,0,0]=4 500 B10R1.137 CCNC(=O)CC1CCC1 WXVL_AK00476SB2207 [1,0,0,1,0,0|1,0,1]=4 501 B10R1.137 CCNC(=O)CC1CCC1 WXVL_AK00476SB2207 [1,0,0,1,0,0|1,0,1]=4 502 B10R1.138 CCNC(=O)CCC1CC1 WXVL_AK00476SB5360 [1,0,0,1,0,0|1,0,1]=4 503 B10R1.138 CCNC(=O)CCC1CC1 WXVL_AK00476SB5360 [1,0,0,1,0,0|1,0,1]=4 504 B10R1.178 C=CCNC(=O)C1CCC1 WXVL_AK00561SB0042 [1,0,0,1,0,0|1,0,0]=3 505 B10R1.178 C=CCNC(=O)C1CCC1 WXVL_AK00561SB0042 [1,0,0,1,0,0|1,0,0]=3 506 B10R1.180 C=CCCC(=O)NC1CC1 WXVL_AK0001SB1035 [1,0,0,1,0,0|2,0,0]=4 507 B10R1.180 C=CCCC(=O)NC1CC1 WXVL_AK0001SB1035 [1,0,0,1,0,0|2,0,0]=4 508 B10R1.180 C=CCNC(=O)CC1CC1 WXVL_AK00561SB0155 [1,0,0,1,0,0|1,0,0]=3 509 B10R1.180 C=CCNC(=O)CC1CC1 WXVL_AK00561SB0155 [1,0,0,1,0,0|1,0,0]=3 510 B10R1.293 C=CCNC(=O)C1CC1C WXVL_AK00561SB0041 [1,0,0,1,0,0|1,0,0]=3 511 B10R1.293 C=CCNC(=O)C1CC1C WXVL_AK00561SB0041 [1,0,0,1,0,0|1,0,0]=3 512 B10R1.293 C=CCNC(=O)[C@@H]1C[C@@H]1F WXVL_AK00561SB1245 [1,0,0,1,0,0|2,0,0]=4 513 B10R1.293 C=CCNC(=O)[C@@H]1C[C@@H]1F WXVL_AK00561SB1245 [1,0,0,1,0,0|2,0,0]=4 514 B10R1.293 C=CCNC(=O)[C@H]1C[C@H]1F WXVL_AK00561SB00019 [1,0,0,1,0,0|2,0,0]=4 515 B10R1.293 C=CCNC(=O)[C@H]1C[C@H]1F WXVL_AK00561SB00019 [1,0,0,1,0,0|2,0,0]=4 516 B12R1.53 C=CCNC(=O)CC1CCCC1 WXVL_AK00561SB0044 [0,1,0,1,0,0|1,0,0]=3 517 B12R1.53 C=CCNC(=O)CC1CCCC1 WXVL_AK00561SB0044 [0,1,0,1,0,0|1,0,0]=3 518 B12R1.53 C=CCNC(=O)CN1CCCC1 WXVL_AK00561SB0201 [0,1,0,1,0,0|1,0,0]=3 519 B12R1.53 C=CCNC(=O)CN1CCCC1 WXVL_AK00561SB0201 [0,1,0,1,0,0|1,0,0]=3 520 B12R1.460 C=CCCC(=O)N1CCC[C@H]1C WXVL_AN00593SB1035 [0,1,0,1,0,0|1,0,0]=3 521 B12R1.460 C=CCNC(=O)C1CCCC1C WXVL_AK00561SB0904 [0,1,0,1,0,0|1,0,0]=3 522 B12R1.460 C=CCNC(=O)C1CCCC1C WXVL_AK00561SB0904 [0,1,0,1,0,0|1,0,0]=3 523 B12R1.460 C=CCNC(=O)[C@@H]1CCCN1C WXVL_AK00561SB1197 [0,1,0,1,0,0|1,0,0]=3 524 B12R1.460 C=CCNC(=O)[C@@H]1CCCN1C WXVL_AK00561SB1197 [0,1,0,1,0,0|1,0,0]=3 525 B12R1.462 C=CCCC(=O)NC1CC(C1)C WXVL_AK0309SB1035 [0,1,0,1,0,0|2,0,0]=4 526 B12R1.462 C=CCCC(=O)NC1CC(C1)C WXVL_AK0309SB1035 [0,1,0,1,0,0|2,0,0]=4 527 B12R1.462 C=CCCC(=O)NC1CC(C1)F WXVL_AK0307SB1035 [0,1,0,1,0,0|2,0,0]=4 528 B12R1.462 C=CCCC(=O)NC1CC(C1)F WXVL_AK0307SB1035 [0,1,0,1,0,0|2,0,0]=4 529 B12R1.462 C=CCCC(=O)NC1CC(C1)O WXVL_AK0306SB1035 [0,1,0,1,0,0|2,0,0]=4 530 B12R1.462 C=CCCC(=O)NC1CC(C1)O WXVL_AK0306SB1035 [0,1,0,1,0,0|2,0,0]=4 531 B12R1.462 C=CCCC(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB1035 [0,1,0,1,0,0|2,0,0]=4 532 B12R1.462 C=CCCC(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB1035 [0,1,0,1,0,0|2,0,0]=4 533 B12R1.841 C=CCCC(=O)NC(C)C1CC1 WXVL_AK00200SB1035 [0,1,0,1,0,0|2,0,0]=4 534 B12R1.841 C=CCCC(=O)NC(C)C1CC1 WXVL_AK00200SB1035 [0,1,0,1,0,0|2,0,0]=4 535 B12R1.841 C=CCCC(=O)N[C@@H](C)C1CC1 WXVL_AK0484SB1035 [0,1,0,1,0,0|2,0,0]=4 536 B12R1.841 C=CCCC(=O)N[C@@H](C)C1CC1 WXVL_AK0484SB1035 [0,1,0,1,0,0|2,0,0]=4 537 B12R1.2044 C=CCNC(=O)CC1(CCC1)O WXVL_AK00561SB0026 [0,1,0,1,0,0|1,0,0]=3 538 B12R1.2044 C=CCNC(=O)CC1(CCC1)O WXVL_AK00561SB0026 [0,1,0,1,0,0|1,0,0]=3 539 B12R1.29 C=CCCC(=O)N1CCC(C1)Br WXVL_AN00715SB1035 [0,1,0,1,0,0|2,0,0]=4 540 B12R1.29 C=CCCC(=O)N1CCC(C1)C WXVL_AN0556SB1035 [0,1,0,1,0,0|2,0,0]=4 541 B12R1.29 C=CCCC(=O)N1CCC(C1)C WXVL_AN0556SB1035 [0,1,0,1,0,0|2,0,0]=4 542 B12R1.29 C=CCCC(=O)N1CCC(C1)F WXVL_AN00338SB1035 [0,1,0,1,0,0|2,0,0]=4 543 B12R1.29 C=CCCC(=O)N1CCC(C1)F WXVL_AN00338SB1035 [0,1,0,1,0,0|2,0,0]=4 544 B12R1.29 C=CCCC(=O)N1CCC(C1)O WXVL_AN0158SB1035 [0,1,0,1,0,0|2,0,0]=4 545 B12R1.29 C=CCCC(=O)N1CCC(C1)O WXVL_AN0158SB1035 [0,1,0,1,0,0|2,0,0]=4 546 B12R1.29 C=CCCC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB1035 [0,1,0,1,0,0|2,0,0]=4 547 B12R1.29 C=CCCC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB1035 [0,1,0,1,0,0|2,0,0]=4 548 B12R1.29 C=CCCC(=O)N1CC[C@@H](C1)O WXVL_AN00391SB1035 [0,1,0,1,0,0|2,0,0]=4 549 B12R1.29 C=CCCC(=O)N1CC[C@@H](C1)O WXVL_AN00391SB1035 [0,1,0,1,0,0|2,0,0]=4 550 B12R1.29 C=CCCC(=O)N1CC[C@H](C1)C WXVL_AN00488SB1035 [0,1,0,1,0,0|2,0,0]=4 551 B12R1.29 C=CCCC(=O)N1CC[C@H](C1)C WXVL_AN00488SB1035 [0,1,0,1,0,0|2,0,0]=4 552 B12R1.29 C=CCCC(=O)N1CC[C@H](C1)F WXVL_AN00035SB1035 [0,1,0,1,0,0|2,0,0]=4 553 B12R1.29 C=CCCC(=O)N1CC[C@H](C1)F WXVL_AN00035SB1035 [0,1,0,1,0,0|2,0,0]=4 554 B12R1.29 C=CCCC(=O)N1CC[C@H](C1)O WXVL_AN00543SB1035 [0,1,0,1,0,0|2,0,0]=4 555 B12R1.29 C=CCNC(=O)C1CCN(C1)C WXVL_AK00561SB1540 [0,1,0,1,0,0|2,0,0]=4 556 B12R1.29 C=CCNC(=O)C1CCN(C1)C WXVL_AK00561SB1540 [0,1,0,1,0,0|2,0,0]=4 557 B12R1.29 C=CCNC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK00561SB00007 [0,1,0,1,0,0|2,0,0]=4 558 B12R1.29 C=CCNC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK00561SB00007 [0,1,0,1,0,0|2,0,0]=4 559 B12R1.29 C=CCNC(=O)[C@H]1CC[C@H](O1)C WXVL_AK00561SB0853 [0,1,0,1,0,0|1,0,0]=3 560 B12R1.29 C=CCNC(=O)[C@H]1CC[C@H](O1)C WXVL_AK00561SB0853 [0,1,0,1,0,0|1,0,0]=3 561 B12R1.30 C=CCCC(=O)N1CCOCC1 WXVL_AN00478SB1035 [0,1,0,1,0,0|2,0,0]=4 562 B12R1.30 C=CCCC(=O)N1CCOCC1 WXVL_AN00478SB1035 [0,1,0,1,0,0|2,0,0]=4 563 B12R1.30 C=CCCC(=O)N1CCSCC1 WXVL_AN0896SB1035 [0,1,0,1,0,0|2,0,0]=4 564 B12R1.30 C=CCNC(=O)C1CC=CCC1 WXVL_AK00561SB3640 [0,1,0,1,0,0|1,0,1]=4 565 B12R1.30 C=CCNC(=O)C1CC=CCC1 WXVL_AK00561SB3640 [0,1,0,1,0,0|1,0,1]=4 566 B12R1.30 C=CCNC(=O)C1CCCCC1 WXVL_AK00561SB0047 [0,1,0,1,0,0|1,0,0]=3 567 B12R1.30 C=CCNC(=O)C1CCCCC1 WXVL_AK00561SB0047 [0,1,0,1,0,0|1,0,0]=3 568 B12R1.30 C=CCNC(=O)C1CCCCO1 WXVL_AK00561SB0206 [0,1,0,1,0,0|1,0,0]=3 569 B12R1.30 C=CCNC(=O)C1CCCCO1 WXVL_AK00561SB0206 [0,1,0,1,0,0|1,0,0]=3 570 B12R1.30 C=CCNC(=O)C1CCOCC1 WXVL_AK00561SB0149 [0,1,0,1,0,0|1,0,0]=3 571 B12R1.30 C=CCNC(=O)C1CCOCC1 WXVL_AK00561SB0149 [0,1,0,1,0,0|1,0,0]=3 572 B12R1.30 C=CCNC(=O)C1CCSCC1 WXVL_AK00561SB0752 [0,1,0,1,0,0|1,0,0]=3 573 B12R1.30 C=CCNC(=O)C1CCSCC1 WXVL_AK00561SB0752 [0,1,0,1,0,0|1,0,0]=3 574 B12R1.30 C=CCNC(=O)[C@H]1CCCCO1 WXVL_AK00561SB00044 [0,1,0,1,0,0|1,0,0]=3 575 B12R1.30 C=CCNC(=O)[C@H]1CCCCO1 WXVL_AK00561SB00044 [0,1,0,1,0,0|1,0,0]=3 576 B12R1.2022 C=CCNC(=O)C1(CCCC1)C WXVL_AK00561SB0209 [0,1,0,1,0,0|1,0,0]=3 577 B12R1.2022 C=CCNC(=O)C1(CCCC1)C WXVL_AK00561SB0209 [0,1,0,1,0,0|1,0,0]=3 578 B12R1.2022 C=CCNC(=O)[C@]1(CCCN1)C WXVL_AK00561SB00033 [0,1,0,1,0,0|2,0,0]=4 579 B12R1.2022 C=CCNC(=O)[C@]1(CCCN1)C WXVL_AK00561SB00033 [0,1,0,1,0,0|2,0,0]=4 580 B12R1.54 C=C(C)CNC(=O)C1CCCC1 WXVL_AK0761SB0043 [0,1,0,1,0,0|1,0,0]=3 581 B12R1.54 C=C(C)CNC(=O)C1CCCC1 WXVL_AK0761SB0043 [0,1,0,1,0,0|1,0,0]=3 582 B12R1.54 C=C(C)CNC(=O)C1CCCO1 WXVL_AK0761SB1033 [0,1,0,1,0,0|2,0,0]=4 583 B12R1.54 C=C(C)CNC(=O)C1CCCO1 WXVL_AK0761SB1033 [0,1,0,1,0,0|2,0,0]=4 584 B12R1.54 C=C(C)CNC(=O)C1CCCS1 WXVL_AK0761SB0022 [0,1,0,1,0,0|2,0,0]=4 585 B12R1.54 C=C(C)CNC(=O)C1CCCS1 WXVL_AK0761SB0022 [0,1,0,1,0,0|2,0,0]=4 586 B12R1.54 C=C(C)CNC(=O)[C@H]1CCCO1 WXVL_AK0761SB00043 [0,1,0,1,0,0|2,0,0]=4 587 B12R1.54 C=C(C)CNC(=O)[C@H]1CCCO1 WXVL_AK0761SB00043 [0,1,0,1,0,0|2,0,0]=4 588 B12R1.54 NC(=O)CNC(=O)C1CCCC1 WXVL_AK0147SB0043 [0,1,0,1,0,0|2,0,0]=4 589 B12R1.54 NC(=O)CNC(=O)C1CCCC1 WXVL_AK0147SB0043 [0,1,0,1,0,0|2,0,0]=4 590 B12R1.484 C=CCCNC(=O)CCC1CC1 WXVL_AK00138SB5360 [0,1,0,1,0,0|1,0,0]=3 591 B12R1.484 C=CCCNC(=O)CCC1CC1 WXVL_AK00138SB5360 [0,1,0,1,0,0|1,0,0]=3 592 B12R1.486 C=C1CC(C1)C(=O)NCCCC WXVL_AK00588SB0804 [0,1,0,1,0,0|2,0,0]=4 593 B12R1.486 C=C1CC(C1)C(=O)NCCCC WXVL_AK00588SB0804 [0,1,0,1,0,0|2,0,0]=4 594 B12R1.551 C=C(C)CNC(=O)CC1CCC1 WXVL_AK0761SB2207 [0,1,0,1,0,0|1,0,0]=3 595 B12R1.551 C=C(C)CNC(=O)CC1CCC1 WXVL_AK0761SB2207 [0,1,0,1,0,0|1,0,0]=3 596 B12R1.551 NC(=O)CNC(=O)CC1CCC1 WXVL_AK0147SB2207 [0,1,0,1,0,0|2,0,0]=4 597 B12R1.551 NC(=O)CNC(=O)CC1CCC1 WXVL_AK0147SB2207 [0,1,0,1,0,0|2,0,0]=4 598 B12R1.552 C=C(C)CNC(=O)CCC1CC1 WXVL_AK0761SB5360 [0,1,0,1,0,0|1,0,0]=3 599 B12R1.552 C=C(C)CNC(=O)CCC1CC1 WXVL_AK0761SB5360 [0,1,0,1,0,0|1,0,0]=3 600 B12R1.552 NC(=O)CNC(=O)CCC1CC1 WXVL_AK0147SB5360 [0,1,0,1,0,0|2,0,0]=4 601 B12R1.552 NC(=O)CNC(=O)CCC1CC1 WXVL_AK0147SB5360 [0,1,0,1,0,0|2,0,0]=4 602 B12R1.463 C=CCCC(=O)NCC1CCC1 WXVL_AK00492SB1035 [0,1,0,1,0,0|1,0,0]=3 603 B12R1.463 C=CCCC(=O)NCC1CCC1 WXVL_AK00492SB1035 [0,1,0,1,0,0|1,0,0]=3 604 B12R1.463 C=CCCC(=O)NCC1CCO1 WXVL_AK1433SB1035 [0,1,0,1,0,0|2,0,0]=4 605 B12R1.463 C=CCCC(=O)NCC1CCO1 WXVL_AK1433SB1035 [0,1,0,1,0,0|2,0,0]=4 606 B12R1.463 C=CCCC(=O)NCC1COC1 WXVL_AK0186SB1035 [0,1,0,1,0,0|2,0,0]=4 607 B12R1.463 C=CCCC(=O)NCC1COC1 WXVL_AK0186SB1035 [0,1,0,1,0,0|2,0,0]=4 608 B12R1.463 C=CCNC(=O)CCC1CCC1 WXVL_AK00561SB8784 [0,1,0,1,0,0|1,0,0]=3 609 B12R1.463 C=CCNC(=O)CCC1CCC1 WXVL_AK00561SB8784 [0,1,0,1,0,0|1,0,0]=3 610 B12R1.882 C=CCCC(=O)NCC1(CC1)C WXVL_AK00811SB1035 [0,1,0,1,0,0|2,0,0]=4 611 B12R1.882 C=CCCC(=O)NCC1(CC1)C WXVL_AK00811SB1035 [0,1,0,1,0,0|2,0,0]=4 612 B12R1.882 C=CCCC(=O)NCC1(CC1)O WXVL_AK0301SB1035 [0,1,0,1,0,0|2,0,0]=4 613 B12R1.882 C=CCCC(=O)NCC1(CC1)O WXVL_AK0301SB1035 [0,1,0,1,0,0|2,0,0]=4 614 B12R1.461 C=CCCC(=O)N1CC[C@@H]1CO WXVL_AN00694SB1035 [0,1,0,1,0,0|2,0,0]=4 615 B12R1.461 C=CCCC(=O)N1CC[C@H]1CO WXVL_AN3414SB1035 [0,1,0,1,0,0|2,0,0]=4 616 B12R1.461 C=CCCC(=O)N1CC[C@H]1CO WXVL_AN3414SB1035 [0,1,0,1,0,0|2,0,0]=4 617 B12R1.464 C=CCCC(=O)NCCC1CC1 WXVL_AK00594SB1035 [0,1,0,1,0,0|1,0,0]=3 618 B12R1.464 C=CCCC(=O)NCCC1CC1 WXVL_AK00594SB1035 [0,1,0,1,0,0|1,0,0]=3 619 B12R1.35 C=CCCCC(=O)N1CCCC1 WXVL_AN0008SB2920 [0,1,0,1,0,0|2,0,0]=4 620 B12R1.35 C=CCCCC(=O)N1CCCC1 WXVL_AN0008SB2920 [0,1,0,1,0,0|2,0,0]=4 621 B12R1.35 C=CCCNC(=O)C1CCCC1 WXVL_AK00138SB0043 [0,1,0,1,0,0|1,0,0]=3 622 B12R1.35 C=CCCNC(=O)C1CCCC1 WXVL_AK00138SB0043 [0,1,0,1,0,0|1,0,0]=3 623 B12R1.35 C=CCCNC(=O)C1CCCO1 WXVL_AK00138SB1033 [0,1,0,1,0,0|2,0,0]=4 624 B12R1.35 C=CCCNC(=O)C1CCCO1 WXVL_AK00138SB1033 [0,1,0,1,0,0|2,0,0]=4 625 B12R1.35 C=CCCNC(=O)C1CCCS1 WXVL_AK00138SB0022 [0,1,0,1,0,0|2,0,0]=4 626 B12R1.35 C=CCCNC(=O)C1CCCS1 WXVL_AK00138SB0022 [0,1,0,1,0,0|2,0,0]=4 627 B12R1.35 C=CCCNC(=O)[C@H]1CCCO1 WXVL_AK00138SB00043 [0,1,0,1,0,0|2,0,0]=4 628 B12R1.35 C=CCCNC(=O)[C@H]1CCCO1 WXVL_AK00138SB00043 [0,1,0,1,0,0|2,0,0]=4 629 B12R1.35 CCCCNC(=O)c1ccco1 WXVL_AK00588SC0049 [0,1,0,1,0,0|1,0,1]=4 630 B12R1.35 CCCCNC(=O)c1ccco1 WXVL_AK00588SC0049 [0,1,0,1,0,0|1,0,1]=4 631 B12R1.35 CCCCNC(=O)c1ccno1 WXVL_AK00588SC0080 [0,1,0,1,0,0|2,0,0]=4 632 B12R1.35 CCCCNC(=O)c1ccno1 WXVL_AK00588SC0080 [0,1,0,1,0,0|2,0,0]=4 633 B12R1.483 C=CCCNC(=O)CC1CCC1 WXVL_AK00138SB2207 [0,1,0,1,0,0|1,0,0]=3 634 B12R1.483 C=CCCNC(=O)CC1CCC1 WXVL_AK00138SB2207 [0,1,0,1,0,0|1,0,0]=3 635 B12R1.15 C=CC(C)NC(=O)C1CCCC1 WXVL_AK00769SB0043 [0,1,0,1,0,0|1,0,0]=3 636 B12R1.15 C=CC(C)NC(=O)C1CCCC1 WXVL_AK00769SB0043 [0,1,0,1,0,0|1,0,0]=3 637 B12R1.15 C=CC(C)NC(=O)C1CCCO1 WXVL_AK00769SB1033 [0,1,0,1,0,0|2,0,0]=4 638 B12R1.15 C=CC(C)NC(=O)C1CCCO1 WXVL_AK00769SB1033 [0,1,0,1,0,0|2,0,0]=4 639 B12R1.15 C=CC(C)NC(=O)C1CCCS1 WXVL_AK00769SB0022 [0,1,0,1,0,0|2,0,0]=4 640 B12R1.15 C=CC(C)NC(=O)C1CCCS1 WXVL_AK00769SB0022 [0,1,0,1,0,0|2,0,0]=4 641 B12R1.15 C=CC(C)NC(=O)[C@H]1CCCO1 WXVL_AK00769SB00043 [0,1,0,1,0,0|2,0,0]=4 642 B12R1.15 C=CC(C)NC(=O)[C@H]1CCCO1 WXVL_AK00769SB00043 [0,1,0,1,0,0|2,0,0]=4 643 B12R1.304 C=CC(C)NC(=O)CC1CCC1 WXVL_AK00769SB2207 [0,1,0,1,0,0|1,0,0]=3 644 B12R1.304 C=CC(C)NC(=O)CC1CCC1 WXVL_AK00769SB2207 [0,1,0,1,0,0|1,0,0]=3 645 B12R1.305 C=CC(C)NC(=O)CCC1CC1 WXVL_AK00769SB5360 [0,1,0,1,0,0|1,0,0]=3 646 B12R1.305 C=CC(C)NC(=O)CCC1CC1 WXVL_AK00769SB5360 [0,1,0,1,0,0|1,0,0]=3 647 B12R1.832 C=CCNS(=O)(=O)CC1CCC1 WXVL_AK00561HU0422 [0,1,0,1,0,0|2,0,0]=4 648 B12R1.832 C=CCNS(=O)(=O)CC1CCC1 WXVL_AK00561HU0422 [0,1,0,1,0,0|2,0,0]=4