0 B8R0.6 C#CC(=O)NCCCC WXVL_AK00588SB0338 [0,0,0,0,0,0|1,0,2]=3 1 B8R0.6 C#CC(=O)NCCCC WXVL_AK00588SB0338 [0,0,0,0,0,0|1,0,2]=3 2 B8R0.6 C#CC(=O)NCCCO WXVL_AK0073SB0338 [0,0,0,0,0,0|2,0,2]=4 3 B8R0.6 C#CC(=O)NCCCO WXVL_AK0073SB0338 [0,0,0,0,0,0|2,0,2]=4 4 B8R0.6 C#CC(=O)NCCSC WXVL_AK00440SB0338 [0,0,0,0,0,0|2,0,2]=4 5 B8R0.6 C#CC(=O)NCCSC WXVL_AK00440SB0338 [0,0,0,0,0,0|2,0,2]=4 6 B8R0.6 C#CCCCC(=O)NC WXVL_AK00442SB2709 [0,0,0,0,0,0|1,0,3]=4 7 B8R0.6 C#CCCCC(=O)NC WXVL_AK00442SB2709 [0,0,0,0,0,0|1,0,3]=4 8 B8R0.6 C=CCCCC(=O)NC WXVL_AK00442SB2920 [0,0,0,0,0,0|1,0,3]=4 9 B8R0.6 C=CCCCC(=O)NC WXVL_AK00442SB2920 [0,0,0,0,0,0|1,0,3]=4 10 B8R0.6 CC/C=C/CC(=O)NC WXVL_AK00442SB0349 [0,0,0,0,0,0|1,0,3]=4 11 B8R0.6 CC/C=C/CC(=O)NC WXVL_AK00442SB0349 [0,0,0,0,0,0|1,0,3]=4 12 B8R0.6 CCC(=O)NCCCO WXVL_AK0073SB0064 [0,0,0,0,0,0|2,0,2]=4 13 B8R0.6 CCC(=O)NCCCO WXVL_AK0073SB0064 [0,0,0,0,0,0|2,0,2]=4 14 B8R0.6 CCC(=O)NCCSC WXVL_AK00440SB0064 [0,0,0,0,0,0|2,0,2]=4 15 B8R0.6 CCC(=O)NCCSC WXVL_AK00440SB0064 [0,0,0,0,0,0|2,0,2]=4 16 B8R0.6 CCCCNC(=O)CC WXVL_AK00588SB0064 [0,0,0,0,0,0|1,0,2]=3 17 B8R0.6 CCCCNC(=O)CC WXVL_AK00588SB0064 [0,0,0,0,0,0|1,0,2]=3 18 B8R0.6 CCCCNC(=O)CO WXVL_AK00588SB2706 [0,0,0,0,0,0|2,0,1]=3 19 B8R0.6 CCCCNC(=O)CO WXVL_AK00588SB2706 [0,0,0,0,0,0|2,0,1]=3 20 B8R0.6 CNC(=O)CCCCBr WXVL_AK00442SB3153 [0,0,0,0,0,0|2,0,1]=3 21 B8R0.6 CNC(=O)CCCCBr WXVL_AK00442SB3153 [0,0,0,0,0,0|2,0,1]=3 22 B8R0.6 CNC(=O)CCCCCl WXVL_AK00442SB0379 [0,0,0,0,0,0|2,0,1]=3 23 B8R0.6 CNC(=O)CCCCCl WXVL_AK00442SB0379 [0,0,0,0,0,0|2,0,1]=3 24 B8R0.6 CNC(=O)NCCCCl WXVL_AK00442YV0130 [0,0,0,0,0,0|3,0,1]=4 25 B8R0.6 CNC(=O)NCCCCl WXVL_AK00442YV0130 [0,0,0,0,0,0|3,0,1]=4 26 B8R0.6 CSCCNC(=O)CO WXVL_AK00440SB2706 [0,0,0,0,0,0|3,0,1]=4 27 B8R0.6 CSCCNC(=O)CO WXVL_AK00440SB2706 [0,0,0,0,0,0|3,0,1]=4 28 B8R0.6 O=C(CO)NCCCO WXVL_AK0073SB2706 [0,0,0,0,0,0|3,0,1]=4 29 B8R0.6 O=C(CO)NCCCO WXVL_AK0073SB2706 [0,0,0,0,0,0|3,0,1]=4 30 B7R0.3 C#CC(=O)NCCC WXVL_AK00504SB0338 [1,0,0,0,0,0|1,0,2]=4 31 B7R0.3 C#CC(=O)NCCC WXVL_AK00504SB0338 [1,0,0,0,0,0|1,0,2]=4 32 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [1,0,0,0,0,0|1,0,2]=4 33 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [1,0,0,0,0,0|1,0,2]=4 34 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [1,0,0,0,0,0|2,0,1]=4 35 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [1,0,0,0,0,0|2,0,1]=4 36 B7R0.3 CCOCC(=O)NC WXVL_AK00442SB0091 [1,0,0,0,0,0|2,0,1]=4 37 B7R0.3 CCOCC(=O)NC WXVL_AK00442SB0091 [1,0,0,0,0,0|2,0,1]=4 38 B7R0.3 CCSCC(=O)NC WXVL_AK00442SB0002 [1,0,0,0,0,0|2,0,1]=4 39 B7R0.3 CCSCC(=O)NC WXVL_AK00442SB0002 [1,0,0,0,0,0|2,0,1]=4 40 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [1,0,0,0,0,0|2,0,1]=4 41 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [1,0,0,0,0,0|2,0,1]=4 42 B7R0.3 CNC(=O)CCSC WXVL_AK00442SB0361 [1,0,0,0,0,0|2,0,1]=4 43 B7R0.3 CNC(=O)CCSC WXVL_AK00442SB0361 [1,0,0,0,0,0|2,0,1]=4 44 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,0,0,0,0,0|1,0,2]=4 45 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,0,0,0,0,0|1,0,2]=4 46 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,0,0,0,0,0|1,0,2]=4 47 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,0,0,0,0,0|1,0,2]=4 48 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,0,0,0,0,0|2,0,1]=4 49 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,0,0,0,0,0|2,0,1]=4 50 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,0,0,0,0,0|1,0,2]=4 51 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,0,0,0,0,0|1,0,2]=4 52 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,0,0,0,0,0|1,0,1]=3 53 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,0,0,0,0,0|1,0,1]=3 54 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,0,0,0,0,0|2,0,1]=4 55 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,0,0,0,0,0|2,0,1]=4 56 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,0,0,0,0,0|2,0,0]=3 57 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,0,0,0,0,0|2,0,0]=3 58 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,0,0,0,0,0|2,0,0]=3 59 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,0,0,0,0,0|2,0,0]=3 60 B9R0.1 C#CC(=O)NCCC(C)C WXVL_AK0068SB0338 [0,1,0,0,0,0|1,0,2]=4 61 B9R0.1 C#CC(=O)NCCC(C)C WXVL_AK0068SB0338 [0,1,0,0,0,0|1,0,2]=4 62 B9R0.1 CC(C)CCNC(=O)CO WXVL_AK0068SB2706 [0,1,0,0,0,0|2,0,1]=4 63 B9R0.1 CC(C)CCNC(=O)CO WXVL_AK0068SB2706 [0,1,0,0,0,0|2,0,1]=4 64 B9R0.1 CCC(=O)NCCC(C)C WXVL_AK0068SB0064 [0,1,0,0,0,0|1,0,2]=4 65 B9R0.1 CCC(=O)NCCC(C)C WXVL_AK0068SB0064 [0,1,0,0,0,0|1,0,2]=4 66 B9R0.1 CNC(=O)CCCC(C)C WXVL_AK00442SB1301 [0,1,0,0,0,0|1,0,1]=3 67 B9R0.1 CNC(=O)CCCC(C)C WXVL_AK00442SB1301 [0,1,0,0,0,0|1,0,1]=3 68 B9R0.1 CNC(=O)CCCN(C)C WXVL_AK00442SB00055 [0,1,0,0,0,0|2,0,1]=4 69 B9R0.1 CNC(=O)CCCN(C)C WXVL_AK00442SB00055 [0,1,0,0,0,0|2,0,1]=4 70 B9R0.5 C#CCC(=O)NCCCC WXVL_AK00588SB3070 [0,1,0,0,0,0|1,0,2]=4 71 B9R0.5 C#CCC(=O)NCCCC WXVL_AK00588SB3070 [0,1,0,0,0,0|1,0,2]=4 72 B9R0.5 C#CCCNC(=O)/C=C/C WXVL_AK3109SB0340 [0,1,0,0,0,0|1,0,2]=4 73 B9R0.5 C#CCCNC(=O)/C=C/C WXVL_AK3109SB0340 [0,1,0,0,0,0|1,0,2]=4 74 B9R0.5 C#CCCNC(=O)CC=C WXVL_AK3109SB2732 [0,1,0,0,0,0|1,0,2]=4 75 B9R0.5 C#CCCNC(=O)CC=C WXVL_AK3109SB2732 [0,1,0,0,0,0|1,0,2]=4 76 B9R0.5 C/C=C/C(=O)NCCC#N WXVL_AK0087SB0340 [0,1,0,0,0,0|2,0,1]=4 77 B9R0.5 C/C=C/C(=O)NCCC#N WXVL_AK0087SB0340 [0,1,0,0,0,0|2,0,1]=4 78 B9R0.5 C/C=C/C(=O)NCCCC WXVL_AK00588SB0340 [0,1,0,0,0,0|1,0,0]=2 79 B9R0.5 C/C=C/C(=O)NCCCC WXVL_AK00588SB0340 [0,1,0,0,0,0|1,0,0]=2 80 B9R0.5 C/C=C/C(=O)NCCCO WXVL_AK0073SB0340 [0,1,0,0,0,0|2,0,0]=3 81 B9R0.5 C/C=C/C(=O)NCCCO WXVL_AK0073SB0340 [0,1,0,0,0,0|2,0,0]=3 82 B9R0.5 C/C=C/C(=O)NCCSC WXVL_AK00440SB0340 [0,1,0,0,0,0|2,0,0]=3 83 B9R0.5 C/C=C/C(=O)NCCSC WXVL_AK00440SB0340 [0,1,0,0,0,0|2,0,0]=3 84 B9R0.5 C=CCC(=O)NCCC#N WXVL_AK0087SB2732 [0,1,0,0,0,0|2,0,1]=4 85 B9R0.5 C=CCC(=O)NCCC#N WXVL_AK0087SB2732 [0,1,0,0,0,0|2,0,1]=4 86 B9R0.5 C=CCC(=O)NCCCC WXVL_AK00588SB2732 [0,1,0,0,0,0|1,0,0]=2 87 B9R0.5 C=CCC(=O)NCCCC WXVL_AK00588SB2732 [0,1,0,0,0,0|1,0,0]=2 88 B9R0.5 C=CCC(=O)NCCCO WXVL_AK0073SB2732 [0,1,0,0,0,0|2,0,0]=3 89 B9R0.5 C=CCC(=O)NCCCO WXVL_AK0073SB2732 [0,1,0,0,0,0|2,0,0]=3 90 B9R0.5 C=CCC(=O)NCCSC WXVL_AK00440SB2732 [0,1,0,0,0,0|2,0,0]=3 91 B9R0.5 C=CCC(=O)NCCSC WXVL_AK00440SB2732 [0,1,0,0,0,0|2,0,0]=3 92 B9R0.5 C=CCCNC(=O)/C=C/C WXVL_AK00138SB0340 [0,1,0,0,0,0|1,0,2]=4 93 B9R0.5 C=CCCNC(=O)/C=C/C WXVL_AK00138SB0340 [0,1,0,0,0,0|1,0,2]=4 94 B9R0.5 C=CCCNC(=O)CC=C WXVL_AK00138SB2732 [0,1,0,0,0,0|1,0,2]=4 95 B9R0.5 C=CCCNC(=O)CC=C WXVL_AK00138SB2732 [0,1,0,0,0,0|1,0,2]=4 96 B9R0.5 CC#CC(=O)NCCCC WXVL_AK00588SB1240 [0,1,0,0,0,0|1,0,2]=4 97 B9R0.5 CC#CC(=O)NCCCC WXVL_AK00588SB1240 [0,1,0,0,0,0|1,0,2]=4 98 B9R0.5 CCCCNC(=O)CC#N WXVL_AK00588SB0057 [0,1,0,0,0,0|1,0,2]=4 99 B9R0.5 CCCCNC(=O)CC#N WXVL_AK00588SB0057 [0,1,0,0,0,0|1,0,2]=4 100 B9R0.5 CCCCNC(=O)CCC WXVL_AK00588SB0073 [0,1,0,0,0,0|1,0,2]=4 101 B9R0.5 CCCCNC(=O)CCC WXVL_AK00588SB0073 [0,1,0,0,0,0|1,0,2]=4 102 B9R0.5 CCCCNC(=O)COC WXVL_AK00588SB0090 [0,1,0,0,0,0|1,0,2]=4 103 B9R0.5 CCCCNC(=O)COC WXVL_AK00588SB0090 [0,1,0,0,0,0|1,0,2]=4 104 B9R0.5 CCCCNC(=O)CSC WXVL_AK00588SB1267 [0,1,0,0,0,0|1,0,2]=4 105 B9R0.5 CCCCNC(=O)CSC WXVL_AK00588SB1267 [0,1,0,0,0,0|1,0,2]=4 106 B9R0.5 CCNC(=O)CCCCBr WXVL_AK00476SB3153 [0,1,0,0,0,0|1,0,2]=4 107 B9R0.5 CCNC(=O)CCCCBr WXVL_AK00476SB3153 [0,1,0,0,0,0|1,0,2]=4 108 B9R0.5 CCNC(=O)CCCCCl WXVL_AK00476SB0379 [0,1,0,0,0,0|1,0,2]=4 109 B9R0.5 CCNC(=O)CCCCCl WXVL_AK00476SB0379 [0,1,0,0,0,0|1,0,2]=4 110 B9R0.8 CCCCC(O)C(=O)NC WXVL_AK00442SB3429 [0,1,0,0,0,0|1,0,1]=3 111 B9R0.8 CCCCC(O)C(=O)NC WXVL_AK00442SB3429 [0,1,0,0,0,0|1,0,1]=3 112 B9R0.24 C=CC(=O)NCC(=O)NC WXVL_AK00442SB9931 [0,1,0,0,0,0|2,0,1]=4 113 B9R0.24 C=CC(=O)NCC(=O)NC WXVL_AK00442SB9931 [0,1,0,0,0,0|2,0,1]=4 114 B9R0.34 C#CC(=O)N[C@@H](C)CCC WXVL_AK00682SB0338 [0,1,0,0,0,0|1,0,2]=4 115 B9R0.34 C#CC(=O)N[C@@H](C)CCC WXVL_AK00682SB0338 [0,1,0,0,0,0|1,0,2]=4 116 B9R0.34 CCC[C@H](C)NC(=O)CC WXVL_AK00682SB0064 [0,1,0,0,0,0|1,0,2]=4 117 B9R0.34 CCC[C@H](C)NC(=O)CC WXVL_AK00682SB0064 [0,1,0,0,0,0|1,0,2]=4 118 B9R0.34 CCC[C@H](C)NC(=O)CO WXVL_AK00682SB2706 [0,1,0,0,0,0|2,0,1]=4 119 B9R0.34 CCC[C@H](C)NC(=O)CO WXVL_AK00682SB2706 [0,1,0,0,0,0|2,0,1]=4 120 B9R0.46 C#CC(=O)NCCCCC WXVL_AK0076SB0338 [0,1,0,0,0,0|0,0,2]=3 121 B9R0.46 C#CC(=O)NCCCCC WXVL_AK0076SB0338 [0,1,0,0,0,0|0,0,2]=3 122 B9R0.46 C#CC(=O)NCCCCO WXVL_AK0075SB0338 [0,1,0,0,0,0|1,0,2]=4 123 B9R0.46 C#CC(=O)NCCCCO WXVL_AK0075SB0338 [0,1,0,0,0,0|1,0,2]=4 124 B9R0.46 C#CC(=O)NCCCOC WXVL_AK00637SB0338 [0,1,0,0,0,0|1,0,2]=4 125 B9R0.46 C#CC(=O)NCCCOC WXVL_AK00637SB0338 [0,1,0,0,0,0|1,0,2]=4 126 B9R0.46 C#CC(=O)NCCCSC WXVL_AK0965SB0338 [0,1,0,0,0,0|1,0,2]=4 127 B9R0.46 C#CC(=O)NCCCSC WXVL_AK0965SB0338 [0,1,0,0,0,0|1,0,2]=4 128 B9R0.46 C#CC(=O)NCCSCC WXVL_AK00494SB0338 [0,1,0,0,0,0|1,0,2]=4 129 B9R0.46 C#CC(=O)NCCSCC WXVL_AK00494SB0338 [0,1,0,0,0,0|1,0,2]=4 130 B9R0.46 CCC(=O)NCCCCO WXVL_AK0075SB0064 [0,1,0,0,0,0|1,0,2]=4 131 B9R0.46 CCC(=O)NCCCCO WXVL_AK0075SB0064 [0,1,0,0,0,0|1,0,2]=4 132 B9R0.46 CCC(=O)NCCCOC WXVL_AK00637SB0064 [0,1,0,0,0,0|1,0,2]=4 133 B9R0.46 CCC(=O)NCCCOC WXVL_AK00637SB0064 [0,1,0,0,0,0|1,0,2]=4 134 B9R0.46 CCC(=O)NCCCSC WXVL_AK0965SB0064 [0,1,0,0,0,0|1,0,2]=4 135 B9R0.46 CCC(=O)NCCCSC WXVL_AK0965SB0064 [0,1,0,0,0,0|1,0,2]=4 136 B9R0.46 CCCCCNC(=O)CC WXVL_AK0076SB0064 [0,1,0,0,0,0|0,0,2]=3 137 B9R0.46 CCCCCNC(=O)CC WXVL_AK0076SB0064 [0,1,0,0,0,0|0,0,2]=3 138 B9R0.46 CCCCCNC(=O)CO WXVL_AK0076SB2706 [0,1,0,0,0,0|1,0,1]=3 139 B9R0.46 CCCCCNC(=O)CO WXVL_AK0076SB2706 [0,1,0,0,0,0|1,0,1]=3 140 B9R0.46 CCSCCNC(=O)CC WXVL_AK00494SB0064 [0,1,0,0,0,0|1,0,2]=4 141 B9R0.46 CCSCCNC(=O)CC WXVL_AK00494SB0064 [0,1,0,0,0,0|1,0,2]=4 142 B9R0.46 CCSCCNC(=O)CO WXVL_AK00494SB2706 [0,1,0,0,0,0|2,0,1]=4 143 B9R0.46 CCSCCNC(=O)CO WXVL_AK00494SB2706 [0,1,0,0,0,0|2,0,1]=4 144 B9R0.46 CNC(=O)CCCCCBr WXVL_AK00442SB2192 [0,1,0,0,0,0|1,0,1]=3 145 B9R0.46 CNC(=O)CCCCCBr WXVL_AK00442SB2192 [0,1,0,0,0,0|1,0,1]=3 146 B9R0.46 CNC(=O)CCCCCO WXVL_AK00442SB2973 [0,1,0,0,0,0|1,0,1]=3 147 B9R0.46 CNC(=O)CCCCCO WXVL_AK00442SB2973 [0,1,0,0,0,0|1,0,1]=3 148 B9R0.46 CNC(=O)COCCOC WXVL_AK00442SB0159 [0,1,0,0,0,0|2,0,1]=4 149 B9R0.46 CNC(=O)COCCOC WXVL_AK00442SB0159 [0,1,0,0,0,0|2,0,1]=4 150 B9R0.46 COCCCNC(=O)CO WXVL_AK00637SB2706 [0,1,0,0,0,0|2,0,1]=4 151 B9R0.46 COCCCNC(=O)CO WXVL_AK00637SB2706 [0,1,0,0,0,0|2,0,1]=4 152 B9R0.46 CSCCCNC(=O)CO WXVL_AK0965SB2706 [0,1,0,0,0,0|2,0,1]=4 153 B9R0.46 CSCCCNC(=O)CO WXVL_AK0965SB2706 [0,1,0,0,0,0|2,0,1]=4 154 B9R0.46 O=C(CO)NCCCCO WXVL_AK0075SB2706 [0,1,0,0,0,0|2,0,1]=4 155 B9R0.46 O=C(CO)NCCCCO WXVL_AK0075SB2706 [0,1,0,0,0,0|2,0,1]=4 156 B9R0.47 C#CCCNC(=O)C(=C)F WXVL_AK3109SB1376 [0,1,0,0,0,0|1,0,2]=4 157 B9R0.47 C#CCCNC(=O)C(=C)F WXVL_AK3109SB1376 [0,1,0,0,0,0|1,0,2]=4 158 B9R0.47 C=C(F)C(=O)NCCC#N WXVL_AK0087SB1376 [0,1,0,0,0,0|2,0,1]=4 159 B9R0.47 C=C(F)C(=O)NCCC#N WXVL_AK0087SB1376 [0,1,0,0,0,0|2,0,1]=4 160 B9R0.47 C=C(F)C(=O)NCCCC WXVL_AK00588SB1376 [0,1,0,0,0,0|1,0,0]=2 161 B9R0.47 C=C(F)C(=O)NCCCC WXVL_AK00588SB1376 [0,1,0,0,0,0|1,0,0]=2 162 B9R0.47 C=C(F)C(=O)NCCCO WXVL_AK0073SB1376 [0,1,0,0,0,0|2,0,0]=3 163 B9R0.47 C=C(F)C(=O)NCCCO WXVL_AK0073SB1376 [0,1,0,0,0,0|2,0,0]=3 164 B9R0.47 C=C(F)C(=O)NCCSC WXVL_AK00440SB1376 [0,1,0,0,0,0|2,0,0]=3 165 B9R0.47 C=C(F)C(=O)NCCSC WXVL_AK00440SB1376 [0,1,0,0,0,0|2,0,0]=3 166 B9R0.47 C=CCCNC(=O)C(=C)F WXVL_AK00138SB1376 [0,1,0,0,0,0|1,0,2]=4 167 B9R0.47 C=CCCNC(=O)C(=C)F WXVL_AK00138SB1376 [0,1,0,0,0,0|1,0,2]=4 168 B9R0.47 CC(=O)C(=O)NCCCO WXVL_AK0073SB0051 [0,1,0,0,0,0|2,0,1]=4 169 B9R0.47 CC(=O)C(=O)NCCCO WXVL_AK0073SB0051 [0,1,0,0,0,0|2,0,1]=4 170 B9R0.47 CCCCCC(C)C(=O)N WXVL_AK0084SB0394 [0,1,0,0,0,0|2,0,1]=4 171 B9R0.47 CCCCCC(C)C(=O)N WXVL_AK0084SB0394 [0,1,0,0,0,0|2,0,1]=4 172 B9R0.47 CCCCNC(=O)C(=O)C WXVL_AK00588SB0051 [0,1,0,0,0,0|1,0,1]=3 173 B9R0.47 CCCCNC(=O)C(=O)C WXVL_AK00588SB0051 [0,1,0,0,0,0|1,0,1]=3 174 B9R0.47 CCCCNC(=O)C(=O)N WXVL_AK00588SB0128 [0,1,0,0,0,0|2,0,0]=3 175 B9R0.47 CCCCNC(=O)C(=O)N WXVL_AK00588SB0128 [0,1,0,0,0,0|2,0,0]=3 176 B9R0.47 CCCCNC(=O)C(C)C WXVL_AK00588SB0052 [0,1,0,0,0,0|1,0,2]=4 177 B9R0.47 CCCCNC(=O)C(C)C WXVL_AK00588SB0052 [0,1,0,0,0,0|1,0,2]=4 178 B9R0.47 CCCCNC(=O)C(C)S WXVL_AK00588SB2708 [0,1,0,0,0,0|1,0,2]=4 179 B9R0.47 CCCCNC(=O)C(C)S WXVL_AK00588SB2708 [0,1,0,0,0,0|1,0,2]=4 180 B9R0.47 CCCCNC(=O)C(F)F WXVL_AK00588SB0079 [0,1,0,0,0,0|2,0,1]=4 181 B9R0.47 CCCCNC(=O)C(F)F WXVL_AK00588SB0079 [0,1,0,0,0,0|2,0,1]=4 182 B9R0.47 CCCCNC(=O)[C@@H](C)O WXVL_AK00588SB1085 [0,1,0,0,0,0|1,0,2]=4 183 B9R0.47 CCCCNC(=O)[C@@H](C)O WXVL_AK00588SB1085 [0,1,0,0,0,0|1,0,2]=4 184 B9R0.47 CN(C)C(=O)CCCCBr WXVL_AN0032SB3153 [0,1,0,0,0,0|2,0,1]=4 185 B9R0.47 CN(C)C(=O)CCCCBr WXVL_AN0032SB3153 [0,1,0,0,0,0|2,0,1]=4 186 B9R0.47 CN(C)C(=O)CCCCCl WXVL_AN0032SB0379 [0,1,0,0,0,0|2,0,1]=4 187 B9R0.47 CN(C)C(=O)CCCCCl WXVL_AN0032SB0379 [0,1,0,0,0,0|2,0,1]=4 188 B9R0.47 CSCCNC(=O)C(=O)C WXVL_AK00440SB0051 [0,1,0,0,0,0|2,0,1]=4 189 B9R0.47 CSCCNC(=O)C(=O)C WXVL_AK00440SB0051 [0,1,0,0,0,0|2,0,1]=4 190 B9R0.47 CSCCNC(=O)C(=O)N WXVL_AK00440SB0128 [0,1,0,0,0,0|3,0,0]=4 191 B9R0.47 CSCCNC(=O)C(=O)N WXVL_AK00440SB0128 [0,1,0,0,0,0|3,0,0]=4 192 B9R0.47 NC(=O)C(=O)NCCCO WXVL_AK0073SB0128 [0,1,0,0,0,0|3,0,0]=4 193 B9R0.47 NC(=O)C(=O)NCCCO WXVL_AK0073SB0128 [0,1,0,0,0,0|3,0,0]=4 194 B9R1.11 C#CC(=O)N1CCCC1 WXVL_AN0008SB0338 [0,0,0,1,0,0|1,0,2]=4 195 B9R1.11 C#CC(=O)N1CCCC1 WXVL_AN0008SB0338 [0,0,0,1,0,0|1,0,2]=4 196 B9R1.11 CCC(=O)N1CCCC1 WXVL_AN0008SB0064 [0,0,0,1,0,0|1,0,2]=4 197 B9R1.11 CCC(=O)N1CCCC1 WXVL_AN0008SB0064 [0,0,0,1,0,0|1,0,2]=4 198 B9R1.11 CNC(=O)C1CCCC1 WXVL_AK00442SB0043 [0,0,0,1,0,0|1,0,1]=3 199 B9R1.11 CNC(=O)C1CCCC1 WXVL_AK00442SB0043 [0,0,0,1,0,0|1,0,1]=3 200 B9R1.11 CNC(=O)C1CCCO1 WXVL_AK00442SB1033 [0,0,0,1,0,0|2,0,1]=4 201 B9R1.11 CNC(=O)C1CCCO1 WXVL_AK00442SB1033 [0,0,0,1,0,0|2,0,1]=4 202 B9R1.11 CNC(=O)C1CCCS1 WXVL_AK00442SB0022 [0,0,0,1,0,0|2,0,1]=4 203 B9R1.11 CNC(=O)C1CCCS1 WXVL_AK00442SB0022 [0,0,0,1,0,0|2,0,1]=4 204 B9R1.11 CNC(=O)[C@H]1CCCO1 WXVL_AK00442SB00043 [0,0,0,1,0,0|2,0,1]=4 205 B9R1.11 CNC(=O)[C@H]1CCCO1 WXVL_AK00442SB00043 [0,0,0,1,0,0|2,0,1]=4 206 B9R1.11 O=C(CO)N1CCCC1 WXVL_AN0008SB2706 [0,0,0,1,0,0|2,0,1]=4 207 B9R1.11 O=C(CO)N1CCCC1 WXVL_AN0008SB2706 [0,0,0,1,0,0|2,0,1]=4 208 B9R1.79 CNC(=O)CC1CCC1 WXVL_AK00442SB2207 [0,0,0,1,0,0|1,0,1]=3 209 B9R1.79 CNC(=O)CC1CCC1 WXVL_AK00442SB2207 [0,0,0,1,0,0|1,0,1]=3 210 B9R1.80 CNC(=O)CCC1CC1 WXVL_AK00442SB5360 [0,0,0,1,0,0|1,0,1]=3 211 B9R1.80 CNC(=O)CCC1CC1 WXVL_AK00442SB5360 [0,0,0,1,0,0|1,0,1]=3 212 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [2,0,0,0,0,0|1,0,1]=4 213 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [2,0,0,0,0,0|1,0,1]=4 214 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [2,0,0,0,0,0|1,0,1]=4 215 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [2,0,0,0,0,0|1,0,1]=4 216 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [2,0,0,0,0,0|2,0,0]=4 217 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [2,0,0,0,0,0|2,0,0]=4 218 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [2,0,0,0,0,0|2,0,0]=4 219 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [2,0,0,0,0,0|2,0,0]=4 220 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [2,0,0,0,0,0|2,0,0]=4 221 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [2,0,0,0,0,0|2,0,0]=4 222 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [2,0,0,0,0,0|2,0,0]=4 223 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [2,0,0,0,0,0|2,0,0]=4 224 B8R0.7 CCCCCNC(=O)C WXVL_AK0076SB0150 [1,1,0,0,0,0|1,0,1]=4 225 B8R0.7 CCCCCNC(=O)C WXVL_AK0076SB0150 [1,1,0,0,0,0|1,0,1]=4 226 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [1,1,0,0,0,0|1,0,1]=4 227 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [1,1,0,0,0,0|1,0,1]=4 228 B8R0.3 CCC[C@H](O)C(=O)NC WXVL_AK00442SB3627 [1,1,0,0,0,0|1,0,1]=4 229 B8R0.3 CCC[C@H](O)C(=O)NC WXVL_AK00442SB3627 [1,1,0,0,0,0|1,0,1]=4 230 B8R0.8 C=C(F)C(=O)NCCC WXVL_AK00504SB1376 [1,1,0,0,0,0|1,0,0]=3 231 B8R0.8 C=C(F)C(=O)NCCC WXVL_AK00504SB1376 [1,1,0,0,0,0|1,0,0]=3 232 B8R0.8 C=C(F)C(=O)NCCF WXVL_AK00466SB1376 [1,1,0,0,0,0|2,0,0]=4 233 B8R0.8 C=C(F)C(=O)NCCF WXVL_AK00466SB1376 [1,1,0,0,0,0|2,0,0]=4 234 B8R0.8 CCCNC(=O)C(=O)C WXVL_AK00504SB0051 [1,1,0,0,0,0|1,0,1]=4 235 B8R0.8 CCCNC(=O)C(=O)C WXVL_AK00504SB0051 [1,1,0,0,0,0|1,0,1]=4 236 B8R0.8 CCCNC(=O)C(=O)N WXVL_AK00504SB0128 [1,1,0,0,0,0|2,0,0]=4 237 B8R0.8 CCCNC(=O)C(=O)N WXVL_AK00504SB0128 [1,1,0,0,0,0|2,0,0]=4 238 B8R0.9 CNC(=O)CCC(C)C WXVL_AK00442SB0354 [1,1,0,0,0,0|1,0,1]=4 239 B8R0.9 CNC(=O)CCC(C)C WXVL_AK00442SB0354 [1,1,0,0,0,0|1,0,1]=4 240 B8R0.19 CCC(C)CC(=O)NC WXVL_AK00442SB0353 [1,1,0,0,0,0|1,0,1]=4 241 B8R0.19 CCC(C)CC(=O)NC WXVL_AK00442SB0353 [1,1,0,0,0,0|1,0,1]=4 242 B8R0.19 CCC(O)CC(=O)NC WXVL_AK00442SB4092 [1,1,0,0,0,0|1,0,1]=4 243 B8R0.19 CCC(O)CC(=O)NC WXVL_AK00442SB4092 [1,1,0,0,0,0|1,0,1]=4 244 B8R0.19 CC[C@@H](C)CC(=O)NC WXVL_AK00442SB8650 [1,1,0,0,0,0|1,0,1]=4 245 B8R0.19 CC[C@@H](C)CC(=O)NC WXVL_AK00442SB8650 [1,1,0,0,0,0|1,0,1]=4 246 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [1,1,0,0,0,0|1,0,1]=4 247 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [1,1,0,0,0,0|1,0,1]=4 248 B8R0.28 CC(=O)NCCC(C)C WXVL_AK0068SB0150 [1,1,0,0,0,0|1,0,1]=4 249 B8R0.28 CC(=O)NCCC(C)C WXVL_AK0068SB0150 [1,1,0,0,0,0|1,0,1]=4 250 B8R0.28 CC(C)CCCC(=O)N WXVL_AK0084SB1301 [1,1,0,0,0,0|1,0,0]=3 251 B8R0.28 CC(C)CCCC(=O)N WXVL_AK0084SB1301 [1,1,0,0,0,0|1,0,0]=3 252 B8R0.28 CN(C)CCCC(=O)N WXVL_AK0084SB00055 [1,1,0,0,0,0|2,0,0]=4 253 B8R0.28 CN(C)CCCC(=O)N WXVL_AK0084SB00055 [1,1,0,0,0,0|2,0,0]=4 254 B10R0.3 C/C=C/C(=O)NCCC(C)C WXVL_AK0068SB0340 [0,2,0,0,0,0|1,0,0]=3 255 B10R0.3 C/C=C/C(=O)NCCC(C)C WXVL_AK0068SB0340 [0,2,0,0,0,0|1,0,0]=3 256 B10R0.3 C/C=C/C(=O)NCCN(C)C WXVL_AK0058SB0340 [0,2,0,0,0,0|2,0,0]=4 257 B10R0.3 C/C=C/C(=O)NCCN(C)C WXVL_AK0058SB0340 [0,2,0,0,0,0|2,0,0]=4 258 B10R0.3 C=CCC(=O)NCCC(C)C WXVL_AK0068SB2732 [0,2,0,0,0,0|1,0,0]=3 259 B10R0.3 C=CCC(=O)NCCC(C)C WXVL_AK0068SB2732 [0,2,0,0,0,0|1,0,0]=3 260 B10R0.3 C=CCC(=O)NCCN(C)C WXVL_AK0058SB2732 [0,2,0,0,0,0|2,0,0]=4 261 B10R0.3 C=CCC(=O)NCCN(C)C WXVL_AK0058SB2732 [0,2,0,0,0,0|2,0,0]=4 262 B10R0.3 CCNC(=O)CCCC(C)C WXVL_AK00476SB1301 [0,2,0,0,0,0|0,0,2]=4 263 B10R0.3 CCNC(=O)CCCC(C)C WXVL_AK00476SB1301 [0,2,0,0,0,0|0,0,2]=4 264 B10R0.82 C=C(F)C(=O)NC[C@@H](C)OC WXVL_AK00704SB1376 [0,2,0,0,0,0|2,0,0]=4 265 B10R0.82 C=C(F)C(=O)NC[C@@H](C)OC WXVL_AK00704SB1376 [0,2,0,0,0,0|2,0,0]=4 266 B10R0.82 C=C(F)C(=O)NC[C@@H](F)CO WXVL_AK00590SB1376 [0,2,0,0,0,0|2,0,0]=4 267 B10R0.82 C=C(F)C(=O)NC[C@@H](F)CO WXVL_AK00590SB1376 [0,2,0,0,0,0|2,0,0]=4 268 B10R0.82 C=C(F)C(=O)NC[C@H](O)CO WXVL_AK00483SB1376 [0,2,0,0,0,0|2,0,0]=4 269 B10R0.82 C=C(F)C(=O)NC[C@H](O)CO WXVL_AK00483SB1376 [0,2,0,0,0,0|2,0,0]=4 270 B10R0.98 C=C(F)C(=O)NCCC(C)C WXVL_AK0068SB1376 [0,2,0,0,0,0|1,0,0]=3 271 B10R0.98 C=C(F)C(=O)NCCC(C)C WXVL_AK0068SB1376 [0,2,0,0,0,0|1,0,0]=3 272 B10R0.98 C=C(F)C(=O)NCCN(C)C WXVL_AK0058SB1376 [0,2,0,0,0,0|2,0,0]=4 273 B10R0.98 C=C(F)C(=O)NCCN(C)C WXVL_AK0058SB1376 [0,2,0,0,0,0|2,0,0]=4 274 B10R0.98 CC(=O)C(=O)NCCC(C)C WXVL_AK0068SB0051 [0,2,0,0,0,0|1,0,1]=4 275 B10R0.98 CC(=O)C(=O)NCCC(C)C WXVL_AK0068SB0051 [0,2,0,0,0,0|1,0,1]=4 276 B10R0.98 CC(C)CCCC(=O)N(C)C WXVL_AN0032SB1301 [0,2,0,0,0,0|1,0,1]=4 277 B10R0.98 CC(C)CCCC(=O)N(C)C WXVL_AN0032SB1301 [0,2,0,0,0,0|1,0,1]=4 278 B10R0.98 CC(C)CCNC(=O)C(=O)N WXVL_AK0068SB0128 [0,2,0,0,0,0|2,0,0]=4 279 B10R0.98 CC(C)CCNC(=O)C(=O)N WXVL_AK0068SB0128 [0,2,0,0,0,0|2,0,0]=4 280 B10R0.1 C#CCC(=O)NCCCCC WXVL_AK0076SB3070 [0,2,0,0,0,0|0,0,2]=4 281 B10R0.1 C#CCC(=O)NCCCCC WXVL_AK0076SB3070 [0,2,0,0,0,0|0,0,2]=4 282 B10R0.1 C#CCCCNC(=O)/C=C/C WXVL_AK00218SB0340 [0,2,0,0,0,0|0,0,2]=4 283 B10R0.1 C#CCCCNC(=O)/C=C/C WXVL_AK00218SB0340 [0,2,0,0,0,0|0,0,2]=4 284 B10R0.1 C#CCCCNC(=O)CC=C WXVL_AK00218SB2732 [0,2,0,0,0,0|0,0,2]=4 285 B10R0.1 C#CCCCNC(=O)CC=C WXVL_AK00218SB2732 [0,2,0,0,0,0|0,0,2]=4 286 B10R0.1 C/C=C/C(=O)NCCCCC WXVL_AK0076SB0340 [0,2,0,0,0,0|0,0,0]=2 287 B10R0.1 C/C=C/C(=O)NCCCCC WXVL_AK0076SB0340 [0,2,0,0,0,0|0,0,0]=2 288 B10R0.1 C/C=C/C(=O)NCCCCO WXVL_AK0075SB0340 [0,2,0,0,0,0|1,0,0]=3 289 B10R0.1 C/C=C/C(=O)NCCCCO WXVL_AK0075SB0340 [0,2,0,0,0,0|1,0,0]=3 290 B10R0.1 C/C=C/C(=O)NCCCOC WXVL_AK00637SB0340 [0,2,0,0,0,0|1,0,0]=3 291 B10R0.1 C/C=C/C(=O)NCCCOC WXVL_AK00637SB0340 [0,2,0,0,0,0|1,0,0]=3 292 B10R0.1 C/C=C/C(=O)NCCCSC WXVL_AK0965SB0340 [0,2,0,0,0,0|1,0,0]=3 293 B10R0.1 C/C=C/C(=O)NCCCSC WXVL_AK0965SB0340 [0,2,0,0,0,0|1,0,0]=3 294 B10R0.1 C/C=C/C(=O)NCCSCC WXVL_AK00494SB0340 [0,2,0,0,0,0|1,0,0]=3 295 B10R0.1 C/C=C/C(=O)NCCSCC WXVL_AK00494SB0340 [0,2,0,0,0,0|1,0,0]=3 296 B10R0.1 C=CCC(=O)NCCCCC WXVL_AK0076SB2732 [0,2,0,0,0,0|0,0,0]=2 297 B10R0.1 C=CCC(=O)NCCCCC WXVL_AK0076SB2732 [0,2,0,0,0,0|0,0,0]=2 298 B10R0.1 C=CCC(=O)NCCCCO WXVL_AK0075SB2732 [0,2,0,0,0,0|1,0,0]=3 299 B10R0.1 C=CCC(=O)NCCCCO WXVL_AK0075SB2732 [0,2,0,0,0,0|1,0,0]=3 300 B10R0.1 C=CCC(=O)NCCCOC WXVL_AK00637SB2732 [0,2,0,0,0,0|1,0,0]=3 301 B10R0.1 C=CCC(=O)NCCCOC WXVL_AK00637SB2732 [0,2,0,0,0,0|1,0,0]=3 302 B10R0.1 C=CCC(=O)NCCCSC WXVL_AK0965SB2732 [0,2,0,0,0,0|1,0,0]=3 303 B10R0.1 C=CCC(=O)NCCCSC WXVL_AK0965SB2732 [0,2,0,0,0,0|1,0,0]=3 304 B10R0.1 C=CCC(=O)NCCSCC WXVL_AK00494SB2732 [0,2,0,0,0,0|1,0,0]=3 305 B10R0.1 C=CCC(=O)NCCSCC WXVL_AK00494SB2732 [0,2,0,0,0,0|1,0,0]=3 306 B10R0.1 CC#CC(=O)NCCCCC WXVL_AK0076SB1240 [0,2,0,0,0,0|0,0,2]=4 307 B10R0.1 CC#CC(=O)NCCCCC WXVL_AK0076SB1240 [0,2,0,0,0,0|0,0,2]=4 308 B10R0.1 CCCCCNC(=O)CC#N WXVL_AK0076SB0057 [0,2,0,0,0,0|0,0,2]=4 309 B10R0.1 CCCCCNC(=O)CC#N WXVL_AK0076SB0057 [0,2,0,0,0,0|0,0,2]=4 310 B10R0.1 CCCCCNC(=O)CCC WXVL_AK0076SB0073 [0,2,0,0,0,0|0,0,2]=4 311 B10R0.1 CCCCCNC(=O)CCC WXVL_AK0076SB0073 [0,2,0,0,0,0|0,0,2]=4 312 B10R0.1 CCCCCNC(=O)COC WXVL_AK0076SB0090 [0,2,0,0,0,0|0,0,2]=4 313 B10R0.1 CCCCCNC(=O)COC WXVL_AK0076SB0090 [0,2,0,0,0,0|0,0,2]=4 314 B10R0.1 CCCCCNC(=O)CSC WXVL_AK0076SB1267 [0,2,0,0,0,0|0,0,2]=4 315 B10R0.1 CCCCCNC(=O)CSC WXVL_AK0076SB1267 [0,2,0,0,0,0|0,0,2]=4 316 B10R0.1 CCNC(=O)CCCCCBr WXVL_AK00476SB2192 [0,2,0,0,0,0|0,0,2]=4 317 B10R0.1 CCNC(=O)CCCCCBr WXVL_AK00476SB2192 [0,2,0,0,0,0|0,0,2]=4 318 B10R0.1 CCNC(=O)CCCCCO WXVL_AK00476SB2973 [0,2,0,0,0,0|0,0,2]=4 319 B10R0.1 CCNC(=O)CCCCCO WXVL_AK00476SB2973 [0,2,0,0,0,0|0,0,2]=4 320 B10R0.2 C/C=C/C(=O)NC(C)CCO WXVL_AK1288SB0340 [0,2,0,0,0,0|2,0,0]=4 321 B10R0.2 C/C=C/C(=O)NC(C)CCO WXVL_AK1288SB0340 [0,2,0,0,0,0|2,0,0]=4 322 B10R0.2 C/C=C/C(=O)N[C@@H](C)CCC WXVL_AK00682SB0340 [0,2,0,0,0,0|1,0,0]=3 323 B10R0.2 C/C=C/C(=O)N[C@@H](C)CCC WXVL_AK00682SB0340 [0,2,0,0,0,0|1,0,0]=3 324 B10R0.2 C/C=C/C(=O)N[C@@H](C)COC WXVL_AK0137SB0340 [0,2,0,0,0,0|2,0,0]=4 325 B10R0.2 C/C=C/C(=O)N[C@@H](C)COC WXVL_AK0137SB0340 [0,2,0,0,0,0|2,0,0]=4 326 B10R0.2 C/C=C/C(=O)N[C@H](C)COC WXVL_AK00613SB0340 [0,2,0,0,0,0|2,0,0]=4 327 B10R0.2 C/C=C/C(=O)N[C@H](C)COC WXVL_AK00613SB0340 [0,2,0,0,0,0|2,0,0]=4 328 B10R0.2 C=CCC(=O)NC(C)CCO WXVL_AK1288SB2732 [0,2,0,0,0,0|2,0,0]=4 329 B10R0.2 C=CCC(=O)NC(C)CCO WXVL_AK1288SB2732 [0,2,0,0,0,0|2,0,0]=4 330 B10R0.2 C=CCC(=O)N[C@@H](C)CCC WXVL_AK00682SB2732 [0,2,0,0,0,0|1,0,0]=3 331 B10R0.2 C=CCC(=O)N[C@@H](C)CCC WXVL_AK00682SB2732 [0,2,0,0,0,0|1,0,0]=3 332 B10R0.2 C=CCC(=O)N[C@@H](C)COC WXVL_AK0137SB2732 [0,2,0,0,0,0|2,0,0]=4 333 B10R0.2 C=CCC(=O)N[C@@H](C)COC WXVL_AK0137SB2732 [0,2,0,0,0,0|2,0,0]=4 334 B10R0.2 C=CCC(=O)N[C@H](C)COC WXVL_AK00613SB2732 [0,2,0,0,0,0|2,0,0]=4 335 B10R0.2 C=CCC(=O)N[C@H](C)COC WXVL_AK00613SB2732 [0,2,0,0,0,0|2,0,0]=4 336 B10R0.6 CC(=CC(=O)NCCCO)C WXVL_AK0073SB0342 [0,2,0,0,0,0|2,0,0]=4 337 B10R0.6 CC(=CC(=O)NCCCO)C WXVL_AK0073SB0342 [0,2,0,0,0,0|2,0,0]=4 338 B10R0.6 CCCCNC(=O)C=C(C)C WXVL_AK00588SB0342 [0,2,0,0,0,0|1,0,0]=3 339 B10R0.6 CCCCNC(=O)C=C(C)C WXVL_AK00588SB0342 [0,2,0,0,0,0|1,0,0]=3 340 B10R0.6 CSCCNC(=O)C=C(C)C WXVL_AK00440SB0342 [0,2,0,0,0,0|2,0,0]=4 341 B10R0.6 CSCCNC(=O)C=C(C)C WXVL_AK00440SB0342 [0,2,0,0,0,0|2,0,0]=4 342 B10R0.19 C/C=C/C(=O)N(C)CCOC WXVL_AN0085SB0340 [0,2,0,0,0,0|2,0,0]=4 343 B10R0.19 C/C=C/C(=O)N(C)CCOC WXVL_AN0085SB0340 [0,2,0,0,0,0|2,0,0]=4 344 B10R0.19 C=CCC(=O)N(C)CCOC WXVL_AN0085SB2732 [0,2,0,0,0,0|2,0,0]=4 345 B10R0.19 C=CCC(=O)N(C)CCOC WXVL_AN0085SB2732 [0,2,0,0,0,0|2,0,0]=4 346 B10R0.19 CCCCC(O)C(=O)NCC WXVL_AK00476SB3429 [0,2,0,0,0,0|0,0,2]=4 347 B10R0.19 CCCCC(O)C(=O)NCC WXVL_AK00476SB3429 [0,2,0,0,0,0|0,0,2]=4 348 B10R0.83 C/C=C(\C)/C(=O)NCCCC WXVL_AK00588SB0343 [0,2,0,0,0,0|1,0,0]=3 349 B10R0.83 C/C=C(\C)/C(=O)NCCCC WXVL_AK00588SB0343 [0,2,0,0,0,0|1,0,0]=3 350 B10R0.83 C/C=C(\C)/C(=O)NCCCO WXVL_AK0073SB0343 [0,2,0,0,0,0|2,0,0]=4 351 B10R0.83 C/C=C(\C)/C(=O)NCCCO WXVL_AK0073SB0343 [0,2,0,0,0,0|2,0,0]=4 352 B10R0.83 C/C=C(\C)/C(=O)NCCSC WXVL_AK00440SB0343 [0,2,0,0,0,0|2,0,0]=4 353 B10R0.83 C/C=C(\C)/C(=O)NCCSC WXVL_AK00440SB0343 [0,2,0,0,0,0|2,0,0]=4 354 B10R0.83 CCCCCC(C)C(=O)NC WXVL_AK00442SB0394 [0,2,0,0,0,0|1,0,1]=4 355 B10R0.83 CCCCCC(C)C(=O)NC WXVL_AK00442SB0394 [0,2,0,0,0,0|1,0,1]=4 356 B10R0.83 CCCCNC(=O)C(=O)CC WXVL_AK00588SB0344 [0,2,0,0,0,0|1,0,1]=4 357 B10R0.83 CCCCNC(=O)C(=O)CC WXVL_AK00588SB0344 [0,2,0,0,0,0|1,0,1]=4 358 B10R0.91 C#CCCCC(=O)NCC=C WXVL_AK00561SB2709 [0,2,0,0,0,0|0,0,2]=4 359 B10R0.91 C#CCCCC(=O)NCC=C WXVL_AK00561SB2709 [0,2,0,0,0,0|0,0,2]=4 360 B10R0.91 C=CCCC(=O)NCCCC WXVL_AK00588SB1035 [0,2,0,0,0,0|1,0,0]=3 361 B10R0.91 C=CCCC(=O)NCCCC WXVL_AK00588SB1035 [0,2,0,0,0,0|1,0,0]=3 362 B10R0.91 C=CCCC(=O)NCCCO WXVL_AK0073SB1035 [0,2,0,0,0,0|2,0,0]=4 363 B10R0.91 C=CCCC(=O)NCCCO WXVL_AK0073SB1035 [0,2,0,0,0,0|2,0,0]=4 364 B10R0.91 C=CCCC(=O)NCCSC WXVL_AK00440SB1035 [0,2,0,0,0,0|2,0,0]=4 365 B10R0.91 C=CCCC(=O)NCCSC WXVL_AK00440SB1035 [0,2,0,0,0,0|2,0,0]=4 366 B10R0.91 C=CCCCC(=O)NCC=C WXVL_AK00561SB2920 [0,2,0,0,0,0|0,0,2]=4 367 B10R0.91 C=CCCCC(=O)NCC=C WXVL_AK00561SB2920 [0,2,0,0,0,0|0,0,2]=4 368 B10R0.91 C=CCNC(=O)C/C=C/CC WXVL_AK00561SB0349 [0,2,0,0,0,0|0,0,2]=4 369 B10R0.91 C=CCNC(=O)C/C=C/CC WXVL_AK00561SB0349 [0,2,0,0,0,0|0,0,2]=4 370 B10R0.91 C=CCNC(=O)CCCCBr WXVL_AK00561SB3153 [0,2,0,0,0,0|1,0,0]=3 371 B10R0.91 C=CCNC(=O)CCCCBr WXVL_AK00561SB3153 [0,2,0,0,0,0|1,0,0]=3 372 B10R0.91 C=CCNC(=O)CCCCCl WXVL_AK00561SB0379 [0,2,0,0,0,0|1,0,0]=3 373 B10R0.91 C=CCNC(=O)CCCCCl WXVL_AK00561SB0379 [0,2,0,0,0,0|1,0,0]=3 374 B10R0.91 C=CCNC(=O)NCCCCl WXVL_AK00561YV0130 [0,2,0,0,0,0|2,0,0]=4 375 B10R0.91 C=CCNC(=O)NCCCCl WXVL_AK00561YV0130 [0,2,0,0,0,0|2,0,0]=4 376 B10R0.91 CCCCNC(=O)/C=C/CBr WXVL_AK00588SB0424 [0,2,0,0,0,0|1,0,0]=3 377 B10R0.91 CCCCNC(=O)/C=C/CBr WXVL_AK00588SB0424 [0,2,0,0,0,0|1,0,0]=3 378 B10R0.91 CSCCNC(=O)/C=C/CBr WXVL_AK00440SB0424 [0,2,0,0,0,0|2,0,0]=4 379 B10R0.91 CSCCNC(=O)/C=C/CBr WXVL_AK00440SB0424 [0,2,0,0,0,0|2,0,0]=4 380 B10R0.91 O=C(/C=C/CBr)NCCCO WXVL_AK0073SB0424 [0,2,0,0,0,0|2,0,0]=4 381 B10R0.91 O=C(/C=C/CBr)NCCCO WXVL_AK0073SB0424 [0,2,0,0,0,0|2,0,0]=4 382 B10R0.108 C/C=C/C(=O)NC[C@@H](C)OC WXVL_AK00704SB0340 [0,2,0,0,0,0|2,0,0]=4 383 B10R0.108 C/C=C/C(=O)NC[C@@H](C)OC WXVL_AK00704SB0340 [0,2,0,0,0,0|2,0,0]=4 384 B10R0.108 C/C=C/C(=O)NC[C@@H](F)CO WXVL_AK00590SB0340 [0,2,0,0,0,0|2,0,0]=4 385 B10R0.108 C/C=C/C(=O)NC[C@@H](F)CO WXVL_AK00590SB0340 [0,2,0,0,0,0|2,0,0]=4 386 B10R0.108 C/C=C/C(=O)NC[C@H](O)CO WXVL_AK00483SB0340 [0,2,0,0,0,0|2,0,0]=4 387 B10R0.108 C/C=C/C(=O)NC[C@H](O)CO WXVL_AK00483SB0340 [0,2,0,0,0,0|2,0,0]=4 388 B10R0.108 C=CC(=O)NCC(=O)NCC WXVL_AK00476SB9931 [0,2,0,0,0,0|1,0,1]=4 389 B10R0.108 C=CC(=O)NCC(=O)NCC WXVL_AK00476SB9931 [0,2,0,0,0,0|1,0,1]=4 390 B10R0.108 C=CCC(=O)NC[C@@H](C)OC WXVL_AK00704SB2732 [0,2,0,0,0,0|2,0,0]=4 391 B10R0.108 C=CCC(=O)NC[C@@H](C)OC WXVL_AK00704SB2732 [0,2,0,0,0,0|2,0,0]=4 392 B10R0.108 C=CCC(=O)NC[C@@H](F)CO WXVL_AK00590SB2732 [0,2,0,0,0,0|2,0,0]=4 393 B10R0.108 C=CCC(=O)NC[C@@H](F)CO WXVL_AK00590SB2732 [0,2,0,0,0,0|2,0,0]=4 394 B10R0.108 C=CCC(=O)NC[C@H](O)CO WXVL_AK00483SB2732 [0,2,0,0,0,0|2,0,0]=4 395 B10R0.108 C=CCC(=O)NC[C@H](O)CO WXVL_AK00483SB2732 [0,2,0,0,0,0|2,0,0]=4 396 B10R0.156 C=CCS(=O)(=O)NCCCC WXVL_AK00588HU0152 [0,2,0,0,0,0|2,0,0]=4 397 B10R0.156 C=CCS(=O)(=O)NCCCC WXVL_AK00588HU0152 [0,2,0,0,0,0|2,0,0]=4 398 B10R0.81 C=C(F)C(=O)N(C)CCOC WXVL_AN0085SB1376 [0,2,0,0,0,0|2,0,0]=4 399 B10R0.81 C=C(F)C(=O)N(C)CCOC WXVL_AN0085SB1376 [0,2,0,0,0,0|2,0,0]=4 400 B10R0.81 CCCCC(O)C(=O)N(C)C WXVL_AN0032SB3429 [0,2,0,0,0,0|1,0,1]=4 401 B10R0.81 CCCCC(O)C(=O)N(C)C WXVL_AN0032SB3429 [0,2,0,0,0,0|1,0,1]=4 402 B10R0.26 C=C(F)C(=O)NC(C)CCO WXVL_AK1288SB1376 [0,2,0,0,0,0|2,0,0]=4 403 B10R0.26 C=C(F)C(=O)NC(C)CCO WXVL_AK1288SB1376 [0,2,0,0,0,0|2,0,0]=4 404 B10R0.26 C=C(F)C(=O)N[C@@H](C)CCC WXVL_AK00682SB1376 [0,2,0,0,0,0|1,0,0]=3 405 B10R0.26 C=C(F)C(=O)N[C@@H](C)CCC WXVL_AK00682SB1376 [0,2,0,0,0,0|1,0,0]=3 406 B10R0.26 C=C(F)C(=O)N[C@@H](C)COC WXVL_AK0137SB1376 [0,2,0,0,0,0|2,0,0]=4 407 B10R0.26 C=C(F)C(=O)N[C@@H](C)COC WXVL_AK0137SB1376 [0,2,0,0,0,0|2,0,0]=4 408 B10R0.26 C=C(F)C(=O)N[C@H](C)COC WXVL_AK00613SB1376 [0,2,0,0,0,0|2,0,0]=4 409 B10R0.26 C=C(F)C(=O)N[C@H](C)COC WXVL_AK00613SB1376 [0,2,0,0,0,0|2,0,0]=4 410 B10R0.26 CCC[C@H](C)NC(=O)C(=O)C WXVL_AK00682SB0051 [0,2,0,0,0,0|1,0,1]=4 411 B10R0.26 CCC[C@H](C)NC(=O)C(=O)C WXVL_AK00682SB0051 [0,2,0,0,0,0|1,0,1]=4 412 B10R0.26 CCC[C@H](C)NC(=O)C(=O)N WXVL_AK00682SB0128 [0,2,0,0,0,0|2,0,0]=4 413 B10R0.26 CCC[C@H](C)NC(=O)C(=O)N WXVL_AK00682SB0128 [0,2,0,0,0,0|2,0,0]=4 414 B10R0.74 C#CC(=O)NCCCCCC WXVL_AK0286SB0338 [0,2,0,0,0,0|0,0,2]=4 415 B10R0.74 C#CC(=O)NCCCCCC WXVL_AK0286SB0338 [0,2,0,0,0,0|0,0,2]=4 416 B10R0.74 C#CC(=O)NCCCCCO WXVL_AK0077SB0338 [0,2,0,0,0,0|0,0,2]=4 417 B10R0.74 C#CC(=O)NCCCCCO WXVL_AK0077SB0338 [0,2,0,0,0,0|0,0,2]=4 418 B10R0.74 C#CC(=O)NCCCOCC WXVL_AK0072SB0338 [0,2,0,0,0,0|0,0,2]=4 419 B10R0.74 C#CC(=O)NCCCOCC WXVL_AK0072SB0338 [0,2,0,0,0,0|0,0,2]=4 420 B10R0.74 CCC(=O)NCCCCCO WXVL_AK0077SB0064 [0,2,0,0,0,0|0,0,2]=4 421 B10R0.74 CCC(=O)NCCCCCO WXVL_AK0077SB0064 [0,2,0,0,0,0|0,0,2]=4 422 B10R0.74 CCCCC/C=C/C(=O)NC WXVL_AK00442SB3331 [0,2,0,0,0,0|1,0,1]=4 423 B10R0.74 CCCCC/C=C/C(=O)NC WXVL_AK00442SB3331 [0,2,0,0,0,0|1,0,1]=4 424 B10R0.74 CCCCCCCC(=O)NC WXVL_AK00442SB0393 [0,2,0,0,0,0|1,0,1]=4 425 B10R0.74 CCCCCCCC(=O)NC WXVL_AK00442SB0393 [0,2,0,0,0,0|1,0,1]=4 426 B10R0.74 CCCCCCNC(=O)CC WXVL_AK0286SB0064 [0,2,0,0,0,0|0,0,2]=4 427 B10R0.74 CCCCCCNC(=O)CC WXVL_AK0286SB0064 [0,2,0,0,0,0|0,0,2]=4 428 B10R0.74 CCCCCCNC(=O)CO WXVL_AK0286SB2706 [0,2,0,0,0,0|1,0,1]=4 429 B10R0.74 CCCCCCNC(=O)CO WXVL_AK0286SB2706 [0,2,0,0,0,0|1,0,1]=4 430 B10R0.74 CCOCCCNC(=O)CC WXVL_AK0072SB0064 [0,2,0,0,0,0|0,0,2]=4 431 B10R0.74 CCOCCCNC(=O)CC WXVL_AK0072SB0064 [0,2,0,0,0,0|0,0,2]=4 432 B10R0.74 CCOCCCNC(=O)CO WXVL_AK0072SB2706 [0,2,0,0,0,0|1,0,1]=4 433 B10R0.74 CCOCCCNC(=O)CO WXVL_AK0072SB2706 [0,2,0,0,0,0|1,0,1]=4 434 B10R0.74 CNC(=O)CCCCCCBr WXVL_AK00442SB1386 [0,2,0,0,0,0|1,0,1]=4 435 B10R0.74 CNC(=O)CCCCCCBr WXVL_AK00442SB1386 [0,2,0,0,0,0|1,0,1]=4 436 B10R0.74 O=C(CO)NCCCCCO WXVL_AK0077SB2706 [0,2,0,0,0,0|1,0,1]=4 437 B10R0.74 O=C(CO)NCCCCCO WXVL_AK0077SB2706 [0,2,0,0,0,0|1,0,1]=4 438 B10R0.75 C#CCCCNC(=O)C(=C)F WXVL_AK00218SB1376 [0,2,0,0,0,0|0,0,2]=4 439 B10R0.75 C#CCCCNC(=O)C(=C)F WXVL_AK00218SB1376 [0,2,0,0,0,0|0,0,2]=4 440 B10R0.75 C=C(F)C(=O)NCCCCC WXVL_AK0076SB1376 [0,2,0,0,0,0|0,0,0]=2 441 B10R0.75 C=C(F)C(=O)NCCCCC WXVL_AK0076SB1376 [0,2,0,0,0,0|0,0,0]=2 442 B10R0.75 C=C(F)C(=O)NCCCCO WXVL_AK0075SB1376 [0,2,0,0,0,0|1,0,0]=3 443 B10R0.75 C=C(F)C(=O)NCCCCO WXVL_AK0075SB1376 [0,2,0,0,0,0|1,0,0]=3 444 B10R0.75 C=C(F)C(=O)NCCCOC WXVL_AK00637SB1376 [0,2,0,0,0,0|1,0,0]=3 445 B10R0.75 C=C(F)C(=O)NCCCOC WXVL_AK00637SB1376 [0,2,0,0,0,0|1,0,0]=3 446 B10R0.75 C=C(F)C(=O)NCCCSC WXVL_AK0965SB1376 [0,2,0,0,0,0|1,0,0]=3 447 B10R0.75 C=C(F)C(=O)NCCCSC WXVL_AK0965SB1376 [0,2,0,0,0,0|1,0,0]=3 448 B10R0.75 C=C(F)C(=O)NCCSCC WXVL_AK00494SB1376 [0,2,0,0,0,0|1,0,0]=3 449 B10R0.75 C=C(F)C(=O)NCCSCC WXVL_AK00494SB1376 [0,2,0,0,0,0|1,0,0]=3 450 B10R0.75 CC(=O)C(=O)NCCCCO WXVL_AK0075SB0051 [0,2,0,0,0,0|1,0,1]=4 451 B10R0.75 CC(=O)C(=O)NCCCCO WXVL_AK0075SB0051 [0,2,0,0,0,0|1,0,1]=4 452 B10R0.75 CCCCCNC(=O)C(=O)C WXVL_AK0076SB0051 [0,2,0,0,0,0|0,0,1]=3 453 B10R0.75 CCCCCNC(=O)C(=O)C WXVL_AK0076SB0051 [0,2,0,0,0,0|0,0,1]=3 454 B10R0.75 CCCCCNC(=O)C(=O)N WXVL_AK0076SB0128 [0,2,0,0,0,0|1,0,0]=3 455 B10R0.75 CCCCCNC(=O)C(=O)N WXVL_AK0076SB0128 [0,2,0,0,0,0|1,0,0]=3 456 B10R0.75 CCCCCNC(=O)C(C)C WXVL_AK0076SB0052 [0,2,0,0,0,0|0,0,2]=4 457 B10R0.75 CCCCCNC(=O)C(C)C WXVL_AK0076SB0052 [0,2,0,0,0,0|0,0,2]=4 458 B10R0.75 CCCCCNC(=O)C(C)S WXVL_AK0076SB2708 [0,2,0,0,0,0|0,0,2]=4 459 B10R0.75 CCCCCNC(=O)C(C)S WXVL_AK0076SB2708 [0,2,0,0,0,0|0,0,2]=4 460 B10R0.75 CCCCCNC(=O)C(F)F WXVL_AK0076SB0079 [0,2,0,0,0,0|1,0,1]=4 461 B10R0.75 CCCCCNC(=O)C(F)F WXVL_AK0076SB0079 [0,2,0,0,0,0|1,0,1]=4 462 B10R0.75 CCCCCNC(=O)[C@@H](C)O WXVL_AK0076SB1085 [0,2,0,0,0,0|0,0,2]=4 463 B10R0.75 CCCCCNC(=O)[C@@H](C)O WXVL_AK0076SB1085 [0,2,0,0,0,0|0,0,2]=4 464 B10R0.75 CCSCCNC(=O)C(=O)C WXVL_AK00494SB0051 [0,2,0,0,0,0|1,0,1]=4 465 B10R0.75 CCSCCNC(=O)C(=O)C WXVL_AK00494SB0051 [0,2,0,0,0,0|1,0,1]=4 466 B10R0.75 CCSCCNC(=O)C(=O)N WXVL_AK00494SB0128 [0,2,0,0,0,0|2,0,0]=4 467 B10R0.75 CCSCCNC(=O)C(=O)N WXVL_AK00494SB0128 [0,2,0,0,0,0|2,0,0]=4 468 B10R0.75 CN(C)C(=O)CCCCCBr WXVL_AN0032SB2192 [0,2,0,0,0,0|1,0,1]=4 469 B10R0.75 CN(C)C(=O)CCCCCBr WXVL_AN0032SB2192 [0,2,0,0,0,0|1,0,1]=4 470 B10R0.75 CN(C)C(=O)CCCCCO WXVL_AN0032SB2973 [0,2,0,0,0,0|1,0,1]=4 471 B10R0.75 CN(C)C(=O)CCCCCO WXVL_AN0032SB2973 [0,2,0,0,0,0|1,0,1]=4 472 B10R0.75 COCCCNC(=O)C(=O)C WXVL_AK00637SB0051 [0,2,0,0,0,0|1,0,1]=4 473 B10R0.75 COCCCNC(=O)C(=O)C WXVL_AK00637SB0051 [0,2,0,0,0,0|1,0,1]=4 474 B10R0.75 COCCCNC(=O)C(=O)N WXVL_AK00637SB0128 [0,2,0,0,0,0|2,0,0]=4 475 B10R0.75 COCCCNC(=O)C(=O)N WXVL_AK00637SB0128 [0,2,0,0,0,0|2,0,0]=4 476 B10R0.75 CSCCCNC(=O)C(=O)C WXVL_AK0965SB0051 [0,2,0,0,0,0|1,0,1]=4 477 B10R0.75 CSCCCNC(=O)C(=O)C WXVL_AK0965SB0051 [0,2,0,0,0,0|1,0,1]=4 478 B10R0.75 CSCCCNC(=O)C(=O)N WXVL_AK0965SB0128 [0,2,0,0,0,0|2,0,0]=4 479 B10R0.75 CSCCCNC(=O)C(=O)N WXVL_AK0965SB0128 [0,2,0,0,0,0|2,0,0]=4 480 B10R0.75 NC(=O)C(=O)NCCCCO WXVL_AK0075SB0128 [0,2,0,0,0,0|2,0,0]=4 481 B10R0.75 NC(=O)C(=O)NCCCCO WXVL_AK0075SB0128 [0,2,0,0,0,0|2,0,0]=4 482 B8R1.38 CNC(=O)C1CCC1 WXVL_AK00442SB0042 [1,0,0,1,0,0|1,0,1]=4 483 B8R1.38 CNC(=O)C1CCC1 WXVL_AK00442SB0042 [1,0,0,1,0,0|1,0,1]=4 484 B8R1.40 CNC(=O)CC1CC1 WXVL_AK00442SB0155 [1,0,0,1,0,0|1,0,1]=4 485 B8R1.40 CNC(=O)CC1CC1 WXVL_AK00442SB0155 [1,0,0,1,0,0|1,0,1]=4 486 B8R1.83 CNC(=O)C1CC1C WXVL_AK00442SB0041 [1,0,0,1,0,0|1,0,1]=4 487 B8R1.83 CNC(=O)C1CC1C WXVL_AK00442SB0041 [1,0,0,1,0,0|1,0,1]=4 488 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [1,0,0,1,0,0|1,0,1]=4 489 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [1,0,0,1,0,0|1,0,1]=4 490 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [1,0,0,1,0,0|1,0,0]=3 491 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [1,0,0,1,0,0|1,0,0]=3 492 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [1,0,0,1,0,0|2,0,0]=4 493 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [1,0,0,1,0,0|2,0,0]=4 494 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [1,0,0,1,0,0|2,0,0]=4 495 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [1,0,0,1,0,0|2,0,0]=4 496 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [1,0,0,1,0,0|2,0,0]=4 497 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [1,0,0,1,0,0|2,0,0]=4 498 B8R1.34 NC(=O)CC1CCC1 WXVL_AK0084SB2207 [1,0,0,1,0,0|1,0,0]=3 499 B8R1.34 NC(=O)CC1CCC1 WXVL_AK0084SB2207 [1,0,0,1,0,0|1,0,0]=3 500 B8R1.35 NC(=O)CCC1CC1 WXVL_AK0084SB5360 [1,0,0,1,0,0|1,0,0]=3 501 B8R1.35 NC(=O)CCC1CC1 WXVL_AK0084SB5360 [1,0,0,1,0,0|1,0,0]=3 502 B10R1.14 CNC(=O)[C@H]1CC[C@H](O1)C WXVL_AK00442SB0853 [0,1,0,1,0,0|1,0,1]=4 503 B10R1.14 CNC(=O)[C@H]1CC[C@H](O1)C WXVL_AK00442SB0853 [0,1,0,1,0,0|1,0,1]=4 504 B10R1.153 C#CC(=O)NCCC1CC1 WXVL_AK00594SB0338 [0,1,0,1,0,0|0,0,2]=4 505 B10R1.153 C#CC(=O)NCCC1CC1 WXVL_AK00594SB0338 [0,1,0,1,0,0|0,0,2]=4 506 B10R1.153 CCC(=O)NCCC1CC1 WXVL_AK00594SB0064 [0,1,0,1,0,0|0,0,2]=4 507 B10R1.153 CCC(=O)NCCC1CC1 WXVL_AK00594SB0064 [0,1,0,1,0,0|0,0,2]=4 508 B10R1.153 O=C(CO)NCCC1CC1 WXVL_AK00594SB2706 [0,1,0,1,0,0|1,0,1]=4 509 B10R1.153 O=C(CO)NCCC1CC1 WXVL_AK00594SB2706 [0,1,0,1,0,0|1,0,1]=4 510 B10R1.11 C/C=C/C(=O)N1CCCC1 WXVL_AN0008SB0340 [0,1,0,1,0,0|1,0,0]=3 511 B10R1.11 C/C=C/C(=O)N1CCCC1 WXVL_AN0008SB0340 [0,1,0,1,0,0|1,0,0]=3 512 B10R1.11 C=CCC(=O)N1CCCC1 WXVL_AN0008SB2732 [0,1,0,1,0,0|1,0,0]=3 513 B10R1.11 C=CCC(=O)N1CCCC1 WXVL_AN0008SB2732 [0,1,0,1,0,0|1,0,0]=3 514 B10R1.11 CCNC(=O)C1CCCC1 WXVL_AK00476SB0043 [0,1,0,1,0,0|0,0,2]=4 515 B10R1.11 CCNC(=O)C1CCCC1 WXVL_AK00476SB0043 [0,1,0,1,0,0|0,0,2]=4 516 B10R1.137 C/C=C/C(=O)NC1CNC1 WXVL_AK1291SB0340 [0,1,0,1,0,0|2,0,0]=4 517 B10R1.137 C/C=C/C(=O)NC1CNC1 WXVL_AK1291SB0340 [0,1,0,1,0,0|2,0,0]=4 518 B10R1.137 C/C=C/C(=O)NC1CSC1 WXVL_AK2089SB0340 [0,1,0,1,0,0|2,0,0]=4 519 B10R1.137 C/C=C/C(=O)NC1CSC1 WXVL_AK2089SB0340 [0,1,0,1,0,0|2,0,0]=4 520 B10R1.137 C=CCC(=O)NC1CNC1 WXVL_AK1291SB2732 [0,1,0,1,0,0|2,0,0]=4 521 B10R1.137 C=CCC(=O)NC1CNC1 WXVL_AK1291SB2732 [0,1,0,1,0,0|2,0,0]=4 522 B10R1.137 C=CCC(=O)NC1CSC1 WXVL_AK2089SB2732 [0,1,0,1,0,0|2,0,0]=4 523 B10R1.137 C=CCC(=O)NC1CSC1 WXVL_AK2089SB2732 [0,1,0,1,0,0|2,0,0]=4 524 B10R1.137 CCNC(=O)CC1CCC1 WXVL_AK00476SB2207 [0,1,0,1,0,0|0,0,2]=4 525 B10R1.137 CCNC(=O)CC1CCC1 WXVL_AK00476SB2207 [0,1,0,1,0,0|0,0,2]=4 526 B10R1.138 CCNC(=O)CCC1CC1 WXVL_AK00476SB5360 [0,1,0,1,0,0|0,0,2]=4 527 B10R1.138 CCNC(=O)CCC1CC1 WXVL_AK00476SB5360 [0,1,0,1,0,0|0,0,2]=4 528 B10R1.15 CNC(=O)C1CCCCC1 WXVL_AK00442SB0047 [0,1,0,1,0,0|1,0,1]=4 529 B10R1.15 CNC(=O)C1CCCCC1 WXVL_AK00442SB0047 [0,1,0,1,0,0|1,0,1]=4 530 B10R1.15 CNC(=O)C1CCCCO1 WXVL_AK00442SB0206 [0,1,0,1,0,0|1,0,1]=4 531 B10R1.15 CNC(=O)C1CCCCO1 WXVL_AK00442SB0206 [0,1,0,1,0,0|1,0,1]=4 532 B10R1.15 CNC(=O)C1CCOCC1 WXVL_AK00442SB0149 [0,1,0,1,0,0|1,0,1]=4 533 B10R1.15 CNC(=O)C1CCOCC1 WXVL_AK00442SB0149 [0,1,0,1,0,0|1,0,1]=4 534 B10R1.15 CNC(=O)C1CCSCC1 WXVL_AK00442SB0752 [0,1,0,1,0,0|1,0,1]=4 535 B10R1.15 CNC(=O)C1CCSCC1 WXVL_AK00442SB0752 [0,1,0,1,0,0|1,0,1]=4 536 B10R1.15 CNC(=O)[C@H]1CCCCO1 WXVL_AK00442SB00044 [0,1,0,1,0,0|1,0,1]=4 537 B10R1.15 CNC(=O)[C@H]1CCCCO1 WXVL_AK00442SB00044 [0,1,0,1,0,0|1,0,1]=4 538 B10R1.411 CNC(=O)C1(CCCC1)C WXVL_AK00442SB0209 [0,1,0,1,0,0|1,0,1]=4 539 B10R1.411 CNC(=O)C1(CCCC1)C WXVL_AK00442SB0209 [0,1,0,1,0,0|1,0,1]=4 540 B10R1.151 C#CC(=O)NCC1CCC1 WXVL_AK00492SB0338 [0,1,0,1,0,0|0,0,2]=4 541 B10R1.151 C#CC(=O)NCC1CCC1 WXVL_AK00492SB0338 [0,1,0,1,0,0|0,0,2]=4 542 B10R1.151 CCC(=O)NCC1CCC1 WXVL_AK00492SB0064 [0,1,0,1,0,0|0,0,2]=4 543 B10R1.151 CCC(=O)NCC1CCC1 WXVL_AK00492SB0064 [0,1,0,1,0,0|0,0,2]=4 544 B10R1.151 CNC(=O)CCC1CCC1 WXVL_AK00442SB8784 [0,1,0,1,0,0|1,0,1]=4 545 B10R1.151 CNC(=O)CCC1CCC1 WXVL_AK00442SB8784 [0,1,0,1,0,0|1,0,1]=4 546 B10R1.151 O=C(CO)NCC1CCC1 WXVL_AK00492SB2706 [0,1,0,1,0,0|1,0,1]=4 547 B10R1.151 O=C(CO)NCC1CCC1 WXVL_AK00492SB2706 [0,1,0,1,0,0|1,0,1]=4 548 B10R1.27 CNC(=O)CC1CCCC1 WXVL_AK00442SB0044 [0,1,0,1,0,0|1,0,1]=4 549 B10R1.27 CNC(=O)CC1CCCC1 WXVL_AK00442SB0044 [0,1,0,1,0,0|1,0,1]=4 550 B10R1.27 CNC(=O)CN1CCCC1 WXVL_AK00442SB0201 [0,1,0,1,0,0|1,0,1]=4 551 B10R1.27 CNC(=O)CN1CCCC1 WXVL_AK00442SB0201 [0,1,0,1,0,0|1,0,1]=4 552 B10R1.149 C#CC(=O)N1CCC[C@H]1C WXVL_AN00593SB0338 [0,1,0,1,0,0|0,0,2]=4 553 B10R1.149 CCC(=O)N1CCC[C@H]1C WXVL_AN00593SB0064 [0,1,0,1,0,0|0,0,2]=4 554 B10R1.149 CNC(=O)C1CCCC1C WXVL_AK00442SB0904 [0,1,0,1,0,0|1,0,1]=4 555 B10R1.149 CNC(=O)C1CCCC1C WXVL_AK00442SB0904 [0,1,0,1,0,0|1,0,1]=4 556 B10R1.149 CNC(=O)[C@@H]1CCCN1C WXVL_AK00442SB1197 [0,1,0,1,0,0|1,0,1]=4 557 B10R1.149 CNC(=O)[C@@H]1CCCN1C WXVL_AK00442SB1197 [0,1,0,1,0,0|1,0,1]=4 558 B10R1.149 C[C@@H]1CCCN1C(=O)CO WXVL_AN00593SB2706 [0,1,0,1,0,0|1,0,1]=4 559 B10R1.429 CNC(=O)CC1(CCC1)O WXVL_AK00442SB0026 [0,1,0,1,0,0|1,0,1]=4 560 B10R1.429 CNC(=O)CC1(CCC1)O WXVL_AK00442SB0026 [0,1,0,1,0,0|1,0,1]=4 561 B10R1.23 C=C(F)C(=O)N1CCCC1 WXVL_AN0008SB1376 [0,1,0,1,0,0|1,0,0]=3 562 B10R1.23 C=C(F)C(=O)N1CCCC1 WXVL_AN0008SB1376 [0,1,0,1,0,0|1,0,0]=3 563 B10R1.23 CC(=O)C(=O)N1CCCC1 WXVL_AN0008SB0051 [0,1,0,1,0,0|1,0,1]=4 564 B10R1.23 CC(=O)C(=O)N1CCCC1 WXVL_AN0008SB0051 [0,1,0,1,0,0|1,0,1]=4 565 B10R1.23 CN(C)C(=O)C1CCCC1 WXVL_AN0032SB0043 [0,1,0,1,0,0|1,0,1]=4 566 B10R1.23 CN(C)C(=O)C1CCCC1 WXVL_AN0032SB0043 [0,1,0,1,0,0|1,0,1]=4 567 B10R1.23 NC(=O)C(=O)N1CCCC1 WXVL_AN0008SB0128 [0,1,0,1,0,0|2,0,0]=4 568 B10R1.23 NC(=O)C(=O)N1CCCC1 WXVL_AN0008SB0128 [0,1,0,1,0,0|2,0,0]=4 569 B10R1.204 C=C(F)C(=O)NC1CNC1 WXVL_AK1291SB1376 [0,1,0,1,0,0|2,0,0]=4 570 B10R1.204 C=C(F)C(=O)NC1CNC1 WXVL_AK1291SB1376 [0,1,0,1,0,0|2,0,0]=4 571 B10R1.204 C=C(F)C(=O)NC1CSC1 WXVL_AK2089SB1376 [0,1,0,1,0,0|2,0,0]=4 572 B10R1.204 C=C(F)C(=O)NC1CSC1 WXVL_AK2089SB1376 [0,1,0,1,0,0|2,0,0]=4 573 B10R1.204 CN(C)C(=O)CC1CCC1 WXVL_AN0032SB2207 [0,1,0,1,0,0|1,0,1]=4 574 B10R1.204 CN(C)C(=O)CC1CCC1 WXVL_AN0032SB2207 [0,1,0,1,0,0|1,0,1]=4 575 B10R1.205 CN(C)C(=O)CCC1CC1 WXVL_AN0032SB5360 [0,1,0,1,0,0|1,0,1]=4 576 B10R1.205 CN(C)C(=O)CCC1CC1 WXVL_AN0032SB5360 [0,1,0,1,0,0|1,0,1]=4