0 B8R0.1 C=CCC(=O)NCCC WXVL_AK00504SB2732 [0,1,0,0,0,0|2,0,1]=4 1 B8R0.1 C=CCC(=O)NCCC WXVL_AK00504SB2732 [0,1,0,0,0,0|2,0,1]=4 2 B8R0.1 C=CCCC(=O)NCC WXVL_AK00476SB1035 [0,1,0,0,0,0|2,0,1]=4 3 B8R0.1 C=CCCC(=O)NCC WXVL_AK00476SB1035 [0,1,0,0,0,0|2,0,1]=4 4 B8R0.1 C=CCNC(=O)CCC WXVL_AK00561SB0073 [0,1,0,0,0,0|2,0,1]=4 5 B8R0.1 C=CCNC(=O)CCC WXVL_AK00561SB0073 [0,1,0,0,0,0|2,0,1]=4 6 B8R0.6 C=CCCCC(=O)NC WXVL_AK00442SB2920 [0,1,0,0,0,0|2,0,1]=4 7 B8R0.6 C=CCCCC(=O)NC WXVL_AK00442SB2920 [0,1,0,0,0,0|2,0,1]=4 8 B8R0.6 C=CCCNC(=O)CC WXVL_AK00138SB0064 [0,1,0,0,0,0|2,0,1]=4 9 B8R0.6 C=CCCNC(=O)CC WXVL_AK00138SB0064 [0,1,0,0,0,0|2,0,1]=4 10 B8R0.7 C#CCCCNC(=O)C WXVL_AK00218SB0150 [0,1,0,0,0,0|1,0,2]=4 11 B8R0.7 C#CCCCNC(=O)C WXVL_AK00218SB0150 [0,1,0,0,0,0|1,0,2]=4 12 B8R0.7 C#CCOCCC(=O)N WXVL_AK0084SBD927 [0,1,0,0,0,0|1,0,2]=4 13 B8R0.7 C#CCOCCC(=O)N WXVL_AK0084SBD927 [0,1,0,0,0,0|1,0,2]=4 14 B8R0.7 CC(=O)NCCCCO WXVL_AK0075SB0150 [0,1,0,0,0,0|2,0,0]=3 15 B8R0.7 CC(=O)NCCCCO WXVL_AK0075SB0150 [0,1,0,0,0,0|2,0,0]=3 16 B8R0.7 CCCCCNC(=O)C WXVL_AK0076SB0150 [0,1,0,0,0,0|1,0,0]=2 17 B8R0.7 CCCCCNC(=O)C WXVL_AK0076SB0150 [0,1,0,0,0,0|1,0,0]=2 18 B8R0.7 CCSCCNC(=O)C WXVL_AK00494SB0150 [0,1,0,0,0,0|2,0,0]=3 19 B8R0.7 CCSCCNC(=O)C WXVL_AK00494SB0150 [0,1,0,0,0,0|2,0,0]=3 20 B8R0.7 COCCCNC(=O)C WXVL_AK00637SB0150 [0,1,0,0,0,0|2,0,0]=3 21 B8R0.7 COCCCNC(=O)C WXVL_AK00637SB0150 [0,1,0,0,0,0|2,0,0]=3 22 B8R0.7 COCCOCC(=O)N WXVL_AK0084SB0159 [0,1,0,0,0,0|2,0,0]=3 23 B8R0.7 COCCOCC(=O)N WXVL_AK0084SB0159 [0,1,0,0,0,0|2,0,0]=3 24 B8R0.7 CSCCCNC(=O)C WXVL_AK0965SB0150 [0,1,0,0,0,0|2,0,0]=3 25 B8R0.7 CSCCCNC(=O)C WXVL_AK0965SB0150 [0,1,0,0,0,0|2,0,0]=3 26 B8R0.7 NC(=O)CCCCCBr WXVL_AK0084SB2192 [0,1,0,0,0,0|1,0,0]=2 27 B8R0.7 NC(=O)CCCCCBr WXVL_AK0084SB2192 [0,1,0,0,0,0|1,0,0]=2 28 B8R0.7 NC(=O)CCCCCO WXVL_AK0084SB2973 [0,1,0,0,0,0|1,0,0]=2 29 B8R0.7 NC(=O)CCCCCO WXVL_AK0084SB2973 [0,1,0,0,0,0|1,0,0]=2 30 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,1,0,0,0,0|0,0,2]=4 31 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,1,0,0,0,0|0,0,2]=4 32 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,1,0,0,0,0|0,0,2]=4 33 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,1,0,0,0,0|0,0,2]=4 34 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,1,0,0,0,0|2,0,0]=4 35 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,1,0,0,0,0|2,0,0]=4 36 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,1,0,0,0,0|0,0,2]=4 37 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,1,0,0,0,0|0,0,2]=4 38 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,1,0,0,0,0|1,0,0]=3 39 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,1,0,0,0,0|1,0,0]=3 40 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,1,0,0,0,0|2,0,0]=4 41 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,1,0,0,0,0|2,0,0]=4 42 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,1,0,0,0,0|1,0,0]=3 43 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,1,0,0,0,0|1,0,0]=3 44 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,1,0,0,0,0|1,0,0]=3 45 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,1,0,0,0,0|1,0,0]=3 46 B9R0.5 C=CCC(=O)NCCCC WXVL_AK00588SB2732 [0,2,0,0,0,0|1,0,1]=4 47 B9R0.5 C=CCC(=O)NCCCC WXVL_AK00588SB2732 [0,2,0,0,0,0|1,0,1]=4 48 B9R0.5 C=CCCCC(=O)NCC WXVL_AK00476SB2920 [0,2,0,0,0,0|1,0,1]=4 49 B9R0.5 C=CCCCC(=O)NCC WXVL_AK00476SB2920 [0,2,0,0,0,0|1,0,1]=4 50 B9R0.5 C=CCCNC(=O)CCC WXVL_AK00138SB0073 [0,2,0,0,0,0|1,0,1]=4 51 B9R0.5 C=CCCNC(=O)CCC WXVL_AK00138SB0073 [0,2,0,0,0,0|1,0,1]=4 52 B9R0.18 C=CCCC(=O)NCCC WXVL_AK00504SB1035 [0,2,0,0,0,0|1,0,1]=4 53 B9R0.18 C=CCCC(=O)NCCC WXVL_AK00504SB1035 [0,2,0,0,0,0|1,0,1]=4 54 B9R0.48 CCCC(=O)NCC(=O)N WXVL_AK0147SB0073 [0,2,0,0,0,0|1,0,1]=4 55 B9R0.48 CCCC(=O)NCC(=O)N WXVL_AK0147SB0073 [0,2,0,0,0,0|1,0,1]=4 56 B9R0.48 CCNC(=O)CCC(=O)C WXVL_AK00476SB0072 [0,2,0,0,0,0|1,0,1]=4 57 B9R0.48 CCNC(=O)CCC(=O)C WXVL_AK00476SB0072 [0,2,0,0,0,0|1,0,1]=4 58 B9R0.48 CCNC(=O)CCC(=O)N WXVL_AK00476SB0358 [0,2,0,0,0,0|1,0,1]=4 59 B9R0.48 CCNC(=O)CCC(=O)N WXVL_AK00476SB0358 [0,2,0,0,0,0|1,0,1]=4 60 B9R0.2 C#CCCCCNC(=O)C WXVL_AK00614SB0150 [0,2,0,0,0,0|0,0,2]=4 61 B9R0.2 C#CCCCCNC(=O)C WXVL_AK00614SB0150 [0,2,0,0,0,0|0,0,2]=4 62 B9R0.2 CC(=O)NCCCCCO WXVL_AK0077SB0150 [0,2,0,0,0,0|1,0,0]=3 63 B9R0.2 CC(=O)NCCCCCO WXVL_AK0077SB0150 [0,2,0,0,0,0|1,0,0]=3 64 B9R0.2 CC(=O)NCCNCCO WXVL_AK0954SB0150 [0,2,0,0,0,0|2,0,0]=4 65 B9R0.2 CC(=O)NCCNCCO WXVL_AK0954SB0150 [0,2,0,0,0,0|2,0,0]=4 66 B9R0.2 CCCCC/C=C/C(=O)N WXVL_AK0084SB3331 [0,2,0,0,0,0|0,0,1]=3 67 B9R0.2 CCCCC/C=C/C(=O)N WXVL_AK0084SB3331 [0,2,0,0,0,0|0,0,1]=3 68 B9R0.2 CCCCCCCC(=O)N WXVL_AK0084SB0393 [0,2,0,0,0,0|0,0,0]=2 69 B9R0.2 CCCCCCCC(=O)N WXVL_AK0084SB0393 [0,2,0,0,0,0|0,0,0]=2 70 B9R0.2 CCCCCCNC(=O)C WXVL_AK0286SB0150 [0,2,0,0,0,0|0,0,0]=2 71 B9R0.2 CCCCCCNC(=O)C WXVL_AK0286SB0150 [0,2,0,0,0,0|0,0,0]=2 72 B9R0.2 CCOCCCNC(=O)C WXVL_AK0072SB0150 [0,2,0,0,0,0|1,0,0]=3 73 B9R0.2 CCOCCCNC(=O)C WXVL_AK0072SB0150 [0,2,0,0,0,0|1,0,0]=3 74 B9R0.2 NC(=O)CCCCCCBr WXVL_AK0084SB1386 [0,2,0,0,0,0|0,0,0]=2 75 B9R0.2 NC(=O)CCCCCCBr WXVL_AK0084SB1386 [0,2,0,0,0,0|0,0,0]=2 76 B9R0.46 C#CC(=O)NCCCCC WXVL_AK0076SB0338 [0,2,0,0,0,0|1,0,0]=3 77 B9R0.46 C#CC(=O)NCCCCC WXVL_AK0076SB0338 [0,2,0,0,0,0|1,0,0]=3 78 B9R0.46 C#CC(=O)NCCCCO WXVL_AK0075SB0338 [0,2,0,0,0,0|2,0,0]=4 79 B9R0.46 C#CC(=O)NCCCCO WXVL_AK0075SB0338 [0,2,0,0,0,0|2,0,0]=4 80 B9R0.46 C#CC(=O)NCCCOC WXVL_AK00637SB0338 [0,2,0,0,0,0|2,0,0]=4 81 B9R0.46 C#CC(=O)NCCCOC WXVL_AK00637SB0338 [0,2,0,0,0,0|2,0,0]=4 82 B9R0.46 C#CC(=O)NCCCSC WXVL_AK0965SB0338 [0,2,0,0,0,0|2,0,0]=4 83 B9R0.46 C#CC(=O)NCCCSC WXVL_AK0965SB0338 [0,2,0,0,0,0|2,0,0]=4 84 B9R0.46 C#CC(=O)NCCSCC WXVL_AK00494SB0338 [0,2,0,0,0,0|2,0,0]=4 85 B9R0.46 C#CC(=O)NCCSCC WXVL_AK00494SB0338 [0,2,0,0,0,0|2,0,0]=4 86 B9R0.46 CCC(=O)NCCCCO WXVL_AK0075SB0064 [0,2,0,0,0,0|2,0,0]=4 87 B9R0.46 CCC(=O)NCCCCO WXVL_AK0075SB0064 [0,2,0,0,0,0|2,0,0]=4 88 B9R0.46 CCC(=O)NCCCOC WXVL_AK00637SB0064 [0,2,0,0,0,0|2,0,0]=4 89 B9R0.46 CCC(=O)NCCCOC WXVL_AK00637SB0064 [0,2,0,0,0,0|2,0,0]=4 90 B9R0.46 CCC(=O)NCCCSC WXVL_AK0965SB0064 [0,2,0,0,0,0|2,0,0]=4 91 B9R0.46 CCC(=O)NCCCSC WXVL_AK0965SB0064 [0,2,0,0,0,0|2,0,0]=4 92 B9R0.46 CCCCCNC(=O)CC WXVL_AK0076SB0064 [0,2,0,0,0,0|1,0,0]=3 93 B9R0.46 CCCCCNC(=O)CC WXVL_AK0076SB0064 [0,2,0,0,0,0|1,0,0]=3 94 B9R0.46 CCCCCNC(=O)CO WXVL_AK0076SB2706 [0,2,0,0,0,0|1,0,0]=3 95 B9R0.46 CCCCCNC(=O)CO WXVL_AK0076SB2706 [0,2,0,0,0,0|1,0,0]=3 96 B9R0.46 CCSCCNC(=O)CC WXVL_AK00494SB0064 [0,2,0,0,0,0|2,0,0]=4 97 B9R0.46 CCSCCNC(=O)CC WXVL_AK00494SB0064 [0,2,0,0,0,0|2,0,0]=4 98 B9R0.46 CCSCCNC(=O)CO WXVL_AK00494SB2706 [0,2,0,0,0,0|2,0,0]=4 99 B9R0.46 CCSCCNC(=O)CO WXVL_AK00494SB2706 [0,2,0,0,0,0|2,0,0]=4 100 B9R0.46 CNC(=O)CCCCCBr WXVL_AK00442SB2192 [0,2,0,0,0,0|1,0,0]=3 101 B9R0.46 CNC(=O)CCCCCBr WXVL_AK00442SB2192 [0,2,0,0,0,0|1,0,0]=3 102 B9R0.46 CNC(=O)CCCCCO WXVL_AK00442SB2973 [0,2,0,0,0,0|1,0,0]=3 103 B9R0.46 CNC(=O)CCCCCO WXVL_AK00442SB2973 [0,2,0,0,0,0|1,0,0]=3 104 B9R0.46 CNC(=O)COCCOC WXVL_AK00442SB0159 [0,2,0,0,0,0|2,0,0]=4 105 B9R0.46 CNC(=O)COCCOC WXVL_AK00442SB0159 [0,2,0,0,0,0|2,0,0]=4 106 B9R0.46 COCCCNC(=O)CO WXVL_AK00637SB2706 [0,2,0,0,0,0|2,0,0]=4 107 B9R0.46 COCCCNC(=O)CO WXVL_AK00637SB2706 [0,2,0,0,0,0|2,0,0]=4 108 B9R0.46 CSCCCNC(=O)CO WXVL_AK0965SB2706 [0,2,0,0,0,0|2,0,0]=4 109 B9R0.46 CSCCCNC(=O)CO WXVL_AK0965SB2706 [0,2,0,0,0,0|2,0,0]=4 110 B9R0.46 O=C(CO)NCCCCO WXVL_AK0075SB2706 [0,2,0,0,0,0|2,0,0]=4 111 B9R0.46 O=C(CO)NCCCCO WXVL_AK0075SB2706 [0,2,0,0,0,0|2,0,0]=4 112 B9R0.1 CC(=O)NCCC(C)CO WXVL_AK4143SB0150 [0,2,0,0,0,0|2,0,0]=4 113 B9R0.1 CC(=O)NCCC(C)CO WXVL_AK4143SB0150 [0,2,0,0,0,0|2,0,0]=4 114 B9R0.1 CCC(=O)NCCC(=O)N WXVL_AK00443SB0064 [0,2,0,0,0,0|1,0,1]=4 115 B9R0.1 CCC(=O)NCCC(=O)N WXVL_AK00443SB0064 [0,2,0,0,0,0|1,0,1]=4 116 B9R0.47 CCCCCC(C)C(=O)N WXVL_AK0084SB0394 [0,2,0,0,0,0|0,0,0]=2 117 B9R0.47 CCCCCC(C)C(=O)N WXVL_AK0084SB0394 [0,2,0,0,0,0|0,0,0]=2 118 B9R0.47 CCCCNC(=O)C(=O)C WXVL_AK00588SB0051 [0,2,0,0,0,0|1,0,1]=4 119 B9R0.47 CCCCNC(=O)C(=O)C WXVL_AK00588SB0051 [0,2,0,0,0,0|1,0,1]=4 120 B9R0.47 CCCCNC(=O)C(=O)N WXVL_AK00588SB0128 [0,2,0,0,0,0|1,0,1]=4 121 B9R0.47 CCCCNC(=O)C(=O)N WXVL_AK00588SB0128 [0,2,0,0,0,0|1,0,1]=4 122 B9R0.55 CC(=O)NCCOC(C)C WXVL_AK0128SB0150 [0,2,0,0,0,0|2,0,0]=4 123 B9R0.55 CC(=O)NCCOC(C)C WXVL_AK0128SB0150 [0,2,0,0,0,0|2,0,0]=4 124 B9R1.6 CC(=O)N1CCOCC1 WXVL_AN00478SB0150 [0,1,0,1,0,0|2,0,0]=4 125 B9R1.6 CC(=O)N1CCOCC1 WXVL_AN00478SB0150 [0,1,0,1,0,0|2,0,0]=4 126 B9R1.6 CC(=O)N1CCSCC1 WXVL_AN0896SB0150 [0,1,0,1,0,0|2,0,0]=4 127 B9R1.6 NC(=O)C1CC=CCC1 WXVL_AK0084SB3640 [0,1,0,1,0,0|0,0,2]=4 128 B9R1.6 NC(=O)C1CC=CCC1 WXVL_AK0084SB3640 [0,1,0,1,0,0|0,0,2]=4 129 B9R1.6 NC(=O)C1CCCCC1 WXVL_AK0084SB0047 [0,1,0,1,0,0|0,0,0]=2 130 B9R1.6 NC(=O)C1CCCCC1 WXVL_AK0084SB0047 [0,1,0,1,0,0|0,0,0]=2 131 B9R1.6 NC(=O)C1CCCCO1 WXVL_AK0084SB0206 [0,1,0,1,0,0|1,0,0]=3 132 B9R1.6 NC(=O)C1CCCCO1 WXVL_AK0084SB0206 [0,1,0,1,0,0|1,0,0]=3 133 B9R1.6 NC(=O)C1CCOCC1 WXVL_AK0084SB0149 [0,1,0,1,0,0|1,0,0]=3 134 B9R1.6 NC(=O)C1CCOCC1 WXVL_AK0084SB0149 [0,1,0,1,0,0|1,0,0]=3 135 B9R1.6 NC(=O)C1CCSCC1 WXVL_AK0084SB0752 [0,1,0,1,0,0|1,0,0]=3 136 B9R1.6 NC(=O)C1CCSCC1 WXVL_AK0084SB0752 [0,1,0,1,0,0|1,0,0]=3 137 B9R1.6 NC(=O)[C@H]1CCCCO1 WXVL_AK0084SB00044 [0,1,0,1,0,0|1,0,0]=3 138 B9R1.6 NC(=O)[C@H]1CCCCO1 WXVL_AK0084SB00044 [0,1,0,1,0,0|1,0,0]=3 139 B9R1.13 NC(=O)CC1CCCC1 WXVL_AK0084SB0044 [0,1,0,1,0,0|0,0,0]=2 140 B9R1.13 NC(=O)CC1CCCC1 WXVL_AK0084SB0044 [0,1,0,1,0,0|0,0,0]=2 141 B9R1.13 NC(=O)CN1CCCC1 WXVL_AK0084SB0201 [0,1,0,1,0,0|1,0,0]=3 142 B9R1.13 NC(=O)CN1CCCC1 WXVL_AK0084SB0201 [0,1,0,1,0,0|1,0,0]=3 143 B9R1.41 CC(=O)N1CCC[C@H]1C WXVL_AN00593SB0150 [0,1,0,1,0,0|1,0,0]=3 144 B9R1.41 CC1CCCC1C(=O)N WXVL_AK0084SB0904 [0,1,0,1,0,0|0,0,0]=2 145 B9R1.41 CC1CCCC1C(=O)N WXVL_AK0084SB0904 [0,1,0,1,0,0|0,0,0]=2 146 B9R1.41 CN1CCC[C@H]1C(=O)N WXVL_AK0084SB1197 [0,1,0,1,0,0|1,0,0]=3 147 B9R1.41 CN1CCC[C@H]1C(=O)N WXVL_AK0084SB1197 [0,1,0,1,0,0|1,0,0]=3 148 B9R1.84 CC(=O)NCC1CCC1 WXVL_AK00492SB0150 [0,1,0,1,0,0|1,0,0]=3 149 B9R1.84 CC(=O)NCC1CCC1 WXVL_AK00492SB0150 [0,1,0,1,0,0|1,0,0]=3 150 B9R1.84 CC(=O)NCC1CCO1 WXVL_AK1433SB0150 [0,1,0,1,0,0|2,0,0]=4 151 B9R1.84 CC(=O)NCC1CCO1 WXVL_AK1433SB0150 [0,1,0,1,0,0|2,0,0]=4 152 B9R1.84 CC(=O)NCC1COC1 WXVL_AK0186SB0150 [0,1,0,1,0,0|2,0,0]=4 153 B9R1.84 CC(=O)NCC1COC1 WXVL_AK0186SB0150 [0,1,0,1,0,0|2,0,0]=4 154 B9R1.84 NC(=O)CCC1CCC1 WXVL_AK0084SB8784 [0,1,0,1,0,0|0,0,0]=2 155 B9R1.84 NC(=O)CCC1CCC1 WXVL_AK0084SB8784 [0,1,0,1,0,0|0,0,0]=2 156 B9R1.85 CC(=O)NCCC1CC1 WXVL_AK00594SB0150 [0,1,0,1,0,0|1,0,0]=3 157 B9R1.85 CC(=O)NCCC1CC1 WXVL_AK00594SB0150 [0,1,0,1,0,0|1,0,0]=3 158 B9R1.96 CC(=O)N1CC[C@@H]1CO WXVL_AN00694SB0150 [0,1,0,1,0,0|2,0,0]=4 159 B9R1.96 CC(=O)N1CC[C@H]1CO WXVL_AN3414SB0150 [0,1,0,1,0,0|2,0,0]=4 160 B9R1.96 CC(=O)N1CC[C@H]1CO WXVL_AN3414SB0150 [0,1,0,1,0,0|2,0,0]=4