0 B8R0.7 C#CCCCNC(=O)C WXVL_AK00218SB0150 [0,0,0,0,0,0|3,0,1]=4 1 B8R0.7 C#CCCCNC(=O)C WXVL_AK00218SB0150 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.7 C#CCOCCC(=O)N WXVL_AK0084SBD927 [0,0,0,0,0,0|3,0,1]=4 3 B8R0.7 C#CCOCCC(=O)N WXVL_AK0084SBD927 [0,0,0,0,0,0|3,0,1]=4 4 B8R0.7 CC(=O)NCCCCO WXVL_AK0075SB0150 [0,0,0,0,0,0|3,0,0]=3 5 B8R0.7 CC(=O)NCCCCO WXVL_AK0075SB0150 [0,0,0,0,0,0|3,0,0]=3 6 B8R0.7 CCCCCNC(=O)C WXVL_AK0076SB0150 [0,0,0,0,0,0|3,0,0]=3 7 B8R0.7 CCCCCNC(=O)C WXVL_AK0076SB0150 [0,0,0,0,0,0|3,0,0]=3 8 B8R0.7 CCSCCNC(=O)C WXVL_AK00494SB0150 [0,0,0,0,0,0|4,0,0]=4 9 B8R0.7 CCSCCNC(=O)C WXVL_AK00494SB0150 [0,0,0,0,0,0|4,0,0]=4 10 B8R0.7 COCCCNC(=O)C WXVL_AK00637SB0150 [0,0,0,0,0,0|4,0,0]=4 11 B8R0.7 COCCCNC(=O)C WXVL_AK00637SB0150 [0,0,0,0,0,0|4,0,0]=4 12 B8R0.7 COCCOCC(=O)N WXVL_AK0084SB0159 [0,0,0,0,0,0|4,0,0]=4 13 B8R0.7 COCCOCC(=O)N WXVL_AK0084SB0159 [0,0,0,0,0,0|4,0,0]=4 14 B8R0.7 CSCCCNC(=O)C WXVL_AK0965SB0150 [0,0,0,0,0,0|4,0,0]=4 15 B8R0.7 CSCCCNC(=O)C WXVL_AK0965SB0150 [0,0,0,0,0,0|4,0,0]=4 16 B8R0.7 NC(=O)CCCCCBr WXVL_AK0084SB2192 [0,0,0,0,0,0|2,0,0]=2 17 B8R0.7 NC(=O)CCCCCBr WXVL_AK0084SB2192 [0,0,0,0,0,0|2,0,0]=2 18 B8R0.7 NC(=O)CCCCCO WXVL_AK0084SB2973 [0,0,0,0,0,0|2,0,0]=2 19 B8R0.7 NC(=O)CCCCCO WXVL_AK0084SB2973 [0,0,0,0,0,0|2,0,0]=2 20 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,0,0,0,0,0|1,0,2]=4 21 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,0,0,0,0,0|1,0,2]=4 22 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,0,0,0,0,0|1,0,2]=4 23 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,0,0,0,0,0|1,0,2]=4 24 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,0,0,0,0,0|3,0,0]=4 25 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,0,0,0,0,0|3,0,0]=4 26 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,0,0,0,0,0|1,0,2]=4 27 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,0,0,0,0,0|1,0,2]=4 28 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,0,0,0,0,0|2,0,0]=3 29 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,0,0,0,0,0|2,0,0]=3 30 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,0,0,0,0,0|3,0,0]=4 31 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,0,0,0,0,0|3,0,0]=4 32 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,0,0,0,0,0|2,0,0]=3 33 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,0,0,0,0,0|2,0,0]=3 34 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,0,0,0,0,0|2,0,0]=3 35 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,0,0,0,0,0|2,0,0]=3 36 B9R0.1 CC(=O)NCCC(C)CO WXVL_AK4143SB0150 [0,1,0,0,0,0|3,0,0]=4 37 B9R0.1 CC(=O)NCCC(C)CO WXVL_AK4143SB0150 [0,1,0,0,0,0|3,0,0]=4 38 B9R0.2 C#CCCCCNC(=O)C WXVL_AK00614SB0150 [0,1,0,0,0,0|2,0,1]=4 39 B9R0.2 C#CCCCCNC(=O)C WXVL_AK00614SB0150 [0,1,0,0,0,0|2,0,1]=4 40 B9R0.2 CC(=O)NCCCCCO WXVL_AK0077SB0150 [0,1,0,0,0,0|2,0,0]=3 41 B9R0.2 CC(=O)NCCCCCO WXVL_AK0077SB0150 [0,1,0,0,0,0|2,0,0]=3 42 B9R0.2 CC(=O)NCCNCCO WXVL_AK0954SB0150 [0,1,0,0,0,0|3,0,0]=4 43 B9R0.2 CC(=O)NCCNCCO WXVL_AK0954SB0150 [0,1,0,0,0,0|3,0,0]=4 44 B9R0.2 CCCCC/C=C/C(=O)N WXVL_AK0084SB3331 [0,1,0,0,0,0|2,0,1]=4 45 B9R0.2 CCCCC/C=C/C(=O)N WXVL_AK0084SB3331 [0,1,0,0,0,0|2,0,1]=4 46 B9R0.2 CCCCCCCC(=O)N WXVL_AK0084SB0393 [0,1,0,0,0,0|2,0,0]=3 47 B9R0.2 CCCCCCCC(=O)N WXVL_AK0084SB0393 [0,1,0,0,0,0|2,0,0]=3 48 B9R0.2 CCCCCCNC(=O)C WXVL_AK0286SB0150 [0,1,0,0,0,0|2,0,0]=3 49 B9R0.2 CCCCCCNC(=O)C WXVL_AK0286SB0150 [0,1,0,0,0,0|2,0,0]=3 50 B9R0.2 CCOCCCNC(=O)C WXVL_AK0072SB0150 [0,1,0,0,0,0|3,0,0]=4 51 B9R0.2 CCOCCCNC(=O)C WXVL_AK0072SB0150 [0,1,0,0,0,0|3,0,0]=4 52 B9R0.2 NC(=O)CCCCCCBr WXVL_AK0084SB1386 [0,1,0,0,0,0|2,0,0]=3 53 B9R0.2 NC(=O)CCCCCCBr WXVL_AK0084SB1386 [0,1,0,0,0,0|2,0,0]=3 54 B9R0.46 C#CC(=O)NCCCCC WXVL_AK0076SB0338 [0,1,0,0,0,0|3,0,0]=4 55 B9R0.46 C#CC(=O)NCCCCC WXVL_AK0076SB0338 [0,1,0,0,0,0|3,0,0]=4 56 B9R0.46 C#CC(=O)NCCCCO WXVL_AK0075SB0338 [0,1,0,0,0,0|3,0,0]=4 57 B9R0.46 C#CC(=O)NCCCCO WXVL_AK0075SB0338 [0,1,0,0,0,0|3,0,0]=4 58 B9R0.46 C#CCCCNC(=O)CO WXVL_AK00218SB2706 [0,1,0,0,0,0|2,0,1]=4 59 B9R0.46 C#CCCCNC(=O)CO WXVL_AK00218SB2706 [0,1,0,0,0,0|2,0,1]=4 60 B9R0.46 CCC(=O)NCCCCO WXVL_AK0075SB0064 [0,1,0,0,0,0|3,0,0]=4 61 B9R0.46 CCC(=O)NCCCCO WXVL_AK0075SB0064 [0,1,0,0,0,0|3,0,0]=4 62 B9R0.46 CCCCCNC(=O)CC WXVL_AK0076SB0064 [0,1,0,0,0,0|3,0,0]=4 63 B9R0.46 CCCCCNC(=O)CC WXVL_AK0076SB0064 [0,1,0,0,0,0|3,0,0]=4 64 B9R0.46 CCCCCNC(=O)CO WXVL_AK0076SB2706 [0,1,0,0,0,0|2,0,0]=3 65 B9R0.46 CCCCCNC(=O)CO WXVL_AK0076SB2706 [0,1,0,0,0,0|2,0,0]=3 66 B9R0.46 CCSCCNC(=O)CO WXVL_AK00494SB2706 [0,1,0,0,0,0|3,0,0]=4 67 B9R0.46 CCSCCNC(=O)CO WXVL_AK00494SB2706 [0,1,0,0,0,0|3,0,0]=4 68 B9R0.46 CNC(=O)CCCCCBr WXVL_AK00442SB2192 [0,1,0,0,0,0|2,0,0]=3 69 B9R0.46 CNC(=O)CCCCCBr WXVL_AK00442SB2192 [0,1,0,0,0,0|2,0,0]=3 70 B9R0.46 CNC(=O)CCCCCO WXVL_AK00442SB2973 [0,1,0,0,0,0|2,0,0]=3 71 B9R0.46 CNC(=O)CCCCCO WXVL_AK00442SB2973 [0,1,0,0,0,0|2,0,0]=3 72 B9R0.46 COCCCNC(=O)CO WXVL_AK00637SB2706 [0,1,0,0,0,0|3,0,0]=4 73 B9R0.46 COCCCNC(=O)CO WXVL_AK00637SB2706 [0,1,0,0,0,0|3,0,0]=4 74 B9R0.46 CSCCCNC(=O)CO WXVL_AK0965SB2706 [0,1,0,0,0,0|3,0,0]=4 75 B9R0.46 CSCCCNC(=O)CO WXVL_AK0965SB2706 [0,1,0,0,0,0|3,0,0]=4 76 B9R0.46 O=C(CO)NCCCCO WXVL_AK0075SB2706 [0,1,0,0,0,0|2,0,0]=3 77 B9R0.46 O=C(CO)NCCCCO WXVL_AK0075SB2706 [0,1,0,0,0,0|2,0,0]=3 78 B9R0.47 CCCCCC(C)C(=O)N WXVL_AK0084SB0394 [0,1,0,0,0,0|2,0,0]=3 79 B9R0.47 CCCCCC(C)C(=O)N WXVL_AK0084SB0394 [0,1,0,0,0,0|2,0,0]=3 80 B9R1.6 NC(=O)C1CCCCC1 WXVL_AK0084SB0047 [0,0,0,1,0,0|2,0,0]=3 81 B9R1.6 NC(=O)C1CCCCC1 WXVL_AK0084SB0047 [0,0,0,1,0,0|2,0,0]=3 82 B9R1.6 NC(=O)C1CCCCO1 WXVL_AK0084SB0206 [0,0,0,1,0,0|2,0,0]=3 83 B9R1.6 NC(=O)C1CCCCO1 WXVL_AK0084SB0206 [0,0,0,1,0,0|2,0,0]=3 84 B9R1.6 NC(=O)C1CCOCC1 WXVL_AK0084SB0149 [0,0,0,1,0,0|3,0,0]=4 85 B9R1.6 NC(=O)C1CCOCC1 WXVL_AK0084SB0149 [0,0,0,1,0,0|3,0,0]=4 86 B9R1.6 NC(=O)C1CCSCC1 WXVL_AK0084SB0752 [0,0,0,1,0,0|3,0,0]=4 87 B9R1.6 NC(=O)C1CCSCC1 WXVL_AK0084SB0752 [0,0,0,1,0,0|3,0,0]=4 88 B9R1.6 NC(=O)[C@H]1CCCCO1 WXVL_AK0084SB00044 [0,0,0,1,0,0|2,0,0]=3 89 B9R1.6 NC(=O)[C@H]1CCCCO1 WXVL_AK0084SB00044 [0,0,0,1,0,0|2,0,0]=3 90 B9R1.13 NC(=O)CC1CCCC1 WXVL_AK0084SB0044 [0,0,0,1,0,0|2,0,0]=3 91 B9R1.13 NC(=O)CC1CCCC1 WXVL_AK0084SB0044 [0,0,0,1,0,0|2,0,0]=3 92 B9R1.13 NC(=O)CN1CCCC1 WXVL_AK0084SB0201 [0,0,0,1,0,0|3,0,0]=4 93 B9R1.13 NC(=O)CN1CCCC1 WXVL_AK0084SB0201 [0,0,0,1,0,0|3,0,0]=4 94 B9R1.41 CC(=O)N1CCC[C@H]1C WXVL_AN00593SB0150 [0,0,0,1,0,0|3,0,0]=4 95 B9R1.41 CC1CCCC1C(=O)N WXVL_AK0084SB0904 [0,0,0,1,0,0|2,0,0]=3 96 B9R1.41 CC1CCCC1C(=O)N WXVL_AK0084SB0904 [0,0,0,1,0,0|2,0,0]=3 97 B9R1.41 CN1CCC[C@H]1C(=O)N WXVL_AK0084SB1197 [0,0,0,1,0,0|3,0,0]=4 98 B9R1.41 CN1CCC[C@H]1C(=O)N WXVL_AK0084SB1197 [0,0,0,1,0,0|3,0,0]=4 99 B9R1.84 CC(=O)NCC1CCC1 WXVL_AK00492SB0150 [0,0,0,1,0,0|3,0,0]=4 100 B9R1.84 CC(=O)NCC1CCC1 WXVL_AK00492SB0150 [0,0,0,1,0,0|3,0,0]=4 101 B9R1.84 CC(=O)NCC1CCO1 WXVL_AK1433SB0150 [0,0,0,1,0,0|3,0,0]=4 102 B9R1.84 CC(=O)NCC1CCO1 WXVL_AK1433SB0150 [0,0,0,1,0,0|3,0,0]=4 103 B9R1.84 NC(=O)CCC1CCC1 WXVL_AK0084SB8784 [0,0,0,1,0,0|2,0,0]=3 104 B9R1.84 NC(=O)CCC1CCC1 WXVL_AK0084SB8784 [0,0,0,1,0,0|2,0,0]=3 105 B9R1.85 CC(=O)NCCC1CC1 WXVL_AK00594SB0150 [0,0,0,1,0,0|3,0,0]=4 106 B9R1.85 CC(=O)NCCC1CC1 WXVL_AK00594SB0150 [0,0,0,1,0,0|3,0,0]=4 107 B9R1.96 CC(=O)N1CC[C@@H]1CO WXVL_AN00694SB0150 [0,0,0,1,0,0|3,0,0]=4 108 B9R1.96 CC(=O)N1CC[C@H]1CO WXVL_AN3414SB0150 [0,0,0,1,0,0|3,0,0]=4 109 B9R1.96 CC(=O)N1CC[C@H]1CO WXVL_AN3414SB0150 [0,0,0,1,0,0|3,0,0]=4 110 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [2,0,0,0,0,0|2,0,0]=4 111 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [2,0,0,0,0,0|2,0,0]=4 112 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [2,0,0,0,0,0|2,0,0]=4 113 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [2,0,0,0,0,0|2,0,0]=4 114 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [2,0,0,0,0,0|2,0,0]=4 115 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [2,0,0,0,0,0|2,0,0]=4 116 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [2,0,0,0,0,0|2,0,0]=4 117 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [2,0,0,0,0,0|2,0,0]=4 118 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [2,0,0,0,0,0|2,0,0]=4 119 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [2,0,0,0,0,0|2,0,0]=4 120 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [1,1,0,0,0,0|2,0,0]=4 121 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [1,1,0,0,0,0|2,0,0]=4 122 B8R0.8 CCCCC(O)C(=O)N WXVL_AK0084SB3429 [1,1,0,0,0,0|1,0,0]=3 123 B8R0.8 CCCCC(O)C(=O)N WXVL_AK0084SB3429 [1,1,0,0,0,0|1,0,0]=3 124 B8R0.28 CC(=O)NCCC(C)C WXVL_AK0068SB0150 [1,1,0,0,0,0|2,0,0]=4 125 B8R0.28 CC(=O)NCCC(C)C WXVL_AK0068SB0150 [1,1,0,0,0,0|2,0,0]=4 126 B8R0.28 CC(C)CCCC(=O)N WXVL_AK0084SB1301 [1,1,0,0,0,0|1,0,0]=3 127 B8R0.28 CC(C)CCCC(=O)N WXVL_AK0084SB1301 [1,1,0,0,0,0|1,0,0]=3 128 B8R0.28 CN(C)CCCC(=O)N WXVL_AK0084SB00055 [1,1,0,0,0,0|2,0,0]=4 129 B8R0.28 CN(C)CCCC(=O)N WXVL_AK0084SB00055 [1,1,0,0,0,0|2,0,0]=4 130 B10R0.3 CC(=O)NCCN(C)CCN WXVL_AK4182SB0150 [0,2,0,0,0,0|2,0,0]=4 131 B10R0.3 CC(=O)NCCN(C)CCN WXVL_AK4182SB0150 [0,2,0,0,0,0|2,0,0]=4 132 B10R0.59 CC(CO)CCNC(=O)CO WXVL_AK4143SB2706 [0,2,0,0,0,0|2,0,0]=4 133 B10R0.59 CC(CO)CCNC(=O)CO WXVL_AK4143SB2706 [0,2,0,0,0,0|2,0,0]=4 134 B10R0.4 CC(=O)NCCCCCCO WXVL_AK0751SB0150 [0,2,0,0,0,0|2,0,0]=4 135 B10R0.4 CC(=O)NCCCCCCO WXVL_AK0751SB0150 [0,2,0,0,0,0|2,0,0]=4 136 B10R0.4 CCCCCCCCC(=O)N WXVL_AK0084SB0409 [0,2,0,0,0,0|2,0,0]=4 137 B10R0.4 CCCCCCCCC(=O)N WXVL_AK0084SB0409 [0,2,0,0,0,0|2,0,0]=4 138 B10R0.4 CCCCOCCNC(=O)C WXVL_AK9674SB0150 [0,2,0,0,0,0|2,0,0]=4 139 B10R0.4 CCCCOCCNC(=O)C WXVL_AK9674SB0150 [0,2,0,0,0,0|2,0,0]=4 140 B10R0.4 NC(=O)CCCCCCCBr WXVL_AK0084SB0559 [0,2,0,0,0,0|2,0,0]=4 141 B10R0.4 NC(=O)CCCCCCCBr WXVL_AK0084SB0559 [0,2,0,0,0,0|2,0,0]=4 142 B10R0.4 NC(=O)CCCCCCCO WXVL_AK0084SB1306 [0,2,0,0,0,0|2,0,0]=4 143 B10R0.4 NC(=O)CCCCCCCO WXVL_AK0084SB1306 [0,2,0,0,0,0|2,0,0]=4 144 B10R0.55 COC(=O)CCCCC(=O)N WXVL_AK0084SB1209 [0,2,0,0,0,0|0,0,1]=3 145 B10R0.55 COC(=O)CCCCC(=O)N WXVL_AK0084SB1209 [0,2,0,0,0,0|0,0,1]=3 146 B10R0.74 C#CC(=O)NCCCCCC WXVL_AK0286SB0338 [0,2,0,0,0,0|2,0,0]=4 147 B10R0.74 C#CC(=O)NCCCCCC WXVL_AK0286SB0338 [0,2,0,0,0,0|2,0,0]=4 148 B10R0.74 C#CC(=O)NCCCCCO WXVL_AK0077SB0338 [0,2,0,0,0,0|2,0,0]=4 149 B10R0.74 C#CC(=O)NCCCCCO WXVL_AK0077SB0338 [0,2,0,0,0,0|2,0,0]=4 150 B10R0.74 C#CCCCCNC(=O)CO WXVL_AK00614SB2706 [0,2,0,0,0,0|1,0,1]=4 151 B10R0.74 C#CCCCCNC(=O)CO WXVL_AK00614SB2706 [0,2,0,0,0,0|1,0,1]=4 152 B10R0.74 CCC(=O)NCCCCCO WXVL_AK0077SB0064 [0,2,0,0,0,0|2,0,0]=4 153 B10R0.74 CCC(=O)NCCCCCO WXVL_AK0077SB0064 [0,2,0,0,0,0|2,0,0]=4 154 B10R0.74 CCCCCCCC(=O)NC WXVL_AK00442SB0393 [0,2,0,0,0,0|2,0,0]=4 155 B10R0.74 CCCCCCCC(=O)NC WXVL_AK00442SB0393 [0,2,0,0,0,0|2,0,0]=4 156 B10R0.74 CCCCCCNC(=O)CC WXVL_AK0286SB0064 [0,2,0,0,0,0|2,0,0]=4 157 B10R0.74 CCCCCCNC(=O)CC WXVL_AK0286SB0064 [0,2,0,0,0,0|2,0,0]=4 158 B10R0.74 CCCCCCNC(=O)CO WXVL_AK0286SB2706 [0,2,0,0,0,0|1,0,0]=3 159 B10R0.74 CCCCCCNC(=O)CO WXVL_AK0286SB2706 [0,2,0,0,0,0|1,0,0]=3 160 B10R0.74 CCOCCCNC(=O)CO WXVL_AK0072SB2706 [0,2,0,0,0,0|2,0,0]=4 161 B10R0.74 CCOCCCNC(=O)CO WXVL_AK0072SB2706 [0,2,0,0,0,0|2,0,0]=4 162 B10R0.74 CNC(=O)CCCCCCBr WXVL_AK00442SB1386 [0,2,0,0,0,0|2,0,0]=4 163 B10R0.74 CNC(=O)CCCCCCBr WXVL_AK00442SB1386 [0,2,0,0,0,0|2,0,0]=4 164 B10R0.74 O=C(CO)NCCCCCO WXVL_AK0077SB2706 [0,2,0,0,0,0|1,0,0]=3 165 B10R0.74 O=C(CO)NCCCCCO WXVL_AK0077SB2706 [0,2,0,0,0,0|1,0,0]=3 166 B10R0.74 O=C(CO)NCCNCCO WXVL_AK0954SB2706 [0,2,0,0,0,0|2,0,0]=4 167 B10R0.74 O=C(CO)NCCNCCO WXVL_AK0954SB2706 [0,2,0,0,0,0|2,0,0]=4 168 B10R0.75 CCCCCNC(=O)[C@@H](C)O WXVL_AK0076SB1085 [0,2,0,0,0,0|2,0,0]=4 169 B10R0.75 CCCCCNC(=O)[C@@H](C)O WXVL_AK0076SB1085 [0,2,0,0,0,0|2,0,0]=4 170 B10R0.75 CN(C)C(=O)CCCCCBr WXVL_AN0032SB2192 [0,2,0,0,0,0|2,0,0]=4 171 B10R0.75 CN(C)C(=O)CCCCCBr WXVL_AN0032SB2192 [0,2,0,0,0,0|2,0,0]=4 172 B10R0.75 CN(C)C(=O)CCCCCO WXVL_AN0032SB2973 [0,2,0,0,0,0|2,0,0]=4 173 B10R0.75 CN(C)C(=O)CCCCCO WXVL_AN0032SB2973 [0,2,0,0,0,0|2,0,0]=4 174 B10R0.75 C[C@@H](O)C(=O)NCCCCO WXVL_AK0075SB1085 [0,2,0,0,0,0|2,0,0]=4 175 B10R0.75 C[C@@H](O)C(=O)NCCCCO WXVL_AK0075SB1085 [0,2,0,0,0,0|2,0,0]=4 176 B10R0.78 CCCCC(C)CCC(=O)N WXVL_AK0084SB1315 [0,2,0,0,0,0|2,0,0]=4 177 B10R0.78 CCCCC(C)CCC(=O)N WXVL_AK0084SB1315 [0,2,0,0,0,0|2,0,0]=4 178 B10R0.97 CC(=O)NCCCCN(C)C WXVL_AK0097SB0150 [0,2,0,0,0,0|2,0,0]=4 179 B10R0.97 CC(=O)NCCCCN(C)C WXVL_AK0097SB0150 [0,2,0,0,0,0|2,0,0]=4 180 B10R0.1 CCCCCNC(=O)COC WXVL_AK0076SB0090 [0,2,0,0,0,0|2,0,0]=4 181 B10R0.1 CCCCCNC(=O)COC WXVL_AK0076SB0090 [0,2,0,0,0,0|2,0,0]=4 182 B10R0.1 CCNC(=O)CCCCCBr WXVL_AK00476SB2192 [0,2,0,0,0,0|2,0,0]=4 183 B10R0.1 CCNC(=O)CCCCCBr WXVL_AK00476SB2192 [0,2,0,0,0,0|2,0,0]=4 184 B10R0.1 CCNC(=O)CCCCCO WXVL_AK00476SB2973 [0,2,0,0,0,0|2,0,0]=4 185 B10R0.1 CCNC(=O)CCCCCO WXVL_AK00476SB2973 [0,2,0,0,0,0|2,0,0]=4 186 B10R0.1 COCC(=O)NCCCCO WXVL_AK0075SB0090 [0,2,0,0,0,0|2,0,0]=4 187 B10R0.1 COCC(=O)NCCCCO WXVL_AK0075SB0090 [0,2,0,0,0,0|2,0,0]=4 188 B10R0.83 CCCCCC(C)C(=O)NC WXVL_AK00442SB0394 [0,2,0,0,0,0|2,0,0]=4 189 B10R0.83 CCCCCC(C)C(=O)NC WXVL_AK00442SB0394 [0,2,0,0,0,0|2,0,0]=4 190 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [1,0,0,1,0,0|2,0,0]=4 191 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [1,0,0,1,0,0|2,0,0]=4 192 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [1,0,0,1,0,0|1,0,0]=3 193 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [1,0,0,1,0,0|1,0,0]=3 194 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [1,0,0,1,0,0|2,0,0]=4 195 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [1,0,0,1,0,0|2,0,0]=4 196 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [1,0,0,1,0,0|2,0,0]=4 197 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [1,0,0,1,0,0|2,0,0]=4 198 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.34 NC(=O)CC1CCC1 WXVL_AK0084SB2207 [1,0,0,1,0,0|1,0,0]=3 201 B8R1.34 NC(=O)CC1CCC1 WXVL_AK0084SB2207 [1,0,0,1,0,0|1,0,0]=3 202 B8R1.35 NC(=O)CCC1CC1 WXVL_AK0084SB5360 [1,0,0,1,0,0|1,0,0]=3 203 B8R1.35 NC(=O)CCC1CC1 WXVL_AK0084SB5360 [1,0,0,1,0,0|1,0,0]=3 204 B10R1.13 NC(=O)C1CCC(CC1)O WXVL_AK0084SB3089 [0,1,0,1,0,0|2,0,0]=4 205 B10R1.13 NC(=O)C1CCC(CC1)O WXVL_AK0084SB3089 [0,1,0,1,0,0|2,0,0]=4 206 B10R1.127 CC(=O)NCCC1CCC1 WXVL_AK2418SB0150 [0,1,0,1,0,0|2,0,0]=4 207 B10R1.127 CC(=O)NCCC1CCC1 WXVL_AK2418SB0150 [0,1,0,1,0,0|2,0,0]=4 208 B10R1.153 O=C(CO)NCCC1CC1 WXVL_AK00594SB2706 [0,1,0,1,0,0|2,0,0]=4 209 B10R1.153 O=C(CO)NCCC1CC1 WXVL_AK00594SB2706 [0,1,0,1,0,0|2,0,0]=4 210 B10R1.18 CC(=O)NC1CCCCC1 WXVL_AK00480SB0150 [0,1,0,1,0,0|2,0,0]=4 211 B10R1.18 CC(=O)NC1CCCCC1 WXVL_AK00480SB0150 [0,1,0,1,0,0|2,0,0]=4 212 B10R1.18 NC(=O)CC1CCCCO1 WXVL_AK0084SB1464 [0,1,0,1,0,0|2,0,0]=4 213 B10R1.18 NC(=O)CC1CCCCO1 WXVL_AK0084SB1464 [0,1,0,1,0,0|2,0,0]=4 214 B10R1.18 NC(=O)CC1CCOCC1 WXVL_AK0084SB0194 [0,1,0,1,0,0|2,0,0]=4 215 B10R1.18 NC(=O)CC1CCOCC1 WXVL_AK0084SB0194 [0,1,0,1,0,0|2,0,0]=4 216 B10R1.18 NC(=O)CC1COCCO1 WXVL_AK0084SB2988 [0,1,0,1,0,0|2,0,0]=4 217 B10R1.18 NC(=O)CC1COCCO1 WXVL_AK0084SB2988 [0,1,0,1,0,0|2,0,0]=4 218 B10R1.18 NC(=O)CN1CCCCC1 WXVL_AK0084SB0186 [0,1,0,1,0,0|2,0,0]=4 219 B10R1.18 NC(=O)CN1CCCCC1 WXVL_AK0084SB0186 [0,1,0,1,0,0|2,0,0]=4 220 B10R1.39 CC(=O)N1CCC[C@H]1CO WXVL_AN0917SB0150 [0,1,0,1,0,0|2,0,0]=4 221 B10R1.61 CC(=O)N1CCCC[C@@H]1C WXVL_AN00851SB0150 [0,1,0,1,0,0|2,0,0]=4 222 B10R1.61 CN1CCCC[C@@H]1C(=O)N WXVL_AK0084SB4055 [0,1,0,1,0,0|1,0,0]=3 223 B10R1.61 CN1CCCC[C@@H]1C(=O)N WXVL_AK0084SB4055 [0,1,0,1,0,0|1,0,0]=3 224 B10R1.66 CC(=O)NCC1CCCC1 WXVL_AK0303SB0150 [0,1,0,1,0,0|2,0,0]=4 225 B10R1.66 CC(=O)NCC1CCCC1 WXVL_AK0303SB0150 [0,1,0,1,0,0|2,0,0]=4 226 B10R1.66 CC(=O)NC[C@@H]1CCCO1 WXVL_AK00754SB0150 [0,1,0,1,0,0|2,0,0]=4 227 B10R1.66 CC(=O)NC[C@@H]1CCCO1 WXVL_AK00754SB0150 [0,1,0,1,0,0|2,0,0]=4 228 B10R1.66 NC(=O)CCC1CCCC1 WXVL_AK0084SB0045 [0,1,0,1,0,0|2,0,0]=4 229 B10R1.66 NC(=O)CCC1CCCC1 WXVL_AK0084SB0045 [0,1,0,1,0,0|2,0,0]=4 230 B10R1.66 NC(=O)CCN1CCCC1 WXVL_AK0084SB0766 [0,1,0,1,0,0|2,0,0]=4 231 B10R1.66 NC(=O)CCN1CCCC1 WXVL_AK0084SB0766 [0,1,0,1,0,0|2,0,0]=4 232 B10R1.66 NC(=O)COC1CCCC1 WXVL_AK0084SB0754 [0,1,0,1,0,0|2,0,0]=4 233 B10R1.66 NC(=O)COC1CCCC1 WXVL_AK0084SB0754 [0,1,0,1,0,0|2,0,0]=4 234 B10R1.348 NC(=O)C1CCCCCC1 WXVL_AK0084SB0385 [0,1,0,1,0,0|2,0,0]=4 235 B10R1.348 NC(=O)C1CCCCCC1 WXVL_AK0084SB0385 [0,1,0,1,0,0|2,0,0]=4 236 B10R1.15 CNC(=O)C1CCCCC1 WXVL_AK00442SB0047 [0,1,0,1,0,0|2,0,0]=4 237 B10R1.15 CNC(=O)C1CCCCC1 WXVL_AK00442SB0047 [0,1,0,1,0,0|2,0,0]=4 238 B10R1.15 CNC(=O)C1CCCCO1 WXVL_AK00442SB0206 [0,1,0,1,0,0|2,0,0]=4 239 B10R1.15 CNC(=O)C1CCCCO1 WXVL_AK00442SB0206 [0,1,0,1,0,0|2,0,0]=4 240 B10R1.15 CNC(=O)[C@H]1CCCCO1 WXVL_AK00442SB00044 [0,1,0,1,0,0|2,0,0]=4 241 B10R1.15 CNC(=O)[C@H]1CCCCO1 WXVL_AK00442SB00044 [0,1,0,1,0,0|2,0,0]=4 242 B10R1.27 CNC(=O)CC1CCCC1 WXVL_AK00442SB0044 [0,1,0,1,0,0|2,0,0]=4 243 B10R1.27 CNC(=O)CC1CCCC1 WXVL_AK00442SB0044 [0,1,0,1,0,0|2,0,0]=4 244 B10R1.149 CNC(=O)C1CCCC1C WXVL_AK00442SB0904 [0,1,0,1,0,0|2,0,0]=4 245 B10R1.149 CNC(=O)C1CCCC1C WXVL_AK00442SB0904 [0,1,0,1,0,0|2,0,0]=4 246 B10R1.149 C[C@@H]1CCCN1C(=O)CO WXVL_AN00593SB2706 [0,1,0,1,0,0|2,0,0]=4 247 B10R1.151 CNC(=O)CCC1CCC1 WXVL_AK00442SB8784 [0,1,0,1,0,0|2,0,0]=4 248 B10R1.151 CNC(=O)CCC1CCC1 WXVL_AK00442SB8784 [0,1,0,1,0,0|2,0,0]=4 249 B10R1.151 O=C(CO)NCC1CCC1 WXVL_AK00492SB2706 [0,1,0,1,0,0|2,0,0]=4 250 B10R1.151 O=C(CO)NCC1CCC1 WXVL_AK00492SB2706 [0,1,0,1,0,0|2,0,0]=4 251 B10R1.151 O=C(CO)NCC1CCO1 WXVL_AK1433SB2706 [0,1,0,1,0,0|2,0,0]=4 252 B10R1.151 O=C(CO)NCC1CCO1 WXVL_AK1433SB2706 [0,1,0,1,0,0|2,0,0]=4 253 B10R1.175 O=C(CO)N1CC[C@@H]1CO WXVL_AN00694SB2706 [0,1,0,1,0,0|2,0,0]=4 254 B10R1.175 O=C(CO)N1CC[C@H]1CO WXVL_AN3414SB2706 [0,1,0,1,0,0|2,0,0]=4 255 B10R1.175 O=C(CO)N1CC[C@H]1CO WXVL_AN3414SB2706 [0,1,0,1,0,0|2,0,0]=4 256 B10R1.113 CC1CCCC(C1)C(=O)N WXVL_AK0084SB5392 [0,1,0,1,0,0|2,0,0]=4 257 B10R1.113 CC1CCCC(C1)C(=O)N WXVL_AK0084SB5392 [0,1,0,1,0,0|2,0,0]=4 258 B10R1.363 CC1(CCCCC1)C(=O)N WXVL_AK0084SB2476 [0,1,0,1,0,0|2,0,0]=4 259 B10R1.363 CC1(CCCCC1)C(=O)N WXVL_AK0084SB2476 [0,1,0,1,0,0|2,0,0]=4 260 B10R2.633 NC(=O)C1CC1C2CC2 WXVL_AK0084SB3548 [0,0,0,2,0,0|2,0,0]=4 261 B10R2.633 NC(=O)C1CC1C2CC2 WXVL_AK0084SB3548 [0,0,0,2,0,0|2,0,0]=4