0 B8R0.6 C#CC(=O)NCCCC WXVL_AK00588SB0338 [0,0,0,0,0,0|2,0,1]=3 1 B8R0.6 C#CC(=O)NCCCC WXVL_AK00588SB0338 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.6 C#CC(=O)NCCCO WXVL_AK0073SB0338 [0,0,0,0,0,0|3,0,1]=4 3 B8R0.6 C#CC(=O)NCCCO WXVL_AK0073SB0338 [0,0,0,0,0,0|3,0,1]=4 4 B8R0.6 C#CC(=O)NCCSC WXVL_AK00440SB0338 [0,0,0,0,0,0|3,0,1]=4 5 B8R0.6 C#CC(=O)NCCSC WXVL_AK00440SB0338 [0,0,0,0,0,0|3,0,1]=4 6 B8R0.6 C#CCCCC(=O)NC WXVL_AK00442SB2709 [0,0,0,0,0,0|1,0,2]=3 7 B8R0.6 C#CCCCC(=O)NC WXVL_AK00442SB2709 [0,0,0,0,0,0|1,0,2]=3 8 B8R0.6 C#CCCNC(=O)CC WXVL_AK3109SB0064 [0,0,0,0,0,0|2,0,2]=4 9 B8R0.6 C#CCCNC(=O)CC WXVL_AK3109SB0064 [0,0,0,0,0,0|2,0,2]=4 10 B8R0.6 C=CCCCC(=O)NC WXVL_AK00442SB2920 [0,0,0,0,0,0|1,0,2]=3 11 B8R0.6 C=CCCCC(=O)NC WXVL_AK00442SB2920 [0,0,0,0,0,0|1,0,2]=3 12 B8R0.6 C=CCCNC(=O)CC WXVL_AK00138SB0064 [0,0,0,0,0,0|2,0,2]=4 13 B8R0.6 C=CCCNC(=O)CC WXVL_AK00138SB0064 [0,0,0,0,0,0|2,0,2]=4 14 B8R0.6 CC/C=C/CC(=O)NC WXVL_AK00442SB0349 [0,0,0,0,0,0|1,0,2]=3 15 B8R0.6 CC/C=C/CC(=O)NC WXVL_AK00442SB0349 [0,0,0,0,0,0|1,0,2]=3 16 B8R0.6 CCC(=O)NCCC#N WXVL_AK0087SB0064 [0,0,0,0,0,0|3,0,1]=4 17 B8R0.6 CCC(=O)NCCC#N WXVL_AK0087SB0064 [0,0,0,0,0,0|3,0,1]=4 18 B8R0.6 CCC(=O)NCCCO WXVL_AK0073SB0064 [0,0,0,0,0,0|3,0,0]=3 19 B8R0.6 CCC(=O)NCCCO WXVL_AK0073SB0064 [0,0,0,0,0,0|3,0,0]=3 20 B8R0.6 CCC(=O)NCCSC WXVL_AK00440SB0064 [0,0,0,0,0,0|3,0,0]=3 21 B8R0.6 CCC(=O)NCCSC WXVL_AK00440SB0064 [0,0,0,0,0,0|3,0,0]=3 22 B8R0.6 CCCCNC(=O)CC WXVL_AK00588SB0064 [0,0,0,0,0,0|2,0,0]=2 23 B8R0.6 CCCCNC(=O)CC WXVL_AK00588SB0064 [0,0,0,0,0,0|2,0,0]=2 24 B8R0.6 CCCCNC(=O)CO WXVL_AK00588SB2706 [0,0,0,0,0,0|3,0,0]=3 25 B8R0.6 CCCCNC(=O)CO WXVL_AK00588SB2706 [0,0,0,0,0,0|3,0,0]=3 26 B8R0.6 CCO/C=C/C(=O)NC WXVL_AK00442SB3226 [0,0,0,0,0,0|2,0,2]=4 27 B8R0.6 CCO/C=C/C(=O)NC WXVL_AK00442SB3226 [0,0,0,0,0,0|2,0,2]=4 28 B8R0.6 CNC(=O)CCCCBr WXVL_AK00442SB3153 [0,0,0,0,0,0|2,0,0]=2 29 B8R0.6 CNC(=O)CCCCBr WXVL_AK00442SB3153 [0,0,0,0,0,0|2,0,0]=2 30 B8R0.6 CNC(=O)CCCCCl WXVL_AK00442SB0379 [0,0,0,0,0,0|2,0,0]=2 31 B8R0.6 CNC(=O)CCCCCl WXVL_AK00442SB0379 [0,0,0,0,0,0|2,0,0]=2 32 B8R0.6 CNC(=O)NCCCCl WXVL_AK00442YV0130 [0,0,0,0,0,0|3,0,0]=3 33 B8R0.6 CNC(=O)NCCCCl WXVL_AK00442YV0130 [0,0,0,0,0,0|3,0,0]=3 34 B8R0.6 CSCCNC(=O)CO WXVL_AK00440SB2706 [0,0,0,0,0,0|4,0,0]=4 35 B8R0.6 CSCCNC(=O)CO WXVL_AK00440SB2706 [0,0,0,0,0,0|4,0,0]=4 36 B8R0.6 O=C(CO)NCCCO WXVL_AK0073SB2706 [0,0,0,0,0,0|4,0,0]=4 37 B8R0.6 O=C(CO)NCCCO WXVL_AK0073SB2706 [0,0,0,0,0,0|4,0,0]=4 38 B7R0.3 C#CC(=O)NCCC WXVL_AK00504SB0338 [1,0,0,0,0,0|2,0,1]=4 39 B7R0.3 C#CC(=O)NCCC WXVL_AK00504SB0338 [1,0,0,0,0,0|2,0,1]=4 40 B7R0.3 C#CCCC(=O)NC WXVL_AK00442SB2189 [1,0,0,0,0,0|1,0,2]=4 41 B7R0.3 C#CCCC(=O)NC WXVL_AK00442SB2189 [1,0,0,0,0,0|1,0,2]=4 42 B7R0.3 C=CCCC(=O)NC WXVL_AK00442SB1035 [1,0,0,0,0,0|1,0,2]=4 43 B7R0.3 C=CCCC(=O)NC WXVL_AK00442SB1035 [1,0,0,0,0,0|1,0,2]=4 44 B7R0.3 CCC(=O)NCCF WXVL_AK00466SB0064 [1,0,0,0,0,0|3,0,0]=4 45 B7R0.3 CCC(=O)NCCF WXVL_AK00466SB0064 [1,0,0,0,0,0|3,0,0]=4 46 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [1,0,0,0,0,0|2,0,0]=3 47 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [1,0,0,0,0,0|2,0,0]=3 48 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [1,0,0,0,0,0|3,0,0]=4 49 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [1,0,0,0,0,0|3,0,0]=4 50 B7R0.3 CCOCC(=O)NC WXVL_AK00442SB0091 [1,0,0,0,0,0|2,0,0]=3 51 B7R0.3 CCOCC(=O)NC WXVL_AK00442SB0091 [1,0,0,0,0,0|2,0,0]=3 52 B7R0.3 CCSCC(=O)NC WXVL_AK00442SB0002 [1,0,0,0,0,0|2,0,0]=3 53 B7R0.3 CCSCC(=O)NC WXVL_AK00442SB0002 [1,0,0,0,0,0|2,0,0]=3 54 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [1,0,0,0,0,0|2,0,0]=3 55 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [1,0,0,0,0,0|2,0,0]=3 56 B7R0.3 CNC(=O)CCSC WXVL_AK00442SB0361 [1,0,0,0,0,0|2,0,0]=3 57 B7R0.3 CNC(=O)CCSC WXVL_AK00442SB0361 [1,0,0,0,0,0|2,0,0]=3 58 B7R0.3 CNC(=O)NCCCl WXVL_AK00442YV0092 [1,0,0,0,0,0|3,0,0]=4 59 B7R0.3 CNC(=O)NCCCl WXVL_AK00442YV0092 [1,0,0,0,0,0|3,0,0]=4 60 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,0,0,0,0,0|1,0,2]=4 61 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,0,0,0,0,0|1,0,2]=4 62 B7R0.4 C#CCCNC(=O)C WXVL_AK3109SB0150 [1,0,0,0,0,0|1,0,2]=4 63 B7R0.4 C#CCCNC(=O)C WXVL_AK3109SB0150 [1,0,0,0,0,0|1,0,2]=4 64 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,0,0,0,0,0|1,0,2]=4 65 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,0,0,0,0,0|1,0,2]=4 66 B7R0.4 C=CCCNC(=O)C WXVL_AK00138SB0150 [1,0,0,0,0,0|1,0,2]=4 67 B7R0.4 C=CCCNC(=O)C WXVL_AK00138SB0150 [1,0,0,0,0,0|1,0,2]=4 68 B7R0.4 CC(=O)NCCC#N WXVL_AK0087SB0150 [1,0,0,0,0,0|2,0,1]=4 69 B7R0.4 CC(=O)NCCC#N WXVL_AK0087SB0150 [1,0,0,0,0,0|2,0,1]=4 70 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,0,0,0,0,0|2,0,0]=3 71 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,0,0,0,0,0|2,0,0]=3 72 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,0,0,0,0,0|1,0,2]=4 73 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,0,0,0,0,0|1,0,2]=4 74 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,0,0,0,0,0|1,0,0]=2 75 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,0,0,0,0,0|1,0,0]=2 76 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,0,0,0,0,0|2,0,0]=3 77 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,0,0,0,0,0|2,0,0]=3 78 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,0,0,0,0,0|2,0,0]=3 79 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,0,0,0,0,0|2,0,0]=3 80 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,0,0,0,0,0|2,0,0]=3 81 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,0,0,0,0,0|2,0,0]=3 82 B9R0.1 C#CC(=O)NCCC(C)C WXVL_AK0068SB0338 [0,1,0,0,0,0|2,0,1]=4 83 B9R0.1 C#CC(=O)NCCC(C)C WXVL_AK0068SB0338 [0,1,0,0,0,0|2,0,1]=4 84 B9R0.1 CC(C)CCNC(=O)CO WXVL_AK0068SB2706 [0,1,0,0,0,0|3,0,0]=4 85 B9R0.1 CC(C)CCNC(=O)CO WXVL_AK0068SB2706 [0,1,0,0,0,0|3,0,0]=4 86 B9R0.1 CCC(=O)NCCC(C)C WXVL_AK0068SB0064 [0,1,0,0,0,0|2,0,0]=3 87 B9R0.1 CCC(=O)NCCC(C)C WXVL_AK0068SB0064 [0,1,0,0,0,0|2,0,0]=3 88 B9R0.1 CCC(=O)NCCN(C)C WXVL_AK0058SB0064 [0,1,0,0,0,0|3,0,0]=4 89 B9R0.1 CCC(=O)NCCN(C)C WXVL_AK0058SB0064 [0,1,0,0,0,0|3,0,0]=4 90 B9R0.1 CNC(=O)CCC=C(C)C WXVL_AK00442SB00030 [0,1,0,0,0,0|1,0,2]=4 91 B9R0.1 CNC(=O)CCC=C(C)C WXVL_AK00442SB00030 [0,1,0,0,0,0|1,0,2]=4 92 B9R0.1 CNC(=O)CCCC(C)C WXVL_AK00442SB1301 [0,1,0,0,0,0|1,0,0]=2 93 B9R0.1 CNC(=O)CCCC(C)C WXVL_AK00442SB1301 [0,1,0,0,0,0|1,0,0]=2 94 B9R0.1 CNC(=O)CCCN(C)C WXVL_AK00442SB00055 [0,1,0,0,0,0|2,0,0]=3 95 B9R0.1 CNC(=O)CCCN(C)C WXVL_AK00442SB00055 [0,1,0,0,0,0|2,0,0]=3 96 B9R0.1 CNC(=O)CCNC(=O)C WXVL_AK00442SB0374 [0,1,0,0,0,0|2,0,1]=4 97 B9R0.1 CNC(=O)CCNC(=O)C WXVL_AK00442SB0374 [0,1,0,0,0,0|2,0,1]=4 98 B9R0.5 C#CCC(=O)NCCCC WXVL_AK00588SB3070 [0,1,0,0,0,0|2,0,1]=4 99 B9R0.5 C#CCC(=O)NCCCC WXVL_AK00588SB3070 [0,1,0,0,0,0|2,0,1]=4 100 B9R0.5 C#CCCCC(=O)NCC WXVL_AK00476SB2709 [0,1,0,0,0,0|1,0,2]=4 101 B9R0.5 C#CCCCC(=O)NCC WXVL_AK00476SB2709 [0,1,0,0,0,0|1,0,2]=4 102 B9R0.5 C#CCCNC(=O)COC WXVL_AK3109SB0090 [0,1,0,0,0,0|1,0,2]=4 103 B9R0.5 C#CCCNC(=O)COC WXVL_AK3109SB0090 [0,1,0,0,0,0|1,0,2]=4 104 B9R0.5 C/C=C/C(=O)NCCCC WXVL_AK00588SB0340 [0,1,0,0,0,0|2,0,0]=3 105 B9R0.5 C/C=C/C(=O)NCCCC WXVL_AK00588SB0340 [0,1,0,0,0,0|2,0,0]=3 106 B9R0.5 C/C=C/C(=O)NCCCO WXVL_AK0073SB0340 [0,1,0,0,0,0|3,0,0]=4 107 B9R0.5 C/C=C/C(=O)NCCCO WXVL_AK0073SB0340 [0,1,0,0,0,0|3,0,0]=4 108 B9R0.5 C/C=C/C(=O)NCCSC WXVL_AK00440SB0340 [0,1,0,0,0,0|3,0,0]=4 109 B9R0.5 C/C=C/C(=O)NCCSC WXVL_AK00440SB0340 [0,1,0,0,0,0|3,0,0]=4 110 B9R0.5 C=CCC(=O)NCCCC WXVL_AK00588SB2732 [0,1,0,0,0,0|2,0,1]=4 111 B9R0.5 C=CCC(=O)NCCCC WXVL_AK00588SB2732 [0,1,0,0,0,0|2,0,1]=4 112 B9R0.5 C=CCCCC(=O)NCC WXVL_AK00476SB2920 [0,1,0,0,0,0|1,0,2]=4 113 B9R0.5 C=CCCCC(=O)NCC WXVL_AK00476SB2920 [0,1,0,0,0,0|1,0,2]=4 114 B9R0.5 C=CCCNC(=O)COC WXVL_AK00138SB0090 [0,1,0,0,0,0|1,0,2]=4 115 B9R0.5 C=CCCNC(=O)COC WXVL_AK00138SB0090 [0,1,0,0,0,0|1,0,2]=4 116 B9R0.5 CC#CC(=O)NCCCC WXVL_AK00588SB1240 [0,1,0,0,0,0|2,0,0]=3 117 B9R0.5 CC#CC(=O)NCCCC WXVL_AK00588SB1240 [0,1,0,0,0,0|2,0,0]=3 118 B9R0.5 CC#CC(=O)NCCCO WXVL_AK0073SB1240 [0,1,0,0,0,0|3,0,0]=4 119 B9R0.5 CC#CC(=O)NCCCO WXVL_AK0073SB1240 [0,1,0,0,0,0|3,0,0]=4 120 B9R0.5 CC#CC(=O)NCCSC WXVL_AK00440SB1240 [0,1,0,0,0,0|3,0,0]=4 121 B9R0.5 CC#CC(=O)NCCSC WXVL_AK00440SB1240 [0,1,0,0,0,0|3,0,0]=4 122 B9R0.5 CC/C=C/CC(=O)NCC WXVL_AK00476SB0349 [0,1,0,0,0,0|1,0,2]=4 123 B9R0.5 CC/C=C/CC(=O)NCC WXVL_AK00476SB0349 [0,1,0,0,0,0|1,0,2]=4 124 B9R0.5 CCCC(=O)NCCCO WXVL_AK0073SB0073 [0,1,0,0,0,0|3,0,0]=4 125 B9R0.5 CCCC(=O)NCCCO WXVL_AK0073SB0073 [0,1,0,0,0,0|3,0,0]=4 126 B9R0.5 CCCC(=O)NCCSC WXVL_AK00440SB0073 [0,1,0,0,0,0|3,0,0]=4 127 B9R0.5 CCCC(=O)NCCSC WXVL_AK00440SB0073 [0,1,0,0,0,0|3,0,0]=4 128 B9R0.5 CCCCNC(=O)CC#N WXVL_AK00588SB0057 [0,1,0,0,0,0|2,0,1]=4 129 B9R0.5 CCCCNC(=O)CC#N WXVL_AK00588SB0057 [0,1,0,0,0,0|2,0,1]=4 130 B9R0.5 CCCCNC(=O)CCC WXVL_AK00588SB0073 [0,1,0,0,0,0|2,0,0]=3 131 B9R0.5 CCCCNC(=O)CCC WXVL_AK00588SB0073 [0,1,0,0,0,0|2,0,0]=3 132 B9R0.5 CCCCNC(=O)COC WXVL_AK00588SB0090 [0,1,0,0,0,0|1,0,0]=2 133 B9R0.5 CCCCNC(=O)COC WXVL_AK00588SB0090 [0,1,0,0,0,0|1,0,0]=2 134 B9R0.5 CCCCNC(=O)CSC WXVL_AK00588SB1267 [0,1,0,0,0,0|1,1,0]=3 135 B9R0.5 CCCCNC(=O)CSC WXVL_AK00588SB1267 [0,1,0,0,0,0|1,1,0]=3 136 B9R0.5 CCNC(=O)CCCCBr WXVL_AK00476SB3153 [0,1,0,0,0,0|2,0,0]=3 137 B9R0.5 CCNC(=O)CCCCBr WXVL_AK00476SB3153 [0,1,0,0,0,0|2,0,0]=3 138 B9R0.5 CCNC(=O)CCCCCl WXVL_AK00476SB0379 [0,1,0,0,0,0|2,0,0]=3 139 B9R0.5 CCNC(=O)CCCCCl WXVL_AK00476SB0379 [0,1,0,0,0,0|2,0,0]=3 140 B9R0.5 CCNC(=O)NCCCCl WXVL_AK00476YV0130 [0,1,0,0,0,0|3,0,0]=4 141 B9R0.5 CCNC(=O)NCCCCl WXVL_AK00476YV0130 [0,1,0,0,0,0|3,0,0]=4 142 B9R0.5 COCC(=O)NCCC#N WXVL_AK0087SB0090 [0,1,0,0,0,0|2,0,1]=4 143 B9R0.5 COCC(=O)NCCC#N WXVL_AK0087SB0090 [0,1,0,0,0,0|2,0,1]=4 144 B9R0.5 COCC(=O)NCCCO WXVL_AK0073SB0090 [0,1,0,0,0,0|2,0,0]=3 145 B9R0.5 COCC(=O)NCCCO WXVL_AK0073SB0090 [0,1,0,0,0,0|2,0,0]=3 146 B9R0.5 COCC(=O)NCCSC WXVL_AK00440SB0090 [0,1,0,0,0,0|2,0,0]=3 147 B9R0.5 COCC(=O)NCCSC WXVL_AK00440SB0090 [0,1,0,0,0,0|2,0,0]=3 148 B9R0.5 CSCC(=O)NCCCO WXVL_AK0073SB1267 [0,1,0,0,0,0|2,1,0]=4 149 B9R0.5 CSCC(=O)NCCCO WXVL_AK0073SB1267 [0,1,0,0,0,0|2,1,0]=4 150 B9R0.5 CSCCNC(=O)CSC WXVL_AK00440SB1267 [0,1,0,0,0,0|2,1,0]=4 151 B9R0.5 CSCCNC(=O)CSC WXVL_AK00440SB1267 [0,1,0,0,0,0|2,1,0]=4 152 B9R0.8 CCC(=O)N(C)CCOC WXVL_AN0085SB0064 [0,1,0,0,0,0|3,0,0]=4 153 B9R0.8 CCC(=O)N(C)CCOC WXVL_AN0085SB0064 [0,1,0,0,0,0|3,0,0]=4 154 B9R0.8 CCCCC(O)C(=O)NC WXVL_AK00442SB3429 [0,1,0,0,0,0|1,0,0]=2 155 B9R0.8 CCCCC(O)C(=O)NC WXVL_AK00442SB3429 [0,1,0,0,0,0|1,0,0]=2 156 B9R0.8 CCCNC(=O)C(=O)CC WXVL_AK00504SB0344 [0,1,0,0,0,0|2,0,1]=4 157 B9R0.8 CCCNC(=O)C(=O)CC WXVL_AK00504SB0344 [0,1,0,0,0,0|2,0,1]=4 158 B9R0.20 CCCCNS(=O)(=O)CC WXVL_AK00588HU0028 [0,1,0,0,0,0|3,0,0]=4 159 B9R0.20 CCCCNS(=O)(=O)CC WXVL_AK00588HU0028 [0,1,0,0,0,0|3,0,0]=4 160 B9R0.20 CCOCCS(=O)(=O)NC WXVL_AK00442HU0315 [0,1,0,0,0,0|3,0,0]=4 161 B9R0.20 CCOCCS(=O)(=O)NC WXVL_AK00442HU0315 [0,1,0,0,0,0|3,0,0]=4 162 B9R0.20 CNS(=O)(=O)CCCCCl WXVL_AK00442HU0456 [0,1,0,0,0,0|3,0,0]=4 163 B9R0.20 CNS(=O)(=O)CCCCCl WXVL_AK00442HU0456 [0,1,0,0,0,0|3,0,0]=4 164 B9R0.24 CCC(=O)NCC(=O)NC WXVL_AK1222SB0064 [0,1,0,0,0,0|2,0,1]=4 165 B9R0.24 CCC(=O)NCC(=O)NC WXVL_AK1222SB0064 [0,1,0,0,0,0|2,0,1]=4 166 B9R0.24 CCC(=O)NC[C@@H](C)OC WXVL_AK00704SB0064 [0,1,0,0,0,0|3,0,0]=4 167 B9R0.24 CCC(=O)NC[C@@H](C)OC WXVL_AK00704SB0064 [0,1,0,0,0,0|3,0,0]=4 168 B9R0.24 CCC(=O)NC[C@@H](F)CO WXVL_AK00590SB0064 [0,1,0,0,0,0|3,0,0]=4 169 B9R0.24 CCC(=O)NC[C@@H](F)CO WXVL_AK00590SB0064 [0,1,0,0,0,0|3,0,0]=4 170 B9R0.24 CCC(=O)NC[C@H](O)CO WXVL_AK00483SB0064 [0,1,0,0,0,0|3,0,0]=4 171 B9R0.24 CCC(=O)NC[C@H](O)CO WXVL_AK00483SB0064 [0,1,0,0,0,0|3,0,0]=4 172 B9R0.24 CNC(=O)CCC(=O)OC WXVL_AK00442SB0069 [0,1,0,0,0,0|1,0,1]=3 173 B9R0.24 CNC(=O)CCC(=O)OC WXVL_AK00442SB0069 [0,1,0,0,0,0|1,0,1]=3 174 B9R0.34 C#CC(=O)N[C@@H](C)CCC WXVL_AK00682SB0338 [0,1,0,0,0,0|2,0,1]=4 175 B9R0.34 C#CC(=O)N[C@@H](C)CCC WXVL_AK00682SB0338 [0,1,0,0,0,0|2,0,1]=4 176 B9R0.34 CCC(=O)NC(C)CCO WXVL_AK1288SB0064 [0,1,0,0,0,0|3,0,0]=4 177 B9R0.34 CCC(=O)NC(C)CCO WXVL_AK1288SB0064 [0,1,0,0,0,0|3,0,0]=4 178 B9R0.34 CCC(=O)N[C@@H](C)COC WXVL_AK0137SB0064 [0,1,0,0,0,0|3,0,0]=4 179 B9R0.34 CCC(=O)N[C@@H](C)COC WXVL_AK0137SB0064 [0,1,0,0,0,0|3,0,0]=4 180 B9R0.34 CCC(=O)N[C@H](C)COC WXVL_AK00613SB0064 [0,1,0,0,0,0|3,0,0]=4 181 B9R0.34 CCC(=O)N[C@H](C)COC WXVL_AK00613SB0064 [0,1,0,0,0,0|3,0,0]=4 182 B9R0.34 CCC[C@H](C)NC(=O)CC WXVL_AK00682SB0064 [0,1,0,0,0,0|2,0,0]=3 183 B9R0.34 CCC[C@H](C)NC(=O)CC WXVL_AK00682SB0064 [0,1,0,0,0,0|2,0,0]=3 184 B9R0.34 CCC[C@H](C)NC(=O)CO WXVL_AK00682SB2706 [0,1,0,0,0,0|3,0,0]=4 185 B9R0.34 CCC[C@H](C)NC(=O)CO WXVL_AK00682SB2706 [0,1,0,0,0,0|3,0,0]=4 186 B9R0.34 CCNC(=O)CC(=O)OC WXVL_AK00476SB2790 [0,1,0,0,0,0|1,0,1]=3 187 B9R0.34 CCNC(=O)CC(=O)OC WXVL_AK00476SB2790 [0,1,0,0,0,0|1,0,1]=3 188 B9R0.34 CCOC(=O)CC(=O)NC WXVL_AK00442SB3094 [0,1,0,0,0,0|2,0,1]=4 189 B9R0.34 CCOC(=O)CC(=O)NC WXVL_AK00442SB3094 [0,1,0,0,0,0|2,0,1]=4 190 B9R0.46 C#CC(=O)NCCCCC WXVL_AK0076SB0338 [0,1,0,0,0,0|1,0,1]=3 191 B9R0.46 C#CC(=O)NCCCCC WXVL_AK0076SB0338 [0,1,0,0,0,0|1,0,1]=3 192 B9R0.46 C#CC(=O)NCCCCO WXVL_AK0075SB0338 [0,1,0,0,0,0|2,0,1]=4 193 B9R0.46 C#CC(=O)NCCCCO WXVL_AK0075SB0338 [0,1,0,0,0,0|2,0,1]=4 194 B9R0.46 C#CC(=O)NCCCOC WXVL_AK00637SB0338 [0,1,0,0,0,0|2,0,1]=4 195 B9R0.46 C#CC(=O)NCCCOC WXVL_AK00637SB0338 [0,1,0,0,0,0|2,0,1]=4 196 B9R0.46 C#CC(=O)NCCCSC WXVL_AK0965SB0338 [0,1,0,0,0,0|2,0,1]=4 197 B9R0.46 C#CC(=O)NCCCSC WXVL_AK0965SB0338 [0,1,0,0,0,0|2,0,1]=4 198 B9R0.46 C#CC(=O)NCCSCC WXVL_AK00494SB0338 [0,1,0,0,0,0|2,0,1]=4 199 B9R0.46 C#CC(=O)NCCSCC WXVL_AK00494SB0338 [0,1,0,0,0,0|2,0,1]=4 200 B9R0.46 C#CCCCNC(=O)CC WXVL_AK00218SB0064 [0,1,0,0,0,0|1,0,2]=4 201 B9R0.46 C#CCCCNC(=O)CC WXVL_AK00218SB0064 [0,1,0,0,0,0|1,0,2]=4 202 B9R0.46 C#CCOCCC(=O)NC WXVL_AK00442SBD927 [0,1,0,0,0,0|1,0,2]=4 203 B9R0.46 C#CCOCCC(=O)NC WXVL_AK00442SBD927 [0,1,0,0,0,0|1,0,2]=4 204 B9R0.46 CCC(=O)NCCCCO WXVL_AK0075SB0064 [0,1,0,0,0,0|2,0,0]=3 205 B9R0.46 CCC(=O)NCCCCO WXVL_AK0075SB0064 [0,1,0,0,0,0|2,0,0]=3 206 B9R0.46 CCC(=O)NCCCOC WXVL_AK00637SB0064 [0,1,0,0,0,0|2,0,0]=3 207 B9R0.46 CCC(=O)NCCCOC WXVL_AK00637SB0064 [0,1,0,0,0,0|2,0,0]=3 208 B9R0.46 CCC(=O)NCCCSC WXVL_AK0965SB0064 [0,1,0,0,0,0|2,0,0]=3 209 B9R0.46 CCC(=O)NCCCSC WXVL_AK0965SB0064 [0,1,0,0,0,0|2,0,0]=3 210 B9R0.46 CCCCCNC(=O)CC WXVL_AK0076SB0064 [0,1,0,0,0,0|1,0,0]=2 211 B9R0.46 CCCCCNC(=O)CC WXVL_AK0076SB0064 [0,1,0,0,0,0|1,0,0]=2 212 B9R0.46 CCCCCNC(=O)CO WXVL_AK0076SB2706 [0,1,0,0,0,0|2,0,0]=3 213 B9R0.46 CCCCCNC(=O)CO WXVL_AK0076SB2706 [0,1,0,0,0,0|2,0,0]=3 214 B9R0.46 CCSCCNC(=O)CC WXVL_AK00494SB0064 [0,1,0,0,0,0|2,0,0]=3 215 B9R0.46 CCSCCNC(=O)CC WXVL_AK00494SB0064 [0,1,0,0,0,0|2,0,0]=3 216 B9R0.46 CCSCCNC(=O)CO WXVL_AK00494SB2706 [0,1,0,0,0,0|3,0,0]=4 217 B9R0.46 CCSCCNC(=O)CO WXVL_AK00494SB2706 [0,1,0,0,0,0|3,0,0]=4 218 B9R0.46 CNC(=O)CCCCCBr WXVL_AK00442SB2192 [0,1,0,0,0,0|1,0,0]=2 219 B9R0.46 CNC(=O)CCCCCBr WXVL_AK00442SB2192 [0,1,0,0,0,0|1,0,0]=2 220 B9R0.46 CNC(=O)CCCCCO WXVL_AK00442SB2973 [0,1,0,0,0,0|1,0,0]=2 221 B9R0.46 CNC(=O)CCCCCO WXVL_AK00442SB2973 [0,1,0,0,0,0|1,0,0]=2 222 B9R0.46 CNC(=O)COCCOC WXVL_AK00442SB0159 [0,1,0,0,0,0|2,0,0]=3 223 B9R0.46 CNC(=O)COCCOC WXVL_AK00442SB0159 [0,1,0,0,0,0|2,0,0]=3 224 B9R0.46 COCCCNC(=O)CO WXVL_AK00637SB2706 [0,1,0,0,0,0|3,0,0]=4 225 B9R0.46 COCCCNC(=O)CO WXVL_AK00637SB2706 [0,1,0,0,0,0|3,0,0]=4 226 B9R0.46 CSCCCNC(=O)CO WXVL_AK0965SB2706 [0,1,0,0,0,0|3,0,0]=4 227 B9R0.46 CSCCCNC(=O)CO WXVL_AK0965SB2706 [0,1,0,0,0,0|3,0,0]=4 228 B9R0.46 O=C(CO)NCCCCO WXVL_AK0075SB2706 [0,1,0,0,0,0|3,0,0]=4 229 B9R0.46 O=C(CO)NCCCCO WXVL_AK0075SB2706 [0,1,0,0,0,0|3,0,0]=4 230 B9R0.47 C#CCCCC(=O)N(C)C WXVL_AN0032SB2709 [0,1,0,0,0,0|1,0,2]=4 231 B9R0.47 C#CCCCC(=O)N(C)C WXVL_AN0032SB2709 [0,1,0,0,0,0|1,0,2]=4 232 B9R0.47 C=C(F)C(=O)NCCCC WXVL_AK00588SB1376 [0,1,0,0,0,0|2,0,1]=4 233 B9R0.47 C=C(F)C(=O)NCCCC WXVL_AK00588SB1376 [0,1,0,0,0,0|2,0,1]=4 234 B9R0.47 C=CCCCC(=O)N(C)C WXVL_AN0032SB2920 [0,1,0,0,0,0|1,0,2]=4 235 B9R0.47 C=CCCCC(=O)N(C)C WXVL_AN0032SB2920 [0,1,0,0,0,0|1,0,2]=4 236 B9R0.47 CC(=O)C(=O)NCCCO WXVL_AK0073SB0051 [0,1,0,0,0,0|3,0,0]=4 237 B9R0.47 CC(=O)C(=O)NCCCO WXVL_AK0073SB0051 [0,1,0,0,0,0|3,0,0]=4 238 B9R0.47 CC(C)C(=O)NCCCO WXVL_AK0073SB0052 [0,1,0,0,0,0|3,0,0]=4 239 B9R0.47 CC(C)C(=O)NCCCO WXVL_AK0073SB0052 [0,1,0,0,0,0|3,0,0]=4 240 B9R0.47 CC(S)C(=O)NCCCO WXVL_AK0073SB2708 [0,1,0,0,0,0|3,0,0]=4 241 B9R0.47 CC(S)C(=O)NCCCO WXVL_AK0073SB2708 [0,1,0,0,0,0|3,0,0]=4 242 B9R0.47 CC/C=C/CC(=O)N(C)C WXVL_AN0032SB0349 [0,1,0,0,0,0|1,0,2]=4 243 B9R0.47 CC/C=C/CC(=O)N(C)C WXVL_AN0032SB0349 [0,1,0,0,0,0|1,0,2]=4 244 B9R0.47 CCCCNC(=O)C(=O)C WXVL_AK00588SB0051 [0,1,0,0,0,0|2,0,0]=3 245 B9R0.47 CCCCNC(=O)C(=O)C WXVL_AK00588SB0051 [0,1,0,0,0,0|2,0,0]=3 246 B9R0.47 CCCCNC(=O)C(=O)N WXVL_AK00588SB0128 [0,1,0,0,0,0|3,0,0]=4 247 B9R0.47 CCCCNC(=O)C(=O)N WXVL_AK00588SB0128 [0,1,0,0,0,0|3,0,0]=4 248 B9R0.47 CCCCNC(=O)C(C)C WXVL_AK00588SB0052 [0,1,0,0,0,0|2,0,0]=3 249 B9R0.47 CCCCNC(=O)C(C)C WXVL_AK00588SB0052 [0,1,0,0,0,0|2,0,0]=3 250 B9R0.47 CCCCNC(=O)C(C)S WXVL_AK00588SB2708 [0,1,0,0,0,0|2,0,0]=3 251 B9R0.47 CCCCNC(=O)C(C)S WXVL_AK00588SB2708 [0,1,0,0,0,0|2,0,0]=3 252 B9R0.47 CCCCNC(=O)C(F)F WXVL_AK00588SB0079 [0,1,0,0,0,0|3,0,0]=4 253 B9R0.47 CCCCNC(=O)C(F)F WXVL_AK00588SB0079 [0,1,0,0,0,0|3,0,0]=4 254 B9R0.47 CCCCNC(=O)[C@@H](C)O WXVL_AK00588SB1085 [0,1,0,0,0,0|2,0,0]=3 255 B9R0.47 CCCCNC(=O)[C@@H](C)O WXVL_AK00588SB1085 [0,1,0,0,0,0|2,0,0]=3 256 B9R0.47 CN(C)C(=O)CCCCBr WXVL_AN0032SB3153 [0,1,0,0,0,0|2,0,0]=3 257 B9R0.47 CN(C)C(=O)CCCCBr WXVL_AN0032SB3153 [0,1,0,0,0,0|2,0,0]=3 258 B9R0.47 CN(C)C(=O)CCCCCl WXVL_AN0032SB0379 [0,1,0,0,0,0|2,0,0]=3 259 B9R0.47 CN(C)C(=O)CCCCCl WXVL_AN0032SB0379 [0,1,0,0,0,0|2,0,0]=3 260 B9R0.47 CN(C)C(=O)NCCCCl WXVL_AN0032YV0130 [0,1,0,0,0,0|3,0,0]=4 261 B9R0.47 CN(C)C(=O)NCCCCl WXVL_AN0032YV0130 [0,1,0,0,0,0|3,0,0]=4 262 B9R0.47 CSCCNC(=O)C(=O)C WXVL_AK00440SB0051 [0,1,0,0,0,0|3,0,0]=4 263 B9R0.47 CSCCNC(=O)C(=O)C WXVL_AK00440SB0051 [0,1,0,0,0,0|3,0,0]=4 264 B9R0.47 CSCCNC(=O)C(C)C WXVL_AK00440SB0052 [0,1,0,0,0,0|3,0,0]=4 265 B9R0.47 CSCCNC(=O)C(C)C WXVL_AK00440SB0052 [0,1,0,0,0,0|3,0,0]=4 266 B9R0.47 CSCCNC(=O)C(C)S WXVL_AK00440SB2708 [0,1,0,0,0,0|3,0,0]=4 267 B9R0.47 CSCCNC(=O)C(C)S WXVL_AK00440SB2708 [0,1,0,0,0,0|3,0,0]=4 268 B9R0.47 CSCCNC(=O)[C@@H](C)O WXVL_AK00440SB1085 [0,1,0,0,0,0|3,0,0]=4 269 B9R0.47 CSCCNC(=O)[C@@H](C)O WXVL_AK00440SB1085 [0,1,0,0,0,0|3,0,0]=4 270 B9R0.47 C[C@@H](O)C(=O)NCCCO WXVL_AK0073SB1085 [0,1,0,0,0,0|3,0,0]=4 271 B9R0.47 C[C@@H](O)C(=O)NCCCO WXVL_AK0073SB1085 [0,1,0,0,0,0|3,0,0]=4 272 B9R1.11 C#CC(=O)N1CCCC1 WXVL_AN0008SB0338 [0,0,0,1,0,0|2,0,1]=4 273 B9R1.11 C#CC(=O)N1CCCC1 WXVL_AN0008SB0338 [0,0,0,1,0,0|2,0,1]=4 274 B9R1.11 CCC(=O)N1CCCC1 WXVL_AN0008SB0064 [0,0,0,1,0,0|2,0,0]=3 275 B9R1.11 CCC(=O)N1CCCC1 WXVL_AN0008SB0064 [0,0,0,1,0,0|2,0,0]=3 276 B9R1.11 CNC(=O)C1CCCC1 WXVL_AK00442SB0043 [0,0,0,1,0,0|1,0,0]=2 277 B9R1.11 CNC(=O)C1CCCC1 WXVL_AK00442SB0043 [0,0,0,1,0,0|1,0,0]=2 278 B9R1.11 CNC(=O)C1CCCO1 WXVL_AK00442SB1033 [0,0,0,1,0,0|2,0,0]=3 279 B9R1.11 CNC(=O)C1CCCO1 WXVL_AK00442SB1033 [0,0,0,1,0,0|2,0,0]=3 280 B9R1.11 CNC(=O)C1CCCS1 WXVL_AK00442SB0022 [0,0,0,1,0,0|2,0,0]=3 281 B9R1.11 CNC(=O)C1CCCS1 WXVL_AK00442SB0022 [0,0,0,1,0,0|2,0,0]=3 282 B9R1.11 CNC(=O)[C@H]1CCCO1 WXVL_AK00442SB00043 [0,0,0,1,0,0|2,0,0]=3 283 B9R1.11 CNC(=O)[C@H]1CCCO1 WXVL_AK00442SB00043 [0,0,0,1,0,0|2,0,0]=3 284 B9R1.11 O=C(CO)N1CCCC1 WXVL_AN0008SB2706 [0,0,0,1,0,0|3,0,0]=4 285 B9R1.11 O=C(CO)N1CCCC1 WXVL_AN0008SB2706 [0,0,0,1,0,0|3,0,0]=4 286 B9R1.79 CCC(=O)NC1CNC1 WXVL_AK1291SB0064 [0,0,0,1,0,0|3,0,0]=4 287 B9R1.79 CCC(=O)NC1CNC1 WXVL_AK1291SB0064 [0,0,0,1,0,0|3,0,0]=4 288 B9R1.79 CCC(=O)NC1CSC1 WXVL_AK2089SB0064 [0,0,0,1,0,0|3,0,0]=4 289 B9R1.79 CCC(=O)NC1CSC1 WXVL_AK2089SB0064 [0,0,0,1,0,0|3,0,0]=4 290 B9R1.79 CNC(=O)CC1CCC1 WXVL_AK00442SB2207 [0,0,0,1,0,0|1,0,0]=2 291 B9R1.79 CNC(=O)CC1CCC1 WXVL_AK00442SB2207 [0,0,0,1,0,0|1,0,0]=2 292 B9R1.80 CNC(=O)C=CC1CC1 WXVL_AK00442SB4216 [0,0,0,1,0,0|1,0,2]=4 293 B9R1.80 CNC(=O)C=CC1CC1 WXVL_AK00442SB4216 [0,0,0,1,0,0|1,0,2]=4 294 B9R1.80 CNC(=O)CCC1CC1 WXVL_AK00442SB5360 [0,0,0,1,0,0|1,0,0]=2 295 B9R1.80 CNC(=O)CCC1CC1 WXVL_AK00442SB5360 [0,0,0,1,0,0|1,0,0]=2 296 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [2,0,0,0,0,0|1,0,0]=3 297 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [2,0,0,0,0,0|1,0,0]=3 298 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [2,0,0,0,0,0|2,0,0]=4 299 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [2,0,0,0,0,0|2,0,0]=4 300 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [2,0,0,0,0,0|2,0,0]=4 301 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [2,0,0,0,0,0|2,0,0]=4 302 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [2,0,0,0,0,0|2,0,0]=4 303 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [2,0,0,0,0,0|2,0,0]=4 304 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [2,0,0,0,0,0|2,0,0]=4 305 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [2,0,0,0,0,0|2,0,0]=4 306 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [2,0,0,0,0,0|1,0,0]=3 307 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [2,0,0,0,0,0|1,0,0]=3 308 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [2,0,0,0,0,0|2,0,0]=4 309 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [2,0,0,0,0,0|2,0,0]=4 310 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [2,0,0,0,0,0|2,0,0]=4 311 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [2,0,0,0,0,0|2,0,0]=4 312 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [2,0,0,0,0,0|2,0,0]=4 313 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [2,0,0,0,0,0|2,0,0]=4 314 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [2,0,0,0,0,0|2,0,0]=4 315 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [2,0,0,0,0,0|2,0,0]=4 316 B8R0.7 CCCCCNC(=O)C WXVL_AK0076SB0150 [1,1,0,0,0,0|2,0,0]=4 317 B8R0.7 CCCCCNC(=O)C WXVL_AK0076SB0150 [1,1,0,0,0,0|2,0,0]=4 318 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [1,1,0,0,0,0|1,0,0]=3 319 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [1,1,0,0,0,0|1,0,0]=3 320 B8R0.3 CCC[C@H](O)C(=O)NC WXVL_AK00442SB3627 [1,1,0,0,0,0|1,0,0]=3 321 B8R0.3 CCC[C@H](O)C(=O)NC WXVL_AK00442SB3627 [1,1,0,0,0,0|1,0,0]=3 322 B8R0.8 CCCNC(=O)C(=O)C WXVL_AK00504SB0051 [1,1,0,0,0,0|2,0,0]=4 323 B8R0.8 CCCNC(=O)C(=O)C WXVL_AK00504SB0051 [1,1,0,0,0,0|2,0,0]=4 324 B8R0.8 CCCNC(=O)C(C)C WXVL_AK00504SB0052 [1,1,0,0,0,0|2,0,0]=4 325 B8R0.8 CCCNC(=O)C(C)C WXVL_AK00504SB0052 [1,1,0,0,0,0|2,0,0]=4 326 B8R0.8 CCCNC(=O)C(C)S WXVL_AK00504SB2708 [1,1,0,0,0,0|2,0,0]=4 327 B8R0.8 CCCNC(=O)C(C)S WXVL_AK00504SB2708 [1,1,0,0,0,0|2,0,0]=4 328 B8R0.8 CCCNC(=O)[C@@H](C)O WXVL_AK00504SB1085 [1,1,0,0,0,0|2,0,0]=4 329 B8R0.8 CCCNC(=O)[C@@H](C)O WXVL_AK00504SB1085 [1,1,0,0,0,0|2,0,0]=4 330 B8R0.8 CCOCC(=O)N(C)C WXVL_AN0032SB0091 [1,1,0,0,0,0|2,0,0]=4 331 B8R0.8 CCOCC(=O)N(C)C WXVL_AN0032SB0091 [1,1,0,0,0,0|2,0,0]=4 332 B8R0.8 CCSCC(=O)N(C)C WXVL_AN0032SB0002 [1,1,0,0,0,0|2,0,0]=4 333 B8R0.8 CCSCC(=O)N(C)C WXVL_AN0032SB0002 [1,1,0,0,0,0|2,0,0]=4 334 B8R0.8 COCCC(=O)N(C)C WXVL_AN0032SB0156 [1,1,0,0,0,0|2,0,0]=4 335 B8R0.8 COCCC(=O)N(C)C WXVL_AN0032SB0156 [1,1,0,0,0,0|2,0,0]=4 336 B8R0.8 CSCCC(=O)N(C)C WXVL_AN0032SB0361 [1,1,0,0,0,0|2,0,0]=4 337 B8R0.8 CSCCC(=O)N(C)C WXVL_AN0032SB0361 [1,1,0,0,0,0|2,0,0]=4 338 B8R0.9 CCC(=O)NCC(C)C WXVL_AK00544SB0064 [1,1,0,0,0,0|2,0,0]=4 339 B8R0.9 CCC(=O)NCC(C)C WXVL_AK00544SB0064 [1,1,0,0,0,0|2,0,0]=4 340 B8R0.9 CCC(=O)NCC(C)O WXVL_AK0052SB0064 [1,1,0,0,0,0|2,0,0]=4 341 B8R0.9 CCC(=O)NCC(C)O WXVL_AK0052SB0064 [1,1,0,0,0,0|2,0,0]=4 342 B8R0.9 CCC(=O)NC[C@H](C)O WXVL_AK0113SB0064 [1,1,0,0,0,0|2,0,0]=4 343 B8R0.9 CCC(=O)NC[C@H](C)O WXVL_AK0113SB0064 [1,1,0,0,0,0|2,0,0]=4 344 B8R0.9 CNC(=O)CCC(=O)C WXVL_AK00442SB0072 [1,1,0,0,0,0|1,0,1]=4 345 B8R0.9 CNC(=O)CCC(=O)C WXVL_AK00442SB0072 [1,1,0,0,0,0|1,0,1]=4 346 B8R0.9 CNC(=O)CCC(C)C WXVL_AK00442SB0354 [1,1,0,0,0,0|1,0,0]=3 347 B8R0.9 CNC(=O)CCC(C)C WXVL_AK00442SB0354 [1,1,0,0,0,0|1,0,0]=3 348 B8R0.9 CNC(=O)CCN(C)C WXVL_AK00442SB00052 [1,1,0,0,0,0|2,0,0]=4 349 B8R0.9 CNC(=O)CCN(C)C WXVL_AK00442SB00052 [1,1,0,0,0,0|2,0,0]=4 350 B8R0.9 CNC(=O)COC(C)C WXVL_AK00442SB0213 [1,1,0,0,0,0|2,0,0]=4 351 B8R0.9 CNC(=O)COC(C)C WXVL_AK00442SB0213 [1,1,0,0,0,0|2,0,0]=4 352 B8R0.9 COC(=O)CCC(=O)N WXVL_AK0084SB0069 [1,1,0,0,0,0|1,0,1]=4 353 B8R0.9 COC(=O)CCC(=O)N WXVL_AK0084SB0069 [1,1,0,0,0,0|1,0,1]=4 354 B8R0.19 CCC(=O)N[C@@H](C)CC WXVL_AK00678SB0064 [1,1,0,0,0,0|2,0,0]=4 355 B8R0.19 CCC(=O)N[C@@H](C)CC WXVL_AK00678SB0064 [1,1,0,0,0,0|2,0,0]=4 356 B8R0.19 CCC(C)CC(=O)NC WXVL_AK00442SB0353 [1,1,0,0,0,0|1,0,0]=3 357 B8R0.19 CCC(C)CC(=O)NC WXVL_AK00442SB0353 [1,1,0,0,0,0|1,0,0]=3 358 B8R0.19 CCC(O)CC(=O)NC WXVL_AK00442SB4092 [1,1,0,0,0,0|1,0,0]=3 359 B8R0.19 CCC(O)CC(=O)NC WXVL_AK00442SB4092 [1,1,0,0,0,0|1,0,0]=3 360 B8R0.19 CC[C@@H](C)CC(=O)NC WXVL_AK00442SB8650 [1,1,0,0,0,0|1,0,0]=3 361 B8R0.19 CC[C@@H](C)CC(=O)NC WXVL_AK00442SB8650 [1,1,0,0,0,0|1,0,0]=3 362 B8R0.19 CNC(=O)CC(=O)OC WXVL_AK00442SB2790 [1,1,0,0,0,0|1,0,1]=4 363 B8R0.19 CNC(=O)CC(=O)OC WXVL_AK00442SB2790 [1,1,0,0,0,0|1,0,1]=4 364 B8R0.25 CCCCS(=O)(=O)NC WXVL_AK00442HU0031 [1,1,0,0,0,0|2,0,0]=4 365 B8R0.25 CCCCS(=O)(=O)NC WXVL_AK00442HU0031 [1,1,0,0,0,0|2,0,0]=4 366 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [1,1,0,0,0,0|2,0,0]=4 367 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [1,1,0,0,0,0|2,0,0]=4 368 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [1,1,0,0,0,0|1,0,0]=3 369 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [1,1,0,0,0,0|1,0,0]=3 370 B8R0.5 COC[C@@H](C)NC(=O)C WXVL_AK00613SB0150 [1,1,0,0,0,0|2,0,0]=4 371 B8R0.5 COC[C@@H](C)NC(=O)C WXVL_AK00613SB0150 [1,1,0,0,0,0|2,0,0]=4 372 B8R0.5 COC[C@H](C)NC(=O)C WXVL_AK0137SB0150 [1,1,0,0,0,0|2,0,0]=4 373 B8R0.5 COC[C@H](C)NC(=O)C WXVL_AK0137SB0150 [1,1,0,0,0,0|2,0,0]=4 374 B8R0.28 CC(=O)NCCC(C)C WXVL_AK0068SB0150 [1,1,0,0,0,0|1,0,0]=3 375 B8R0.28 CC(=O)NCCC(C)C WXVL_AK0068SB0150 [1,1,0,0,0,0|1,0,0]=3 376 B8R0.28 CC(=O)NCCN(C)C WXVL_AK0058SB0150 [1,1,0,0,0,0|2,0,0]=4 377 B8R0.28 CC(=O)NCCN(C)C WXVL_AK0058SB0150 [1,1,0,0,0,0|2,0,0]=4 378 B8R0.28 CC(C)CCCC(=O)N WXVL_AK0084SB1301 [1,1,0,0,0,0|1,0,0]=3 379 B8R0.28 CC(C)CCCC(=O)N WXVL_AK0084SB1301 [1,1,0,0,0,0|1,0,0]=3 380 B8R0.28 CN(C)CCCC(=O)N WXVL_AK0084SB00055 [1,1,0,0,0,0|2,0,0]=4 381 B8R0.28 CN(C)CCCC(=O)N WXVL_AK0084SB00055 [1,1,0,0,0,0|2,0,0]=4 382 B10R0.3 C/C=C/C(=O)NCCC(C)C WXVL_AK0068SB0340 [0,2,0,0,0,0|2,0,0]=4 383 B10R0.3 C/C=C/C(=O)NCCC(C)C WXVL_AK0068SB0340 [0,2,0,0,0,0|2,0,0]=4 384 B10R0.3 CC#CC(=O)NCCC(C)C WXVL_AK0068SB1240 [0,2,0,0,0,0|2,0,0]=4 385 B10R0.3 CC#CC(=O)NCCC(C)C WXVL_AK0068SB1240 [0,2,0,0,0,0|2,0,0]=4 386 B10R0.3 CCCC(=O)NCCC(C)C WXVL_AK0068SB0073 [0,2,0,0,0,0|2,0,0]=4 387 B10R0.3 CCCC(=O)NCCC(C)C WXVL_AK0068SB0073 [0,2,0,0,0,0|2,0,0]=4 388 B10R0.3 CCNC(=O)CCCC(C)C WXVL_AK00476SB1301 [0,2,0,0,0,0|1,0,0]=3 389 B10R0.3 CCNC(=O)CCCC(C)C WXVL_AK00476SB1301 [0,2,0,0,0,0|1,0,0]=3 390 B10R0.3 CCNC(=O)CCCN(C)C WXVL_AK00476SB00055 [0,2,0,0,0,0|2,0,0]=4 391 B10R0.3 CCNC(=O)CCCN(C)C WXVL_AK00476SB00055 [0,2,0,0,0,0|2,0,0]=4 392 B10R0.3 CCOC(=O)CCNC(=O)C WXVL_AK0465SB0150 [0,2,0,0,0,0|1,0,1]=4 393 B10R0.3 CCOC(=O)CCNC(=O)C WXVL_AK0465SB0150 [0,2,0,0,0,0|1,0,1]=4 394 B10R0.3 COCC(=O)NCCC(C)C WXVL_AK0068SB0090 [0,2,0,0,0,0|1,0,0]=3 395 B10R0.3 COCC(=O)NCCC(C)C WXVL_AK0068SB0090 [0,2,0,0,0,0|1,0,0]=3 396 B10R0.3 COCC(=O)NCCN(C)C WXVL_AK0058SB0090 [0,2,0,0,0,0|2,0,0]=4 397 B10R0.3 COCC(=O)NCCN(C)C WXVL_AK0058SB0090 [0,2,0,0,0,0|2,0,0]=4 398 B10R0.3 CSCC(=O)NCCC(C)C WXVL_AK0068SB1267 [0,2,0,0,0,0|1,1,0]=4 399 B10R0.3 CSCC(=O)NCCC(C)C WXVL_AK0068SB1267 [0,2,0,0,0,0|1,1,0]=4 400 B10R0.44 COC(=O)CC(=O)NC(C)C WXVL_AK0030SB2790 [0,2,0,0,0,0|1,0,1]=4 401 B10R0.44 COC(=O)CC(=O)NC(C)C WXVL_AK0030SB2790 [0,2,0,0,0,0|1,0,1]=4 402 B10R0.44 COC(=O)CC(C)NC(=O)C WXVL_AK4097SB0150 [0,2,0,0,0,0|1,0,1]=4 403 B10R0.44 COC(=O)CC(C)NC(=O)C WXVL_AK4097SB0150 [0,2,0,0,0,0|1,0,1]=4 404 B10R0.44 COC(=O)C[C@@H](C)NC(=O)C WXVL_AK5300SB0150 [0,2,0,0,0,0|1,0,1]=4 405 B10R0.44 COC(=O)C[C@@H](C)NC(=O)C WXVL_AK5300SB0150 [0,2,0,0,0,0|1,0,1]=4 406 B10R0.59 CCC(=O)NCCC(C)CO WXVL_AK4143SB0064 [0,2,0,0,0,0|2,0,0]=4 407 B10R0.59 CCC(=O)NCCC(C)CO WXVL_AK4143SB0064 [0,2,0,0,0,0|2,0,0]=4 408 B10R0.60 CCC(=O)NCCC(C)(C)O WXVL_AK1558SB0064 [0,2,0,0,0,0|2,0,0]=4 409 B10R0.60 CCC(=O)NCCC(C)(C)O WXVL_AK1558SB0064 [0,2,0,0,0,0|2,0,0]=4 410 B10R0.60 CNC(=O)CCCC(F)(F)F WXVL_AK00442SB1398 [0,2,0,0,0,0|2,0,0]=4 411 B10R0.60 CNC(=O)CCCC(F)(F)F WXVL_AK00442SB1398 [0,2,0,0,0,0|2,0,0]=4 412 B10R0.82 COC(=O)CCC(=O)N(C)C WXVL_AN0032SB0069 [0,2,0,0,0,0|1,0,1]=4 413 B10R0.82 COC(=O)CCC(=O)N(C)C WXVL_AN0032SB0069 [0,2,0,0,0,0|1,0,1]=4 414 B10R0.98 CC(=O)C(=O)NCCC(C)C WXVL_AK0068SB0051 [0,2,0,0,0,0|2,0,0]=4 415 B10R0.98 CC(=O)C(=O)NCCC(C)C WXVL_AK0068SB0051 [0,2,0,0,0,0|2,0,0]=4 416 B10R0.98 CC(C)CCCC(=O)N(C)C WXVL_AN0032SB1301 [0,2,0,0,0,0|1,0,0]=3 417 B10R0.98 CC(C)CCCC(=O)N(C)C WXVL_AN0032SB1301 [0,2,0,0,0,0|1,0,0]=3 418 B10R0.98 CC(C)CCNC(=O)C(C)C WXVL_AK0068SB0052 [0,2,0,0,0,0|2,0,0]=4 419 B10R0.98 CC(C)CCNC(=O)C(C)C WXVL_AK0068SB0052 [0,2,0,0,0,0|2,0,0]=4 420 B10R0.98 CC(C)CCNC(=O)C(C)S WXVL_AK0068SB2708 [0,2,0,0,0,0|2,0,0]=4 421 B10R0.98 CC(C)CCNC(=O)C(C)S WXVL_AK0068SB2708 [0,2,0,0,0,0|2,0,0]=4 422 B10R0.98 CC(C)CCNC(=O)[C@@H](C)O WXVL_AK0068SB1085 [0,2,0,0,0,0|2,0,0]=4 423 B10R0.98 CC(C)CCNC(=O)[C@@H](C)O WXVL_AK0068SB1085 [0,2,0,0,0,0|2,0,0]=4 424 B10R0.98 CN(C)CCCC(=O)N(C)C WXVL_AN0032SB00055 [0,2,0,0,0,0|2,0,0]=4 425 B10R0.98 CN(C)CCCC(=O)N(C)C WXVL_AN0032SB00055 [0,2,0,0,0,0|2,0,0]=4 426 B10R0.1 C#CCC(=O)NCCCCC WXVL_AK0076SB3070 [0,2,0,0,0,0|1,0,1]=4 427 B10R0.1 C#CCC(=O)NCCCCC WXVL_AK0076SB3070 [0,2,0,0,0,0|1,0,1]=4 428 B10R0.1 C#CCCCNC(=O)COC WXVL_AK00218SB0090 [0,2,0,0,0,0|0,0,2]=4 429 B10R0.1 C#CCCCNC(=O)COC WXVL_AK00218SB0090 [0,2,0,0,0,0|0,0,2]=4 430 B10R0.1 C/C=C/C(=O)NCCCCC WXVL_AK0076SB0340 [0,2,0,0,0,0|1,0,0]=3 431 B10R0.1 C/C=C/C(=O)NCCCCC WXVL_AK0076SB0340 [0,2,0,0,0,0|1,0,0]=3 432 B10R0.1 C/C=C/C(=O)NCCCCO WXVL_AK0075SB0340 [0,2,0,0,0,0|2,0,0]=4 433 B10R0.1 C/C=C/C(=O)NCCCCO WXVL_AK0075SB0340 [0,2,0,0,0,0|2,0,0]=4 434 B10R0.1 C/C=C/C(=O)NCCCOC WXVL_AK00637SB0340 [0,2,0,0,0,0|2,0,0]=4 435 B10R0.1 C/C=C/C(=O)NCCCOC WXVL_AK00637SB0340 [0,2,0,0,0,0|2,0,0]=4 436 B10R0.1 C/C=C/C(=O)NCCCSC WXVL_AK0965SB0340 [0,2,0,0,0,0|2,0,0]=4 437 B10R0.1 C/C=C/C(=O)NCCCSC WXVL_AK0965SB0340 [0,2,0,0,0,0|2,0,0]=4 438 B10R0.1 C/C=C/C(=O)NCCSCC WXVL_AK00494SB0340 [0,2,0,0,0,0|2,0,0]=4 439 B10R0.1 C/C=C/C(=O)NCCSCC WXVL_AK00494SB0340 [0,2,0,0,0,0|2,0,0]=4 440 B10R0.1 C=CCC(=O)NCCCCC WXVL_AK0076SB2732 [0,2,0,0,0,0|1,0,1]=4 441 B10R0.1 C=CCC(=O)NCCCCC WXVL_AK0076SB2732 [0,2,0,0,0,0|1,0,1]=4 442 B10R0.1 CC#CC(=O)NCCCCC WXVL_AK0076SB1240 [0,2,0,0,0,0|1,0,0]=3 443 B10R0.1 CC#CC(=O)NCCCCC WXVL_AK0076SB1240 [0,2,0,0,0,0|1,0,0]=3 444 B10R0.1 CC#CC(=O)NCCCCO WXVL_AK0075SB1240 [0,2,0,0,0,0|2,0,0]=4 445 B10R0.1 CC#CC(=O)NCCCCO WXVL_AK0075SB1240 [0,2,0,0,0,0|2,0,0]=4 446 B10R0.1 CC#CC(=O)NCCCOC WXVL_AK00637SB1240 [0,2,0,0,0,0|2,0,0]=4 447 B10R0.1 CC#CC(=O)NCCCOC WXVL_AK00637SB1240 [0,2,0,0,0,0|2,0,0]=4 448 B10R0.1 CC#CC(=O)NCCCSC WXVL_AK0965SB1240 [0,2,0,0,0,0|2,0,0]=4 449 B10R0.1 CC#CC(=O)NCCCSC WXVL_AK0965SB1240 [0,2,0,0,0,0|2,0,0]=4 450 B10R0.1 CC#CC(=O)NCCSCC WXVL_AK00494SB1240 [0,2,0,0,0,0|2,0,0]=4 451 B10R0.1 CC#CC(=O)NCCSCC WXVL_AK00494SB1240 [0,2,0,0,0,0|2,0,0]=4 452 B10R0.1 CCCC(=O)NCCCCO WXVL_AK0075SB0073 [0,2,0,0,0,0|2,0,0]=4 453 B10R0.1 CCCC(=O)NCCCCO WXVL_AK0075SB0073 [0,2,0,0,0,0|2,0,0]=4 454 B10R0.1 CCCC(=O)NCCCOC WXVL_AK00637SB0073 [0,2,0,0,0,0|2,0,0]=4 455 B10R0.1 CCCC(=O)NCCCOC WXVL_AK00637SB0073 [0,2,0,0,0,0|2,0,0]=4 456 B10R0.1 CCCC(=O)NCCCSC WXVL_AK0965SB0073 [0,2,0,0,0,0|2,0,0]=4 457 B10R0.1 CCCC(=O)NCCCSC WXVL_AK0965SB0073 [0,2,0,0,0,0|2,0,0]=4 458 B10R0.1 CCCC(=O)NCCSCC WXVL_AK00494SB0073 [0,2,0,0,0,0|2,0,0]=4 459 B10R0.1 CCCC(=O)NCCSCC WXVL_AK00494SB0073 [0,2,0,0,0,0|2,0,0]=4 460 B10R0.1 CCCCCNC(=O)CC#N WXVL_AK0076SB0057 [0,2,0,0,0,0|1,0,1]=4 461 B10R0.1 CCCCCNC(=O)CC#N WXVL_AK0076SB0057 [0,2,0,0,0,0|1,0,1]=4 462 B10R0.1 CCCCCNC(=O)CCC WXVL_AK0076SB0073 [0,2,0,0,0,0|1,0,0]=3 463 B10R0.1 CCCCCNC(=O)CCC WXVL_AK0076SB0073 [0,2,0,0,0,0|1,0,0]=3 464 B10R0.1 CCCCCNC(=O)COC WXVL_AK0076SB0090 [0,2,0,0,0,0|0,0,0]=2 465 B10R0.1 CCCCCNC(=O)COC WXVL_AK0076SB0090 [0,2,0,0,0,0|0,0,0]=2 466 B10R0.1 CCCCCNC(=O)CSC WXVL_AK0076SB1267 [0,2,0,0,0,0|0,1,0]=3 467 B10R0.1 CCCCCNC(=O)CSC WXVL_AK0076SB1267 [0,2,0,0,0,0|0,1,0]=3 468 B10R0.1 CCNC(=O)CCCCCBr WXVL_AK00476SB2192 [0,2,0,0,0,0|1,0,0]=3 469 B10R0.1 CCNC(=O)CCCCCBr WXVL_AK00476SB2192 [0,2,0,0,0,0|1,0,0]=3 470 B10R0.1 CCNC(=O)CCCCCO WXVL_AK00476SB2973 [0,2,0,0,0,0|1,0,0]=3 471 B10R0.1 CCNC(=O)CCCCCO WXVL_AK00476SB2973 [0,2,0,0,0,0|1,0,0]=3 472 B10R0.1 CCNC(=O)COCCOC WXVL_AK00476SB0159 [0,2,0,0,0,0|2,0,0]=4 473 B10R0.1 CCNC(=O)COCCOC WXVL_AK00476SB0159 [0,2,0,0,0,0|2,0,0]=4 474 B10R0.1 CCSCCNC(=O)COC WXVL_AK00494SB0090 [0,2,0,0,0,0|1,0,0]=3 475 B10R0.1 CCSCCNC(=O)COC WXVL_AK00494SB0090 [0,2,0,0,0,0|1,0,0]=3 476 B10R0.1 CCSCCNC(=O)CSC WXVL_AK00494SB1267 [0,2,0,0,0,0|1,1,0]=4 477 B10R0.1 CCSCCNC(=O)CSC WXVL_AK00494SB1267 [0,2,0,0,0,0|1,1,0]=4 478 B10R0.1 COCC(=O)NCCCCO WXVL_AK0075SB0090 [0,2,0,0,0,0|1,0,0]=3 479 B10R0.1 COCC(=O)NCCCCO WXVL_AK0075SB0090 [0,2,0,0,0,0|1,0,0]=3 480 B10R0.1 COCC(=O)NCCCSC WXVL_AK0965SB0090 [0,2,0,0,0,0|1,0,0]=3 481 B10R0.1 COCC(=O)NCCCSC WXVL_AK0965SB0090 [0,2,0,0,0,0|1,0,0]=3 482 B10R0.1 COCCCNC(=O)COC WXVL_AK00637SB0090 [0,2,0,0,0,0|1,0,0]=3 483 B10R0.1 COCCCNC(=O)COC WXVL_AK00637SB0090 [0,2,0,0,0,0|1,0,0]=3 484 B10R0.1 COCCCNC(=O)CSC WXVL_AK00637SB1267 [0,2,0,0,0,0|1,1,0]=4 485 B10R0.1 COCCCNC(=O)CSC WXVL_AK00637SB1267 [0,2,0,0,0,0|1,1,0]=4 486 B10R0.1 CSCC(=O)NCCCCO WXVL_AK0075SB1267 [0,2,0,0,0,0|1,1,0]=4 487 B10R0.1 CSCC(=O)NCCCCO WXVL_AK0075SB1267 [0,2,0,0,0,0|1,1,0]=4 488 B10R0.1 CSCCCNC(=O)CSC WXVL_AK0965SB1267 [0,2,0,0,0,0|1,1,0]=4 489 B10R0.1 CSCCCNC(=O)CSC WXVL_AK0965SB1267 [0,2,0,0,0,0|1,1,0]=4 490 B10R0.2 C/C=C/C(=O)N[C@@H](C)CCC WXVL_AK00682SB0340 [0,2,0,0,0,0|2,0,0]=4 491 B10R0.2 C/C=C/C(=O)N[C@@H](C)CCC WXVL_AK00682SB0340 [0,2,0,0,0,0|2,0,0]=4 492 B10R0.2 CC#CC(=O)N[C@@H](C)CCC WXVL_AK00682SB1240 [0,2,0,0,0,0|2,0,0]=4 493 B10R0.2 CC#CC(=O)N[C@@H](C)CCC WXVL_AK00682SB1240 [0,2,0,0,0,0|2,0,0]=4 494 B10R0.2 CCCC(=O)N[C@@H](C)CCC WXVL_AK00682SB0073 [0,2,0,0,0,0|2,0,0]=4 495 B10R0.2 CCCC(=O)N[C@@H](C)CCC WXVL_AK00682SB0073 [0,2,0,0,0,0|2,0,0]=4 496 B10R0.2 CCC[C@H](C)NC(=O)COC WXVL_AK00682SB0090 [0,2,0,0,0,0|1,0,0]=3 497 B10R0.2 CCC[C@H](C)NC(=O)COC WXVL_AK00682SB0090 [0,2,0,0,0,0|1,0,0]=3 498 B10R0.2 CCC[C@H](C)NC(=O)CSC WXVL_AK00682SB1267 [0,2,0,0,0,0|1,1,0]=4 499 B10R0.2 CCC[C@H](C)NC(=O)CSC WXVL_AK00682SB1267 [0,2,0,0,0,0|1,1,0]=4 500 B10R0.2 CCNC(=O)CC(=O)OCC WXVL_AK00476SB3094 [0,2,0,0,0,0|1,0,1]=4 501 B10R0.2 CCNC(=O)CC(=O)OCC WXVL_AK00476SB3094 [0,2,0,0,0,0|1,0,1]=4 502 B10R0.2 COCC(=O)NC(C)CCO WXVL_AK1288SB0090 [0,2,0,0,0,0|2,0,0]=4 503 B10R0.2 COCC(=O)NC(C)CCO WXVL_AK1288SB0090 [0,2,0,0,0,0|2,0,0]=4 504 B10R0.2 COCC(=O)N[C@@H](C)COC WXVL_AK0137SB0090 [0,2,0,0,0,0|2,0,0]=4 505 B10R0.2 COCC(=O)N[C@@H](C)COC WXVL_AK0137SB0090 [0,2,0,0,0,0|2,0,0]=4 506 B10R0.2 COCC(=O)N[C@H](C)COC WXVL_AK00613SB0090 [0,2,0,0,0,0|2,0,0]=4 507 B10R0.2 COCC(=O)N[C@H](C)COC WXVL_AK00613SB0090 [0,2,0,0,0,0|2,0,0]=4 508 B10R0.6 CC(C)NC(=O)CCCCBr WXVL_AK0030SB3153 [0,2,0,0,0,0|2,0,0]=4 509 B10R0.6 CC(C)NC(=O)CCCCBr WXVL_AK0030SB3153 [0,2,0,0,0,0|2,0,0]=4 510 B10R0.6 CC(C)NC(=O)CCCCCl WXVL_AK0030SB0379 [0,2,0,0,0,0|2,0,0]=4 511 B10R0.6 CC(C)NC(=O)CCCCCl WXVL_AK0030SB0379 [0,2,0,0,0,0|2,0,0]=4 512 B10R0.6 CCCCNC(=O)C=C(C)C WXVL_AK00588SB0342 [0,2,0,0,0,0|2,0,0]=4 513 B10R0.6 CCCCNC(=O)C=C(C)C WXVL_AK00588SB0342 [0,2,0,0,0,0|2,0,0]=4 514 B10R0.6 CCCCNC(=O)CC(C)C WXVL_AK00588SB0063 [0,2,0,0,0,0|2,0,0]=4 515 B10R0.6 CCCCNC(=O)CC(C)C WXVL_AK00588SB0063 [0,2,0,0,0,0|2,0,0]=4 516 B10R0.6 CCCCNC(=O)CC(C)O WXVL_AK00588SB3643 [0,2,0,0,0,0|2,0,0]=4 517 B10R0.6 CCCCNC(=O)CC(C)O WXVL_AK00588SB3643 [0,2,0,0,0,0|2,0,0]=4 518 B10R0.6 CCCCNC(=O)CN(C)C WXVL_AK00588SB0085 [0,2,0,0,0,0|2,0,0]=4 519 B10R0.6 CCCCNC(=O)CN(C)C WXVL_AK00588SB0085 [0,2,0,0,0,0|2,0,0]=4 520 B10R0.19 CCCCC(O)C(=O)NCC WXVL_AK00476SB3429 [0,2,0,0,0,0|1,0,0]=3 521 B10R0.19 CCCCC(O)C(=O)NCC WXVL_AK00476SB3429 [0,2,0,0,0,0|1,0,0]=3 522 B10R0.19 CCCNC(=O)C(=O)OCC WXVL_AK00504SB4144 [0,2,0,0,0,0|1,0,1]=4 523 B10R0.19 CCCNC(=O)C(=O)OCC WXVL_AK00504SB4144 [0,2,0,0,0,0|1,0,1]=4 524 B10R0.19 COCCN(C)C(=O)COC WXVL_AN0085SB0090 [0,2,0,0,0,0|2,0,0]=4 525 B10R0.19 COCCN(C)C(=O)COC WXVL_AN0085SB0090 [0,2,0,0,0,0|2,0,0]=4 526 B10R0.83 C/C=C(\C)/C(=O)NCCCC WXVL_AK00588SB0343 [0,2,0,0,0,0|2,0,0]=4 527 B10R0.83 C/C=C(\C)/C(=O)NCCCC WXVL_AK00588SB0343 [0,2,0,0,0,0|2,0,0]=4 528 B10R0.83 CCCCCC(C)C(=O)NC WXVL_AK00442SB0394 [0,2,0,0,0,0|1,0,0]=3 529 B10R0.83 CCCCCC(C)C(=O)NC WXVL_AK00442SB0394 [0,2,0,0,0,0|1,0,0]=3 530 B10R0.83 CCCCNC(=O)C(=O)CC WXVL_AK00588SB0344 [0,2,0,0,0,0|1,0,1]=4 531 B10R0.83 CCCCNC(=O)C(=O)CC WXVL_AK00588SB0344 [0,2,0,0,0,0|1,0,1]=4 532 B10R0.83 CCCCNC(=O)C(C)CC WXVL_AK00588SB0054 [0,2,0,0,0,0|2,0,0]=4 533 B10R0.83 CCCCNC(=O)C(C)CC WXVL_AK00588SB0054 [0,2,0,0,0,0|2,0,0]=4 534 B10R0.83 CCCCNC(=O)[C@@H](C)OC WXVL_AK00588SB2926 [0,2,0,0,0,0|1,0,0]=3 535 B10R0.83 CCCCNC(=O)[C@@H](C)OC WXVL_AK00588SB2926 [0,2,0,0,0,0|1,0,0]=3 536 B10R0.83 CCCCNC(=O)[C@@H](O)CC WXVL_AK00588SB3573 [0,2,0,0,0,0|2,0,0]=4 537 B10R0.83 CCCCNC(=O)[C@@H](O)CC WXVL_AK00588SB3573 [0,2,0,0,0,0|2,0,0]=4 538 B10R0.83 CCCCNC(=O)[C@H](C)CC WXVL_AK00588SB00054 [0,2,0,0,0,0|2,0,0]=4 539 B10R0.83 CCCCNC(=O)[C@H](C)CC WXVL_AK00588SB00054 [0,2,0,0,0,0|2,0,0]=4 540 B10R0.83 CO[C@H](C)C(=O)NCCCO WXVL_AK0073SB2926 [0,2,0,0,0,0|2,0,0]=4 541 B10R0.83 CO[C@H](C)C(=O)NCCCO WXVL_AK0073SB2926 [0,2,0,0,0,0|2,0,0]=4 542 B10R0.83 CO[C@H](C)C(=O)NCCSC WXVL_AK00440SB2926 [0,2,0,0,0,0|2,0,0]=4 543 B10R0.83 CO[C@H](C)C(=O)NCCSC WXVL_AK00440SB2926 [0,2,0,0,0,0|2,0,0]=4 544 B10R0.91 C#CCCC(=O)NCCCC WXVL_AK00588SB2189 [0,2,0,0,0,0|2,0,0]=4 545 B10R0.91 C#CCCC(=O)NCCCC WXVL_AK00588SB2189 [0,2,0,0,0,0|2,0,0]=4 546 B10R0.91 C=CCCC(=O)NCCCC WXVL_AK00588SB1035 [0,2,0,0,0,0|2,0,0]=4 547 B10R0.91 C=CCCC(=O)NCCCC WXVL_AK00588SB1035 [0,2,0,0,0,0|2,0,0]=4 548 B10R0.91 C=CCNC(=O)CCCCBr WXVL_AK00561SB3153 [0,2,0,0,0,0|2,0,0]=4 549 B10R0.91 C=CCNC(=O)CCCCBr WXVL_AK00561SB3153 [0,2,0,0,0,0|2,0,0]=4 550 B10R0.91 C=CCNC(=O)CCCCCl WXVL_AK00561SB0379 [0,2,0,0,0,0|2,0,0]=4 551 B10R0.91 C=CCNC(=O)CCCCCl WXVL_AK00561SB0379 [0,2,0,0,0,0|2,0,0]=4 552 B10R0.91 CCCCNC(=O)/C=C/CBr WXVL_AK00588SB0424 [0,2,0,0,0,0|2,0,0]=4 553 B10R0.91 CCCCNC(=O)/C=C/CBr WXVL_AK00588SB0424 [0,2,0,0,0,0|2,0,0]=4 554 B10R0.91 CCCCNC(=O)CCOC WXVL_AK00588SB0156 [0,2,0,0,0,0|1,0,0]=3 555 B10R0.91 CCCCNC(=O)CCOC WXVL_AK00588SB0156 [0,2,0,0,0,0|1,0,0]=3 556 B10R0.91 CCCCNC(=O)CCSC WXVL_AK00588SB0361 [0,2,0,0,0,0|1,1,0]=4 557 B10R0.91 CCCCNC(=O)CCSC WXVL_AK00588SB0361 [0,2,0,0,0,0|1,1,0]=4 558 B10R0.91 CCCCNC(=O)COCC WXVL_AK00588SB0091 [0,2,0,0,0,0|1,0,0]=3 559 B10R0.91 CCCCNC(=O)COCC WXVL_AK00588SB0091 [0,2,0,0,0,0|1,0,0]=3 560 B10R0.91 CCCCNC(=O)CSCC WXVL_AK00588SB0002 [0,2,0,0,0,0|1,1,0]=4 561 B10R0.91 CCCCNC(=O)CSCC WXVL_AK00588SB0002 [0,2,0,0,0,0|1,1,0]=4 562 B10R0.91 CCCCNC(=O)NCCCl WXVL_AK00588YV0092 [0,2,0,0,0,0|2,0,0]=4 563 B10R0.91 CCCCNC(=O)NCCCl WXVL_AK00588YV0092 [0,2,0,0,0,0|2,0,0]=4 564 B10R0.91 CCCNC(=O)CCCCBr WXVL_AK00504SB3153 [0,2,0,0,0,0|2,0,0]=4 565 B10R0.91 CCCNC(=O)CCCCBr WXVL_AK00504SB3153 [0,2,0,0,0,0|2,0,0]=4 566 B10R0.91 CCCNC(=O)CCCCCl WXVL_AK00504SB0379 [0,2,0,0,0,0|2,0,0]=4 567 B10R0.91 CCCNC(=O)CCCCCl WXVL_AK00504SB0379 [0,2,0,0,0,0|2,0,0]=4 568 B10R0.91 CCOCC(=O)NCCCO WXVL_AK0073SB0091 [0,2,0,0,0,0|2,0,0]=4 569 B10R0.91 CCOCC(=O)NCCCO WXVL_AK0073SB0091 [0,2,0,0,0,0|2,0,0]=4 570 B10R0.91 CCOCC(=O)NCCSC WXVL_AK00440SB0091 [0,2,0,0,0,0|2,0,0]=4 571 B10R0.91 CCOCC(=O)NCCSC WXVL_AK00440SB0091 [0,2,0,0,0,0|2,0,0]=4 572 B10R0.91 COCCC(=O)NCCCO WXVL_AK0073SB0156 [0,2,0,0,0,0|2,0,0]=4 573 B10R0.91 COCCC(=O)NCCCO WXVL_AK0073SB0156 [0,2,0,0,0,0|2,0,0]=4 574 B10R0.91 COCCC(=O)NCCSC WXVL_AK00440SB0156 [0,2,0,0,0,0|2,0,0]=4 575 B10R0.91 COCCC(=O)NCCSC WXVL_AK00440SB0156 [0,2,0,0,0,0|2,0,0]=4 576 B10R0.91 N#CCNC(=O)CCCCBr WXVL_AK0683SB3153 [0,2,0,0,0,0|2,0,0]=4 577 B10R0.91 N#CCNC(=O)CCCCBr WXVL_AK0683SB3153 [0,2,0,0,0,0|2,0,0]=4 578 B10R0.91 N#CCNC(=O)CCCCCl WXVL_AK0683SB0379 [0,2,0,0,0,0|2,0,0]=4 579 B10R0.91 N#CCNC(=O)CCCCCl WXVL_AK0683SB0379 [0,2,0,0,0,0|2,0,0]=4 580 B10R0.91 O=C(CCCCBr)NCCF WXVL_AK00466SB3153 [0,2,0,0,0,0|2,0,0]=4 581 B10R0.91 O=C(CCCCBr)NCCF WXVL_AK00466SB3153 [0,2,0,0,0,0|2,0,0]=4 582 B10R0.91 O=C(CCCCCl)NCCF WXVL_AK00466SB0379 [0,2,0,0,0,0|2,0,0]=4 583 B10R0.91 O=C(CCCCCl)NCCF WXVL_AK00466SB0379 [0,2,0,0,0,0|2,0,0]=4 584 B10R0.108 CCCC(=O)NCC(=O)NC WXVL_AK1222SB0073 [0,2,0,0,0,0|1,0,1]=4 585 B10R0.108 CCCC(=O)NCC(=O)NC WXVL_AK1222SB0073 [0,2,0,0,0,0|1,0,1]=4 586 B10R0.108 CCNC(=O)CCC(=O)OC WXVL_AK00476SB0069 [0,2,0,0,0,0|0,0,1]=3 587 B10R0.108 CCNC(=O)CCC(=O)OC WXVL_AK00476SB0069 [0,2,0,0,0,0|0,0,1]=3 588 B10R0.108 COCC(=O)NC[C@@H](C)OC WXVL_AK00704SB0090 [0,2,0,0,0,0|2,0,0]=4 589 B10R0.108 COCC(=O)NC[C@@H](C)OC WXVL_AK00704SB0090 [0,2,0,0,0,0|2,0,0]=4 590 B10R0.108 COCC(=O)NC[C@@H](F)CO WXVL_AK00590SB0090 [0,2,0,0,0,0|2,0,0]=4 591 B10R0.108 COCC(=O)NC[C@@H](F)CO WXVL_AK00590SB0090 [0,2,0,0,0,0|2,0,0]=4 592 B10R0.108 COCC(=O)NC[C@H](O)CO WXVL_AK00483SB0090 [0,2,0,0,0,0|2,0,0]=4 593 B10R0.108 COCC(=O)NC[C@H](O)CO WXVL_AK00483SB0090 [0,2,0,0,0,0|2,0,0]=4 594 B10R0.35 CCNC(=O)C(C)C(=O)OC WXVL_AK00476SB5708 [0,2,0,0,0,0|1,0,1]=4 595 B10R0.35 CCNC(=O)C(C)C(=O)OC WXVL_AK00476SB5708 [0,2,0,0,0,0|1,0,1]=4 596 B10R0.81 CCCCC(O)C(=O)N(C)C WXVL_AN0032SB3429 [0,2,0,0,0,0|1,0,0]=3 597 B10R0.81 CCCCC(O)C(=O)N(C)C WXVL_AN0032SB3429 [0,2,0,0,0,0|1,0,0]=3 598 B10R0.62 CCCCCNS(=O)(=O)CC WXVL_AK0076HU0028 [0,2,0,0,0,0|2,0,0]=4 599 B10R0.62 CCCCCNS(=O)(=O)CC WXVL_AK0076HU0028 [0,2,0,0,0,0|2,0,0]=4 600 B10R0.115 CNS(=O)(=O)CCC(=O)OC WXVL_AK00442HU0340 [0,2,0,0,0,0|2,0,0]=4 601 B10R0.115 CNS(=O)(=O)CCC(=O)OC WXVL_AK00442HU0340 [0,2,0,0,0,0|2,0,0]=4 602 B10R0.18 CCCNC(=O)CC(=O)OC WXVL_AK00504SB2790 [0,2,0,0,0,0|0,0,1]=3 603 B10R0.18 CCCNC(=O)CC(=O)OC WXVL_AK00504SB2790 [0,2,0,0,0,0|0,0,1]=3 604 B10R0.18 COC(=O)CC(=O)NCCF WXVL_AK00466SB2790 [0,2,0,0,0,0|1,0,1]=4 605 B10R0.18 COC(=O)CC(=O)NCCF WXVL_AK00466SB2790 [0,2,0,0,0,0|1,0,1]=4 606 B10R0.26 CCC[C@H](C)NC(=O)C(=O)C WXVL_AK00682SB0051 [0,2,0,0,0,0|2,0,0]=4 607 B10R0.26 CCC[C@H](C)NC(=O)C(=O)C WXVL_AK00682SB0051 [0,2,0,0,0,0|2,0,0]=4 608 B10R0.26 CCC[C@H](C)NC(=O)C(C)C WXVL_AK00682SB0052 [0,2,0,0,0,0|2,0,0]=4 609 B10R0.26 CCC[C@H](C)NC(=O)C(C)C WXVL_AK00682SB0052 [0,2,0,0,0,0|2,0,0]=4 610 B10R0.26 CCC[C@H](C)NC(=O)C(C)S WXVL_AK00682SB2708 [0,2,0,0,0,0|2,0,0]=4 611 B10R0.26 CCC[C@H](C)NC(=O)C(C)S WXVL_AK00682SB2708 [0,2,0,0,0,0|2,0,0]=4 612 B10R0.26 CCC[C@H](C)NC(=O)[C@@H](C)O WXVL_AK00682SB1085 [0,2,0,0,0,0|2,0,0]=4 613 B10R0.26 CCC[C@H](C)NC(=O)[C@@H](C)O WXVL_AK00682SB1085 [0,2,0,0,0,0|2,0,0]=4 614 B10R0.29 CCC[C@@H](CO)NC(=O)CC WXVL_AK2551SB0064 [0,2,0,0,0,0|2,0,0]=4 615 B10R0.29 CCC[C@@H](CO)NC(=O)CC WXVL_AK2551SB0064 [0,2,0,0,0,0|2,0,0]=4 616 B10R0.148 CCNS(=O)(=O)CC(=O)OC WXVL_AK00476HU0075 [0,2,0,0,0,0|2,0,0]=4 617 B10R0.148 CCNS(=O)(=O)CC(=O)OC WXVL_AK00476HU0075 [0,2,0,0,0,0|2,0,0]=4 618 B10R0.55 CCC(=O)NCCOC(C)C WXVL_AK0128SB0064 [0,2,0,0,0,0|2,0,0]=4 619 B10R0.55 CCC(=O)NCCOC(C)C WXVL_AK0128SB0064 [0,2,0,0,0,0|2,0,0]=4 620 B10R0.55 COC(=O)CCCCC(=O)N WXVL_AK0084SB1209 [0,2,0,0,0,0|0,0,1]=3 621 B10R0.55 COC(=O)CCCCC(=O)N WXVL_AK0084SB1209 [0,2,0,0,0,0|0,0,1]=3 622 B10R0.55 COC(=O)CCCNC(=O)C WXVL_AK00444SB0150 [0,2,0,0,0,0|0,0,1]=3 623 B10R0.55 COC(=O)CCCNC(=O)C WXVL_AK00444SB0150 [0,2,0,0,0,0|0,0,1]=3 624 B10R0.74 C#CC(=O)NCCCCCC WXVL_AK0286SB0338 [0,2,0,0,0,0|1,0,1]=4 625 B10R0.74 C#CC(=O)NCCCCCC WXVL_AK0286SB0338 [0,2,0,0,0,0|1,0,1]=4 626 B10R0.74 C#CC(=O)NCCCCCO WXVL_AK0077SB0338 [0,2,0,0,0,0|1,0,1]=4 627 B10R0.74 C#CC(=O)NCCCCCO WXVL_AK0077SB0338 [0,2,0,0,0,0|1,0,1]=4 628 B10R0.74 C#CC(=O)NCCCOCC WXVL_AK0072SB0338 [0,2,0,0,0,0|1,0,1]=4 629 B10R0.74 C#CC(=O)NCCCOCC WXVL_AK0072SB0338 [0,2,0,0,0,0|1,0,1]=4 630 B10R0.74 C#CCCCCNC(=O)CC WXVL_AK00614SB0064 [0,2,0,0,0,0|1,0,1]=4 631 B10R0.74 C#CCCCCNC(=O)CC WXVL_AK00614SB0064 [0,2,0,0,0,0|1,0,1]=4 632 B10R0.74 CCC(=O)NCCCCCO WXVL_AK0077SB0064 [0,2,0,0,0,0|1,0,0]=3 633 B10R0.74 CCC(=O)NCCCCCO WXVL_AK0077SB0064 [0,2,0,0,0,0|1,0,0]=3 634 B10R0.74 CCC(=O)NCCNCCO WXVL_AK0954SB0064 [0,2,0,0,0,0|2,0,0]=4 635 B10R0.74 CCC(=O)NCCNCCO WXVL_AK0954SB0064 [0,2,0,0,0,0|2,0,0]=4 636 B10R0.74 CCCCC/C=C/C(=O)NC WXVL_AK00442SB3331 [0,2,0,0,0,0|1,0,0]=3 637 B10R0.74 CCCCC/C=C/C(=O)NC WXVL_AK00442SB3331 [0,2,0,0,0,0|1,0,0]=3 638 B10R0.74 CCCCCCCC(=O)NC WXVL_AK00442SB0393 [0,2,0,0,0,0|1,0,0]=3 639 B10R0.74 CCCCCCCC(=O)NC WXVL_AK00442SB0393 [0,2,0,0,0,0|1,0,0]=3 640 B10R0.74 CCCCCCNC(=O)CC WXVL_AK0286SB0064 [0,2,0,0,0,0|1,0,0]=3 641 B10R0.74 CCCCCCNC(=O)CC WXVL_AK0286SB0064 [0,2,0,0,0,0|1,0,0]=3 642 B10R0.74 CCCCCCNC(=O)CO WXVL_AK0286SB2706 [0,2,0,0,0,0|2,0,0]=4 643 B10R0.74 CCCCCCNC(=O)CO WXVL_AK0286SB2706 [0,2,0,0,0,0|2,0,0]=4 644 B10R0.74 CCOCCCNC(=O)CC WXVL_AK0072SB0064 [0,2,0,0,0,0|1,0,0]=3 645 B10R0.74 CCOCCCNC(=O)CC WXVL_AK0072SB0064 [0,2,0,0,0,0|1,0,0]=3 646 B10R0.74 CCOCCCNC(=O)CO WXVL_AK0072SB2706 [0,2,0,0,0,0|2,0,0]=4 647 B10R0.74 CCOCCCNC(=O)CO WXVL_AK0072SB2706 [0,2,0,0,0,0|2,0,0]=4 648 B10R0.74 CNC(=O)CCCCCCBr WXVL_AK00442SB1386 [0,2,0,0,0,0|1,0,0]=3 649 B10R0.74 CNC(=O)CCCCCCBr WXVL_AK00442SB1386 [0,2,0,0,0,0|1,0,0]=3 650 B10R0.74 O=C(CO)NCCCCCO WXVL_AK0077SB2706 [0,2,0,0,0,0|2,0,0]=4 651 B10R0.74 O=C(CO)NCCCCCO WXVL_AK0077SB2706 [0,2,0,0,0,0|2,0,0]=4 652 B10R0.75 C=C(F)C(=O)NCCCCC WXVL_AK0076SB1376 [0,2,0,0,0,0|1,0,1]=4 653 B10R0.75 C=C(F)C(=O)NCCCCC WXVL_AK0076SB1376 [0,2,0,0,0,0|1,0,1]=4 654 B10R0.75 CC(=O)C(=O)NCCCCO WXVL_AK0075SB0051 [0,2,0,0,0,0|2,0,0]=4 655 B10R0.75 CC(=O)C(=O)NCCCCO WXVL_AK0075SB0051 [0,2,0,0,0,0|2,0,0]=4 656 B10R0.75 CC(C)C(=O)NCCCCO WXVL_AK0075SB0052 [0,2,0,0,0,0|2,0,0]=4 657 B10R0.75 CC(C)C(=O)NCCCCO WXVL_AK0075SB0052 [0,2,0,0,0,0|2,0,0]=4 658 B10R0.75 CC(S)C(=O)NCCCCO WXVL_AK0075SB2708 [0,2,0,0,0,0|2,0,0]=4 659 B10R0.75 CC(S)C(=O)NCCCCO WXVL_AK0075SB2708 [0,2,0,0,0,0|2,0,0]=4 660 B10R0.75 CCCCCNC(=O)C(=O)C WXVL_AK0076SB0051 [0,2,0,0,0,0|1,0,0]=3 661 B10R0.75 CCCCCNC(=O)C(=O)C WXVL_AK0076SB0051 [0,2,0,0,0,0|1,0,0]=3 662 B10R0.75 CCCCCNC(=O)C(=O)N WXVL_AK0076SB0128 [0,2,0,0,0,0|2,0,0]=4 663 B10R0.75 CCCCCNC(=O)C(=O)N WXVL_AK0076SB0128 [0,2,0,0,0,0|2,0,0]=4 664 B10R0.75 CCCCCNC(=O)C(C)C WXVL_AK0076SB0052 [0,2,0,0,0,0|1,0,0]=3 665 B10R0.75 CCCCCNC(=O)C(C)C WXVL_AK0076SB0052 [0,2,0,0,0,0|1,0,0]=3 666 B10R0.75 CCCCCNC(=O)C(C)S WXVL_AK0076SB2708 [0,2,0,0,0,0|1,0,0]=3 667 B10R0.75 CCCCCNC(=O)C(C)S WXVL_AK0076SB2708 [0,2,0,0,0,0|1,0,0]=3 668 B10R0.75 CCCCCNC(=O)C(F)F WXVL_AK0076SB0079 [0,2,0,0,0,0|2,0,0]=4 669 B10R0.75 CCCCCNC(=O)C(F)F WXVL_AK0076SB0079 [0,2,0,0,0,0|2,0,0]=4 670 B10R0.75 CCCCCNC(=O)[C@@H](C)O WXVL_AK0076SB1085 [0,2,0,0,0,0|1,0,0]=3 671 B10R0.75 CCCCCNC(=O)[C@@H](C)O WXVL_AK0076SB1085 [0,2,0,0,0,0|1,0,0]=3 672 B10R0.75 CCSCCNC(=O)C(=O)C WXVL_AK00494SB0051 [0,2,0,0,0,0|2,0,0]=4 673 B10R0.75 CCSCCNC(=O)C(=O)C WXVL_AK00494SB0051 [0,2,0,0,0,0|2,0,0]=4 674 B10R0.75 CCSCCNC(=O)C(C)C WXVL_AK00494SB0052 [0,2,0,0,0,0|2,0,0]=4 675 B10R0.75 CCSCCNC(=O)C(C)C WXVL_AK00494SB0052 [0,2,0,0,0,0|2,0,0]=4 676 B10R0.75 CCSCCNC(=O)C(C)S WXVL_AK00494SB2708 [0,2,0,0,0,0|2,0,0]=4 677 B10R0.75 CCSCCNC(=O)C(C)S WXVL_AK00494SB2708 [0,2,0,0,0,0|2,0,0]=4 678 B10R0.75 CCSCCNC(=O)[C@@H](C)O WXVL_AK00494SB1085 [0,2,0,0,0,0|2,0,0]=4 679 B10R0.75 CCSCCNC(=O)[C@@H](C)O WXVL_AK00494SB1085 [0,2,0,0,0,0|2,0,0]=4 680 B10R0.75 CN(C)C(=O)CCCCCBr WXVL_AN0032SB2192 [0,2,0,0,0,0|1,0,0]=3 681 B10R0.75 CN(C)C(=O)CCCCCBr WXVL_AN0032SB2192 [0,2,0,0,0,0|1,0,0]=3 682 B10R0.75 CN(C)C(=O)CCCCCO WXVL_AN0032SB2973 [0,2,0,0,0,0|1,0,0]=3 683 B10R0.75 CN(C)C(=O)CCCCCO WXVL_AN0032SB2973 [0,2,0,0,0,0|1,0,0]=3 684 B10R0.75 COCCCNC(=O)C(=O)C WXVL_AK00637SB0051 [0,2,0,0,0,0|2,0,0]=4 685 B10R0.75 COCCCNC(=O)C(=O)C WXVL_AK00637SB0051 [0,2,0,0,0,0|2,0,0]=4 686 B10R0.75 COCCCNC(=O)C(C)C WXVL_AK00637SB0052 [0,2,0,0,0,0|2,0,0]=4 687 B10R0.75 COCCCNC(=O)C(C)C WXVL_AK00637SB0052 [0,2,0,0,0,0|2,0,0]=4 688 B10R0.75 COCCCNC(=O)C(C)S WXVL_AK00637SB2708 [0,2,0,0,0,0|2,0,0]=4 689 B10R0.75 COCCCNC(=O)C(C)S WXVL_AK00637SB2708 [0,2,0,0,0,0|2,0,0]=4 690 B10R0.75 COCCCNC(=O)[C@@H](C)O WXVL_AK00637SB1085 [0,2,0,0,0,0|2,0,0]=4 691 B10R0.75 COCCCNC(=O)[C@@H](C)O WXVL_AK00637SB1085 [0,2,0,0,0,0|2,0,0]=4 692 B10R0.75 COCCOCC(=O)N(C)C WXVL_AN0032SB0159 [0,2,0,0,0,0|2,0,0]=4 693 B10R0.75 COCCOCC(=O)N(C)C WXVL_AN0032SB0159 [0,2,0,0,0,0|2,0,0]=4 694 B10R0.75 CSCCCNC(=O)C(=O)C WXVL_AK0965SB0051 [0,2,0,0,0,0|2,0,0]=4 695 B10R0.75 CSCCCNC(=O)C(=O)C WXVL_AK0965SB0051 [0,2,0,0,0,0|2,0,0]=4 696 B10R0.75 CSCCCNC(=O)C(C)C WXVL_AK0965SB0052 [0,2,0,0,0,0|2,0,0]=4 697 B10R0.75 CSCCCNC(=O)C(C)C WXVL_AK0965SB0052 [0,2,0,0,0,0|2,0,0]=4 698 B10R0.75 CSCCCNC(=O)C(C)S WXVL_AK0965SB2708 [0,2,0,0,0,0|2,0,0]=4 699 B10R0.75 CSCCCNC(=O)C(C)S WXVL_AK0965SB2708 [0,2,0,0,0,0|2,0,0]=4 700 B10R0.75 CSCCCNC(=O)[C@@H](C)O WXVL_AK0965SB1085 [0,2,0,0,0,0|2,0,0]=4 701 B10R0.75 CSCCCNC(=O)[C@@H](C)O WXVL_AK0965SB1085 [0,2,0,0,0,0|2,0,0]=4 702 B10R0.75 C[C@@H](O)C(=O)NCCCCO WXVL_AK0075SB1085 [0,2,0,0,0,0|2,0,0]=4 703 B10R0.75 C[C@@H](O)C(=O)NCCCCO WXVL_AK0075SB1085 [0,2,0,0,0,0|2,0,0]=4 704 B10R0.5 CCCCNC(=O)C(C)(C)Br WXVL_AK00588SB0432 [0,2,0,0,0,0|2,0,0]=4 705 B10R0.5 CCCCNC(=O)C(C)(C)Br WXVL_AK00588SB0432 [0,2,0,0,0,0|2,0,0]=4 706 B10R0.5 CCCCNC(=O)C(C)(C)C WXVL_AK00588SB0078 [0,2,0,0,0,0|2,0,0]=4 707 B10R0.5 CCCCNC(=O)C(C)(C)C WXVL_AK00588SB0078 [0,2,0,0,0,0|2,0,0]=4 708 B10R0.5 CCCCNC(=O)C(C)(C)F WXVL_AK00588SB0199 [0,2,0,0,0,0|2,0,0]=4 709 B10R0.5 CCCCNC(=O)C(C)(C)F WXVL_AK00588SB0199 [0,2,0,0,0,0|2,0,0]=4 710 B10R0.5 CCCCNC(=O)C(C)(C)O WXVL_AK00588SB0125 [0,2,0,0,0,0|2,0,0]=4 711 B10R0.5 CCCCNC(=O)C(C)(C)O WXVL_AK00588SB0125 [0,2,0,0,0,0|2,0,0]=4 712 B10R0.5 CCCCNC(=O)C(C)(F)F WXVL_AK00588SB0197 [0,2,0,0,0,0|2,0,0]=4 713 B10R0.5 CCCCNC(=O)C(C)(F)F WXVL_AK00588SB0197 [0,2,0,0,0,0|2,0,0]=4 714 B8R1.38 CNC(=O)C1CCC1 WXVL_AK00442SB0042 [1,0,0,1,0,0|1,0,0]=3 715 B8R1.38 CNC(=O)C1CCC1 WXVL_AK00442SB0042 [1,0,0,1,0,0|1,0,0]=3 716 B8R1.40 CCC(=O)NC1CC1 WXVL_AK0001SB0064 [1,0,0,1,0,0|2,0,0]=4 717 B8R1.40 CCC(=O)NC1CC1 WXVL_AK0001SB0064 [1,0,0,1,0,0|2,0,0]=4 718 B8R1.40 CNC(=O)CC1CC1 WXVL_AK00442SB0155 [1,0,0,1,0,0|1,0,0]=3 719 B8R1.40 CNC(=O)CC1CC1 WXVL_AK00442SB0155 [1,0,0,1,0,0|1,0,0]=3 720 B8R1.83 CNC(=O)C1CC1C WXVL_AK00442SB0041 [1,0,0,1,0,0|1,0,0]=3 721 B8R1.83 CNC(=O)C1CC1C WXVL_AK00442SB0041 [1,0,0,1,0,0|1,0,0]=3 722 B8R1.83 CNC(=O)[C@@H]1C[C@@H]1F WXVL_AK00442SB1245 [1,0,0,1,0,0|2,0,0]=4 723 B8R1.83 CNC(=O)[C@@H]1C[C@@H]1F WXVL_AK00442SB1245 [1,0,0,1,0,0|2,0,0]=4 724 B8R1.83 CNC(=O)[C@H]1C[C@H]1F WXVL_AK00442SB00019 [1,0,0,1,0,0|2,0,0]=4 725 B8R1.83 CNC(=O)[C@H]1C[C@H]1F WXVL_AK00442SB00019 [1,0,0,1,0,0|2,0,0]=4 726 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [1,0,0,1,0,0|1,0,0]=3 727 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [1,0,0,1,0,0|1,0,0]=3 728 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [1,0,0,1,0,0|1,0,0]=3 729 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [1,0,0,1,0,0|1,0,0]=3 730 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [1,0,0,1,0,0|2,0,0]=4 731 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [1,0,0,1,0,0|2,0,0]=4 732 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [1,0,0,1,0,0|2,0,0]=4 733 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [1,0,0,1,0,0|2,0,0]=4 734 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [1,0,0,1,0,0|2,0,0]=4 735 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [1,0,0,1,0,0|2,0,0]=4 736 B8R1.34 CC(=O)NC1CNC1 WXVL_AK1291SB0150 [1,0,0,1,0,0|2,0,0]=4 737 B8R1.34 CC(=O)NC1CNC1 WXVL_AK1291SB0150 [1,0,0,1,0,0|2,0,0]=4 738 B8R1.34 CC(=O)NC1CSC1 WXVL_AK2089SB0150 [1,0,0,1,0,0|2,0,0]=4 739 B8R1.34 CC(=O)NC1CSC1 WXVL_AK2089SB0150 [1,0,0,1,0,0|2,0,0]=4 740 B8R1.34 NC(=O)CC1CCC1 WXVL_AK0084SB2207 [1,0,0,1,0,0|1,0,0]=3 741 B8R1.34 NC(=O)CC1CCC1 WXVL_AK0084SB2207 [1,0,0,1,0,0|1,0,0]=3 742 B8R1.35 NC(=O)CCC1CC1 WXVL_AK0084SB5360 [1,0,0,1,0,0|1,0,0]=3 743 B8R1.35 NC(=O)CCC1CC1 WXVL_AK0084SB5360 [1,0,0,1,0,0|1,0,0]=3 744 B10R1.14 CCC(=O)N1CCC(C1)Br WXVL_AN00715SB0064 [0,1,0,1,0,0|2,0,0]=4 745 B10R1.14 CCC(=O)N1CCC(C1)C WXVL_AN0556SB0064 [0,1,0,1,0,0|2,0,0]=4 746 B10R1.14 CCC(=O)N1CCC(C1)C WXVL_AN0556SB0064 [0,1,0,1,0,0|2,0,0]=4 747 B10R1.14 CCC(=O)N1CCC(C1)F WXVL_AN00338SB0064 [0,1,0,1,0,0|2,0,0]=4 748 B10R1.14 CCC(=O)N1CCC(C1)F WXVL_AN00338SB0064 [0,1,0,1,0,0|2,0,0]=4 749 B10R1.14 CCC(=O)N1CCC(C1)O WXVL_AN0158SB0064 [0,1,0,1,0,0|2,0,0]=4 750 B10R1.14 CCC(=O)N1CCC(C1)O WXVL_AN0158SB0064 [0,1,0,1,0,0|2,0,0]=4 751 B10R1.14 CCC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB0064 [0,1,0,1,0,0|2,0,0]=4 752 B10R1.14 CCC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB0064 [0,1,0,1,0,0|2,0,0]=4 753 B10R1.14 CCC(=O)N1CC[C@@H](C1)O WXVL_AN00391SB0064 [0,1,0,1,0,0|2,0,0]=4 754 B10R1.14 CCC(=O)N1CC[C@@H](C1)O WXVL_AN00391SB0064 [0,1,0,1,0,0|2,0,0]=4 755 B10R1.14 CCC(=O)N1CC[C@H](C1)C WXVL_AN00488SB0064 [0,1,0,1,0,0|2,0,0]=4 756 B10R1.14 CCC(=O)N1CC[C@H](C1)C WXVL_AN00488SB0064 [0,1,0,1,0,0|2,0,0]=4 757 B10R1.14 CCC(=O)N1CC[C@H](C1)F WXVL_AN00035SB0064 [0,1,0,1,0,0|2,0,0]=4 758 B10R1.14 CCC(=O)N1CC[C@H](C1)F WXVL_AN00035SB0064 [0,1,0,1,0,0|2,0,0]=4 759 B10R1.14 CCC(=O)N1CC[C@H](C1)O WXVL_AN00543SB0064 [0,1,0,1,0,0|2,0,0]=4 760 B10R1.14 CNC(=O)C1CCN(C1)C WXVL_AK00442SB1540 [0,1,0,1,0,0|2,0,0]=4 761 B10R1.14 CNC(=O)C1CCN(C1)C WXVL_AK00442SB1540 [0,1,0,1,0,0|2,0,0]=4 762 B10R1.14 CNC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK00442SB00007 [0,1,0,1,0,0|2,0,0]=4 763 B10R1.14 CNC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK00442SB00007 [0,1,0,1,0,0|2,0,0]=4 764 B10R1.14 CNC(=O)[C@H]1CC[C@H](O1)C WXVL_AK00442SB0853 [0,1,0,1,0,0|1,0,0]=3 765 B10R1.14 CNC(=O)[C@H]1CC[C@H](O1)C WXVL_AK00442SB0853 [0,1,0,1,0,0|1,0,0]=3 766 B10R1.54 CC(=O)N[C@@H]1COC(=O)C1 WXVL_AK00458SB0150 [0,1,0,1,0,0|1,0,1]=4 767 B10R1.54 CC(=O)N[C@@H]1COC(=O)C1 WXVL_AK00458SB0150 [0,1,0,1,0,0|1,0,1]=4 768 B10R1.150 CCC(=O)NC1CC(C1)C WXVL_AK0309SB0064 [0,1,0,1,0,0|2,0,0]=4 769 B10R1.150 CCC(=O)NC1CC(C1)C WXVL_AK0309SB0064 [0,1,0,1,0,0|2,0,0]=4 770 B10R1.150 CCC(=O)NC1CC(C1)F WXVL_AK0307SB0064 [0,1,0,1,0,0|2,0,0]=4 771 B10R1.150 CCC(=O)NC1CC(C1)F WXVL_AK0307SB0064 [0,1,0,1,0,0|2,0,0]=4 772 B10R1.150 CCC(=O)NC1CC(C1)O WXVL_AK0306SB0064 [0,1,0,1,0,0|2,0,0]=4 773 B10R1.150 CCC(=O)NC1CC(C1)O WXVL_AK0306SB0064 [0,1,0,1,0,0|2,0,0]=4 774 B10R1.150 CCC(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB0064 [0,1,0,1,0,0|2,0,0]=4 775 B10R1.150 CCC(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB0064 [0,1,0,1,0,0|2,0,0]=4 776 B10R1.153 C#CC(=O)NCCC1CC1 WXVL_AK00594SB0338 [0,1,0,1,0,0|1,0,1]=4 777 B10R1.153 C#CC(=O)NCCC1CC1 WXVL_AK00594SB0338 [0,1,0,1,0,0|1,0,1]=4 778 B10R1.153 CCC(=O)NCCC1CC1 WXVL_AK00594SB0064 [0,1,0,1,0,0|1,0,0]=3 779 B10R1.153 CCC(=O)NCCC1CC1 WXVL_AK00594SB0064 [0,1,0,1,0,0|1,0,0]=3 780 B10R1.153 O=C(CO)NCCC1CC1 WXVL_AK00594SB2706 [0,1,0,1,0,0|2,0,0]=4 781 B10R1.153 O=C(CO)NCCC1CC1 WXVL_AK00594SB2706 [0,1,0,1,0,0|2,0,0]=4 782 B10R1.11 C/C=C/C(=O)N1CCCC1 WXVL_AN0008SB0340 [0,1,0,1,0,0|2,0,0]=4 783 B10R1.11 C/C=C/C(=O)N1CCCC1 WXVL_AN0008SB0340 [0,1,0,1,0,0|2,0,0]=4 784 B10R1.11 CC#CC(=O)N1CCCC1 WXVL_AN0008SB1240 [0,1,0,1,0,0|2,0,0]=4 785 B10R1.11 CC#CC(=O)N1CCCC1 WXVL_AN0008SB1240 [0,1,0,1,0,0|2,0,0]=4 786 B10R1.11 CCCC(=O)N1CCCC1 WXVL_AN0008SB0073 [0,1,0,1,0,0|2,0,0]=4 787 B10R1.11 CCCC(=O)N1CCCC1 WXVL_AN0008SB0073 [0,1,0,1,0,0|2,0,0]=4 788 B10R1.11 CCNC(=O)C1CCCC1 WXVL_AK00476SB0043 [0,1,0,1,0,0|1,0,0]=3 789 B10R1.11 CCNC(=O)C1CCCC1 WXVL_AK00476SB0043 [0,1,0,1,0,0|1,0,0]=3 790 B10R1.11 CCNC(=O)C1CCCO1 WXVL_AK00476SB1033 [0,1,0,1,0,0|2,0,0]=4 791 B10R1.11 CCNC(=O)C1CCCO1 WXVL_AK00476SB1033 [0,1,0,1,0,0|2,0,0]=4 792 B10R1.11 CCNC(=O)C1CCCS1 WXVL_AK00476SB0022 [0,1,0,1,0,0|2,0,0]=4 793 B10R1.11 CCNC(=O)C1CCCS1 WXVL_AK00476SB0022 [0,1,0,1,0,0|2,0,0]=4 794 B10R1.11 CCNC(=O)[C@H]1CCCO1 WXVL_AK00476SB00043 [0,1,0,1,0,0|2,0,0]=4 795 B10R1.11 CCNC(=O)[C@H]1CCCO1 WXVL_AK00476SB00043 [0,1,0,1,0,0|2,0,0]=4 796 B10R1.11 COCC(=O)N1CCCC1 WXVL_AN0008SB0090 [0,1,0,1,0,0|1,0,0]=3 797 B10R1.11 COCC(=O)N1CCCC1 WXVL_AN0008SB0090 [0,1,0,1,0,0|1,0,0]=3 798 B10R1.11 CSCC(=O)N1CCCC1 WXVL_AN0008SB1267 [0,1,0,1,0,0|1,1,0]=4 799 B10R1.11 CSCC(=O)N1CCCC1 WXVL_AN0008SB1267 [0,1,0,1,0,0|1,1,0]=4 800 B10R1.137 CCNC(=O)CC1CCC1 WXVL_AK00476SB2207 [0,1,0,1,0,0|1,0,0]=3 801 B10R1.137 CCNC(=O)CC1CCC1 WXVL_AK00476SB2207 [0,1,0,1,0,0|1,0,0]=3 802 B10R1.137 COCC(=O)NC1CNC1 WXVL_AK1291SB0090 [0,1,0,1,0,0|2,0,0]=4 803 B10R1.137 COCC(=O)NC1CNC1 WXVL_AK1291SB0090 [0,1,0,1,0,0|2,0,0]=4 804 B10R1.137 COCC(=O)NC1CSC1 WXVL_AK2089SB0090 [0,1,0,1,0,0|2,0,0]=4 805 B10R1.137 COCC(=O)NC1CSC1 WXVL_AK2089SB0090 [0,1,0,1,0,0|2,0,0]=4 806 B10R1.138 CCNC(=O)CCC1CC1 WXVL_AK00476SB5360 [0,1,0,1,0,0|1,0,0]=3 807 B10R1.138 CCNC(=O)CCC1CC1 WXVL_AK00476SB5360 [0,1,0,1,0,0|1,0,0]=3 808 B10R1.186 CCCCNC(=O)C1CC1 WXVL_AK00588SB0038 [0,1,0,1,0,0|2,0,0]=4 809 B10R1.186 CCCCNC(=O)C1CC1 WXVL_AK00588SB0038 [0,1,0,1,0,0|2,0,0]=4 810 B10R1.15 CCC(=O)N1CCOCC1 WXVL_AN00478SB0064 [0,1,0,1,0,0|2,0,0]=4 811 B10R1.15 CCC(=O)N1CCOCC1 WXVL_AN00478SB0064 [0,1,0,1,0,0|2,0,0]=4 812 B10R1.15 CCC(=O)N1CCSCC1 WXVL_AN0896SB0064 [0,1,0,1,0,0|2,0,0]=4 813 B10R1.15 CNC(=O)C1CC=CCC1 WXVL_AK00442SB3640 [0,1,0,1,0,0|1,0,1]=4 814 B10R1.15 CNC(=O)C1CC=CCC1 WXVL_AK00442SB3640 [0,1,0,1,0,0|1,0,1]=4 815 B10R1.15 CNC(=O)C1CCCCC1 WXVL_AK00442SB0047 [0,1,0,1,0,0|1,0,0]=3 816 B10R1.15 CNC(=O)C1CCCCC1 WXVL_AK00442SB0047 [0,1,0,1,0,0|1,0,0]=3 817 B10R1.15 CNC(=O)C1CCCCO1 WXVL_AK00442SB0206 [0,1,0,1,0,0|1,0,0]=3 818 B10R1.15 CNC(=O)C1CCCCO1 WXVL_AK00442SB0206 [0,1,0,1,0,0|1,0,0]=3 819 B10R1.15 CNC(=O)C1CCOCC1 WXVL_AK00442SB0149 [0,1,0,1,0,0|1,0,0]=3 820 B10R1.15 CNC(=O)C1CCOCC1 WXVL_AK00442SB0149 [0,1,0,1,0,0|1,0,0]=3 821 B10R1.15 CNC(=O)C1CCSCC1 WXVL_AK00442SB0752 [0,1,0,1,0,0|1,0,0]=3 822 B10R1.15 CNC(=O)C1CCSCC1 WXVL_AK00442SB0752 [0,1,0,1,0,0|1,0,0]=3 823 B10R1.15 CNC(=O)[C@H]1CCCCO1 WXVL_AK00442SB00044 [0,1,0,1,0,0|1,0,0]=3 824 B10R1.15 CNC(=O)[C@H]1CCCCO1 WXVL_AK00442SB00044 [0,1,0,1,0,0|1,0,0]=3 825 B10R1.411 CNC(=O)C1(CCCC1)C WXVL_AK00442SB0209 [0,1,0,1,0,0|1,0,0]=3 826 B10R1.411 CNC(=O)C1(CCCC1)C WXVL_AK00442SB0209 [0,1,0,1,0,0|1,0,0]=3 827 B10R1.411 CNC(=O)[C@]1(CCCN1)C WXVL_AK00442SB00033 [0,1,0,1,0,0|2,0,0]=4 828 B10R1.411 CNC(=O)[C@]1(CCCN1)C WXVL_AK00442SB00033 [0,1,0,1,0,0|2,0,0]=4 829 B10R1.102 CNS(=O)(=O)CC1CCC1 WXVL_AK00442HU0422 [0,1,0,1,0,0|2,0,0]=4 830 B10R1.102 CNS(=O)(=O)CC1CCC1 WXVL_AK00442HU0422 [0,1,0,1,0,0|2,0,0]=4 831 B10R1.151 C#CC(=O)NCC1CCC1 WXVL_AK00492SB0338 [0,1,0,1,0,0|1,0,1]=4 832 B10R1.151 C#CC(=O)NCC1CCC1 WXVL_AK00492SB0338 [0,1,0,1,0,0|1,0,1]=4 833 B10R1.151 CCC(=O)NCC1CCC1 WXVL_AK00492SB0064 [0,1,0,1,0,0|1,0,0]=3 834 B10R1.151 CCC(=O)NCC1CCC1 WXVL_AK00492SB0064 [0,1,0,1,0,0|1,0,0]=3 835 B10R1.151 CCC(=O)NCC1CCO1 WXVL_AK1433SB0064 [0,1,0,1,0,0|2,0,0]=4 836 B10R1.151 CCC(=O)NCC1CCO1 WXVL_AK1433SB0064 [0,1,0,1,0,0|2,0,0]=4 837 B10R1.151 CCC(=O)NCC1COC1 WXVL_AK0186SB0064 [0,1,0,1,0,0|2,0,0]=4 838 B10R1.151 CCC(=O)NCC1COC1 WXVL_AK0186SB0064 [0,1,0,1,0,0|2,0,0]=4 839 B10R1.151 CNC(=O)CCC1CCC1 WXVL_AK00442SB8784 [0,1,0,1,0,0|1,0,0]=3 840 B10R1.151 CNC(=O)CCC1CCC1 WXVL_AK00442SB8784 [0,1,0,1,0,0|1,0,0]=3 841 B10R1.151 O=C(CO)NCC1CCC1 WXVL_AK00492SB2706 [0,1,0,1,0,0|2,0,0]=4 842 B10R1.151 O=C(CO)NCC1CCC1 WXVL_AK00492SB2706 [0,1,0,1,0,0|2,0,0]=4 843 B10R1.152 CCC(=O)NCC1(CC1)C WXVL_AK00811SB0064 [0,1,0,1,0,0|2,0,0]=4 844 B10R1.152 CCC(=O)NCC1(CC1)C WXVL_AK00811SB0064 [0,1,0,1,0,0|2,0,0]=4 845 B10R1.152 CCC(=O)NCC1(CC1)O WXVL_AK0301SB0064 [0,1,0,1,0,0|2,0,0]=4 846 B10R1.152 CCC(=O)NCC1(CC1)O WXVL_AK0301SB0064 [0,1,0,1,0,0|2,0,0]=4 847 B10R1.27 CNC(=O)CC1CCCC1 WXVL_AK00442SB0044 [0,1,0,1,0,0|1,0,0]=3 848 B10R1.27 CNC(=O)CC1CCCC1 WXVL_AK00442SB0044 [0,1,0,1,0,0|1,0,0]=3 849 B10R1.27 CNC(=O)CN1CCCC1 WXVL_AK00442SB0201 [0,1,0,1,0,0|1,0,0]=3 850 B10R1.27 CNC(=O)CN1CCCC1 WXVL_AK00442SB0201 [0,1,0,1,0,0|1,0,0]=3 851 B10R1.134 CCC(=O)NC(C)C1CC1 WXVL_AK00200SB0064 [0,1,0,1,0,0|2,0,0]=4 852 B10R1.134 CCC(=O)NC(C)C1CC1 WXVL_AK00200SB0064 [0,1,0,1,0,0|2,0,0]=4 853 B10R1.134 CCC(=O)N[C@@H](C)C1CC1 WXVL_AK0484SB0064 [0,1,0,1,0,0|2,0,0]=4 854 B10R1.134 CCC(=O)N[C@@H](C)C1CC1 WXVL_AK0484SB0064 [0,1,0,1,0,0|2,0,0]=4 855 B10R1.149 C#CC(=O)N1CCC[C@H]1C WXVL_AN00593SB0338 [0,1,0,1,0,0|1,0,1]=4 856 B10R1.149 CCC(=O)N1CCC[C@H]1C WXVL_AN00593SB0064 [0,1,0,1,0,0|1,0,0]=3 857 B10R1.149 CNC(=O)C1CCCC1C WXVL_AK00442SB0904 [0,1,0,1,0,0|1,0,0]=3 858 B10R1.149 CNC(=O)C1CCCC1C WXVL_AK00442SB0904 [0,1,0,1,0,0|1,0,0]=3 859 B10R1.149 CNC(=O)[C@@H]1CCCN1C WXVL_AK00442SB1197 [0,1,0,1,0,0|1,0,0]=3 860 B10R1.149 CNC(=O)[C@@H]1CCCN1C WXVL_AK00442SB1197 [0,1,0,1,0,0|1,0,0]=3 861 B10R1.149 C[C@@H]1CCCN1C(=O)CO WXVL_AN00593SB2706 [0,1,0,1,0,0|2,0,0]=4 862 B10R1.429 CNC(=O)CC1(CCC1)O WXVL_AK00442SB0026 [0,1,0,1,0,0|1,0,0]=3 863 B10R1.429 CNC(=O)CC1(CCC1)O WXVL_AK00442SB0026 [0,1,0,1,0,0|1,0,0]=3 864 B10R1.175 CCC(=O)N1CC[C@@H]1CO WXVL_AN00694SB0064 [0,1,0,1,0,0|2,0,0]=4 865 B10R1.175 CCC(=O)N1CC[C@H]1CO WXVL_AN3414SB0064 [0,1,0,1,0,0|2,0,0]=4 866 B10R1.175 CCC(=O)N1CC[C@H]1CO WXVL_AN3414SB0064 [0,1,0,1,0,0|2,0,0]=4 867 B10R1.23 CC(=O)C(=O)N1CCCC1 WXVL_AN0008SB0051 [0,1,0,1,0,0|2,0,0]=4 868 B10R1.23 CC(=O)C(=O)N1CCCC1 WXVL_AN0008SB0051 [0,1,0,1,0,0|2,0,0]=4 869 B10R1.23 CC(C)C(=O)N1CCCC1 WXVL_AN0008SB0052 [0,1,0,1,0,0|2,0,0]=4 870 B10R1.23 CC(C)C(=O)N1CCCC1 WXVL_AN0008SB0052 [0,1,0,1,0,0|2,0,0]=4 871 B10R1.23 CC(S)C(=O)N1CCCC1 WXVL_AN0008SB2708 [0,1,0,1,0,0|2,0,0]=4 872 B10R1.23 CC(S)C(=O)N1CCCC1 WXVL_AN0008SB2708 [0,1,0,1,0,0|2,0,0]=4 873 B10R1.23 CN(C)C(=O)C1CCCC1 WXVL_AN0032SB0043 [0,1,0,1,0,0|1,0,0]=3 874 B10R1.23 CN(C)C(=O)C1CCCC1 WXVL_AN0032SB0043 [0,1,0,1,0,0|1,0,0]=3 875 B10R1.23 CN(C)C(=O)C1CCCO1 WXVL_AN0032SB1033 [0,1,0,1,0,0|2,0,0]=4 876 B10R1.23 CN(C)C(=O)C1CCCO1 WXVL_AN0032SB1033 [0,1,0,1,0,0|2,0,0]=4 877 B10R1.23 CN(C)C(=O)C1CCCS1 WXVL_AN0032SB0022 [0,1,0,1,0,0|2,0,0]=4 878 B10R1.23 CN(C)C(=O)C1CCCS1 WXVL_AN0032SB0022 [0,1,0,1,0,0|2,0,0]=4 879 B10R1.23 CN(C)C(=O)[C@H]1CCCO1 WXVL_AN0032SB00043 [0,1,0,1,0,0|2,0,0]=4 880 B10R1.23 CN(C)C(=O)[C@H]1CCCO1 WXVL_AN0032SB00043 [0,1,0,1,0,0|2,0,0]=4 881 B10R1.23 C[C@@H](O)C(=O)N1CCCC1 WXVL_AN0008SB1085 [0,1,0,1,0,0|2,0,0]=4 882 B10R1.23 C[C@@H](O)C(=O)N1CCCC1 WXVL_AN0008SB1085 [0,1,0,1,0,0|2,0,0]=4 883 B10R1.204 CN(C)C(=O)CC1CCC1 WXVL_AN0032SB2207 [0,1,0,1,0,0|1,0,0]=3 884 B10R1.204 CN(C)C(=O)CC1CCC1 WXVL_AN0032SB2207 [0,1,0,1,0,0|1,0,0]=3 885 B10R1.205 CN(C)C(=O)CCC1CC1 WXVL_AN0032SB5360 [0,1,0,1,0,0|1,0,0]=3 886 B10R1.205 CN(C)C(=O)CCC1CC1 WXVL_AN0032SB5360 [0,1,0,1,0,0|1,0,0]=3