0 B8R0.7 C#CCCCNC(=O)C WXVL_AK00218SB0150 [0,0,0,0,0,0|1,0,2]=3 1 B8R0.7 C#CCCCNC(=O)C WXVL_AK00218SB0150 [0,0,0,0,0,0|1,0,2]=3 2 B8R0.7 CC(=O)NCCCCO WXVL_AK0075SB0150 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.7 CC(=O)NCCCCO WXVL_AK0075SB0150 [0,0,0,0,0,0|2,0,1]=3 4 B8R0.7 CCCCCNC(=O)C WXVL_AK0076SB0150 [0,0,0,0,0,0|1,0,2]=3 5 B8R0.7 CCCCCNC(=O)C WXVL_AK0076SB0150 [0,0,0,0,0,0|1,0,2]=3 6 B8R0.7 CCSCCNC(=O)C WXVL_AK00494SB0150 [0,0,0,0,0,0|2,0,2]=4 7 B8R0.7 CCSCCNC(=O)C WXVL_AK00494SB0150 [0,0,0,0,0,0|2,0,2]=4 8 B8R0.7 COCCCNC(=O)C WXVL_AK00637SB0150 [0,0,0,0,0,0|2,0,1]=3 9 B8R0.7 COCCCNC(=O)C WXVL_AK00637SB0150 [0,0,0,0,0,0|2,0,1]=3 10 B8R0.7 CSCCCNC(=O)C WXVL_AK0965SB0150 [0,0,0,0,0,0|2,0,1]=3 11 B8R0.7 CSCCCNC(=O)C WXVL_AK0965SB0150 [0,0,0,0,0,0|2,0,1]=3 12 B8R0.7 NC(=O)CCCCCBr WXVL_AK0084SB2192 [0,0,0,0,0,0|3,0,1]=4 13 B8R0.7 NC(=O)CCCCCBr WXVL_AK0084SB2192 [0,0,0,0,0,0|3,0,1]=4 14 B8R0.7 NC(=O)CCCCCO WXVL_AK0084SB2973 [0,0,0,0,0,0|3,0,1]=4 15 B8R0.7 NC(=O)CCCCCO WXVL_AK0084SB2973 [0,0,0,0,0,0|3,0,1]=4 16 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,0,0,0,0,0|1,0,2]=4 17 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,0,0,0,0,0|1,0,2]=4 18 B7R0.4 C#CCCNC(=O)C WXVL_AK3109SB0150 [1,0,0,0,0,0|1,0,2]=4 19 B7R0.4 C#CCCNC(=O)C WXVL_AK3109SB0150 [1,0,0,0,0,0|1,0,2]=4 20 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,0,0,0,0,0|1,0,0]=2 21 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,0,0,0,0,0|1,0,0]=2 22 B7R0.4 C=CCCNC(=O)C WXVL_AK00138SB0150 [1,0,0,0,0,0|1,0,0]=2 23 B7R0.4 C=CCCNC(=O)C WXVL_AK00138SB0150 [1,0,0,0,0,0|1,0,0]=2 24 B7R0.4 CC(=O)NCCC#N WXVL_AK0087SB0150 [1,0,0,0,0,0|2,0,1]=4 25 B7R0.4 CC(=O)NCCC#N WXVL_AK0087SB0150 [1,0,0,0,0,0|2,0,1]=4 26 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,0,0,0,0,0|2,0,0]=3 27 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,0,0,0,0,0|2,0,0]=3 28 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,0,0,0,0,0|1,0,1]=3 29 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,0,0,0,0,0|1,0,1]=3 30 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,0,0,0,0,0|2,0,1]=4 31 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,0,0,0,0,0|2,0,1]=4 32 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,0,0,0,0,0|2,0,1]=4 33 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,0,0,0,0,0|2,0,1]=4 34 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,0,0,0,0,0|2,0,1]=4 35 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,0,0,0,0,0|2,0,1]=4 36 B9R0.1 CC(=O)NCCC(C)CO WXVL_AK4143SB0150 [0,1,0,0,0,0|2,0,1]=4 37 B9R0.1 CC(=O)NCCC(C)CO WXVL_AK4143SB0150 [0,1,0,0,0,0|2,0,1]=4 38 B9R0.2 C#CCCCCNC(=O)C WXVL_AK00614SB0150 [0,1,0,0,0,0|1,0,2]=4 39 B9R0.2 C#CCCCCNC(=O)C WXVL_AK00614SB0150 [0,1,0,0,0,0|1,0,2]=4 40 B9R0.2 C#CCOCCNC(=O)C WXVL_AK00687SB0150 [0,1,0,0,0,0|1,0,2]=4 41 B9R0.2 C#CCOCCNC(=O)C WXVL_AK00687SB0150 [0,1,0,0,0,0|1,0,2]=4 42 B9R0.2 C=COCCCNC(=O)C WXVL_AK7221SB0150 [0,1,0,0,0,0|1,0,0]=2 43 B9R0.2 C=COCCCNC(=O)C WXVL_AK7221SB0150 [0,1,0,0,0,0|1,0,0]=2 44 B9R0.2 CC(=O)NCCCCCO WXVL_AK0077SB0150 [0,1,0,0,0,0|1,0,2]=4 45 B9R0.2 CC(=O)NCCCCCO WXVL_AK0077SB0150 [0,1,0,0,0,0|1,0,2]=4 46 B9R0.2 CC(=O)NCCNCCO WXVL_AK0954SB0150 [0,1,0,0,0,0|2,0,1]=4 47 B9R0.2 CC(=O)NCCNCCO WXVL_AK0954SB0150 [0,1,0,0,0,0|2,0,1]=4 48 B9R0.2 CCCCCCNC(=O)C WXVL_AK0286SB0150 [0,1,0,0,0,0|1,0,2]=4 49 B9R0.2 CCCCCCNC(=O)C WXVL_AK0286SB0150 [0,1,0,0,0,0|1,0,2]=4 50 B9R0.2 CCOCCCNC(=O)C WXVL_AK0072SB0150 [0,1,0,0,0,0|1,0,2]=4 51 B9R0.2 CCOCCCNC(=O)C WXVL_AK0072SB0150 [0,1,0,0,0,0|1,0,2]=4 52 B9R0.46 C#CCCCNC(=O)CC WXVL_AK00218SB0064 [0,1,0,0,0,0|1,0,2]=4 53 B9R0.46 C#CCCCNC(=O)CC WXVL_AK00218SB0064 [0,1,0,0,0,0|1,0,2]=4 54 B9R0.46 C#CCCCNC(=O)CO WXVL_AK00218SB2706 [0,1,0,0,0,0|1,0,2]=4 55 B9R0.46 C#CCCCNC(=O)CO WXVL_AK00218SB2706 [0,1,0,0,0,0|1,0,2]=4 56 B9R0.46 CCC(=O)NCCCCO WXVL_AK0075SB0064 [0,1,0,0,0,0|2,0,1]=4 57 B9R0.46 CCC(=O)NCCCCO WXVL_AK0075SB0064 [0,1,0,0,0,0|2,0,1]=4 58 B9R0.46 CCC(=O)NCCCOC WXVL_AK00637SB0064 [0,1,0,0,0,0|2,0,1]=4 59 B9R0.46 CCC(=O)NCCCOC WXVL_AK00637SB0064 [0,1,0,0,0,0|2,0,1]=4 60 B9R0.46 CCC(=O)NCCCSC WXVL_AK0965SB0064 [0,1,0,0,0,0|2,0,1]=4 61 B9R0.46 CCC(=O)NCCCSC WXVL_AK0965SB0064 [0,1,0,0,0,0|2,0,1]=4 62 B9R0.46 CCCCCNC(=O)CC WXVL_AK0076SB0064 [0,1,0,0,0,0|1,0,2]=4 63 B9R0.46 CCCCCNC(=O)CC WXVL_AK0076SB0064 [0,1,0,0,0,0|1,0,2]=4 64 B9R0.46 CCCCCNC(=O)CO WXVL_AK0076SB2706 [0,1,0,0,0,0|1,0,2]=4 65 B9R0.46 CCCCCNC(=O)CO WXVL_AK0076SB2706 [0,1,0,0,0,0|1,0,2]=4 66 B9R0.46 CNC(=O)CCCCCBr WXVL_AK00442SB2192 [0,1,0,0,0,0|2,0,1]=4 67 B9R0.46 CNC(=O)CCCCCBr WXVL_AK00442SB2192 [0,1,0,0,0,0|2,0,1]=4 68 B9R0.46 CNC(=O)CCCCCO WXVL_AK00442SB2973 [0,1,0,0,0,0|2,0,1]=4 69 B9R0.46 CNC(=O)CCCCCO WXVL_AK00442SB2973 [0,1,0,0,0,0|2,0,1]=4 70 B9R0.46 COCCCNC(=O)CO WXVL_AK00637SB2706 [0,1,0,0,0,0|2,0,1]=4 71 B9R0.46 COCCCNC(=O)CO WXVL_AK00637SB2706 [0,1,0,0,0,0|2,0,1]=4 72 B9R0.46 CSCCCNC(=O)CO WXVL_AK0965SB2706 [0,1,0,0,0,0|2,0,1]=4 73 B9R0.46 CSCCCNC(=O)CO WXVL_AK0965SB2706 [0,1,0,0,0,0|2,0,1]=4 74 B9R0.46 O=C(CO)NCCCCO WXVL_AK0075SB2706 [0,1,0,0,0,0|2,0,1]=4 75 B9R0.46 O=C(CO)NCCCCO WXVL_AK0075SB2706 [0,1,0,0,0,0|2,0,1]=4 76 B9R0.47 C=CCCCC(=O)N(C)C WXVL_AN0032SB2920 [0,1,0,0,0,0|3,0,0]=4 77 B9R0.47 C=CCCCC(=O)N(C)C WXVL_AN0032SB2920 [0,1,0,0,0,0|3,0,0]=4 78 B9R0.47 C=CCCNC(=O)C(=O)C WXVL_AK00138SB0051 [0,1,0,0,0,0|2,0,0]=3 79 B9R0.47 C=CCCNC(=O)C(=O)C WXVL_AK00138SB0051 [0,1,0,0,0,0|2,0,0]=3 80 B9R0.47 C=CCCNC(=O)C(=O)N WXVL_AK00138SB0128 [0,1,0,0,0,0|3,0,0]=4 81 B9R0.47 C=CCCNC(=O)C(=O)N WXVL_AK00138SB0128 [0,1,0,0,0,0|3,0,0]=4 82 B9R0.55 CC(=O)NCCNC(=O)C WXVL_AK0057SB0150 [0,1,0,0,0,0|2,0,1]=4 83 B9R0.55 CC(=O)NCCNC(=O)C WXVL_AK0057SB0150 [0,1,0,0,0,0|2,0,1]=4 84 B9R1.6 NC(=O)C1=COCCC1 WXVL_AK0084SB2928 [0,0,0,1,0,0|3,0,0]=4 85 B9R1.6 NC(=O)C1=COCCC1 WXVL_AK0084SB2928 [0,0,0,1,0,0|3,0,0]=4 86 B9R1.41 CC(=O)N1CCC[C@H]1C WXVL_AN00593SB0150 [0,0,0,1,0,0|1,0,2]=4 87 B9R1.84 CC(=O)NCC1CCC1 WXVL_AK00492SB0150 [0,0,0,1,0,0|1,0,2]=4 88 B9R1.84 CC(=O)NCC1CCC1 WXVL_AK00492SB0150 [0,0,0,1,0,0|1,0,2]=4 89 B9R1.84 CC(=O)NCC1CCO1 WXVL_AK1433SB0150 [0,0,0,1,0,0|2,0,1]=4 90 B9R1.84 CC(=O)NCC1CCO1 WXVL_AK1433SB0150 [0,0,0,1,0,0|2,0,1]=4 91 B9R1.84 CC(=O)NCC1COC1 WXVL_AK0186SB0150 [0,0,0,1,0,0|2,0,1]=4 92 B9R1.84 CC(=O)NCC1COC1 WXVL_AK0186SB0150 [0,0,0,1,0,0|2,0,1]=4 93 B9R1.85 CC(=O)NCCC1CC1 WXVL_AK00594SB0150 [0,0,0,1,0,0|1,0,2]=4 94 B9R1.85 CC(=O)NCCC1CC1 WXVL_AK00594SB0150 [0,0,0,1,0,0|1,0,2]=4 95 B9R1.96 CC(=O)N1CC[C@@H]1CO WXVL_AN00694SB0150 [0,0,0,1,0,0|2,0,1]=4 96 B9R1.96 CC(=O)N1CC[C@H]1CO WXVL_AN3414SB0150 [0,0,0,1,0,0|2,0,1]=4 97 B9R1.96 CC(=O)N1CC[C@H]1CO WXVL_AN3414SB0150 [0,0,0,1,0,0|2,0,1]=4 98 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [2,0,0,0,0,0|1,0,0]=3 99 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [2,0,0,0,0,0|1,0,0]=3 100 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [2,0,0,0,0,0|1,0,0]=3 101 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [2,0,0,0,0,0|1,0,0]=3 102 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [2,0,0,0,0,0|2,0,0]=4 103 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [2,0,0,0,0,0|2,0,0]=4 104 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [2,0,0,0,0,0|1,0,0]=3 105 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [2,0,0,0,0,0|1,0,0]=3 106 B8R0.6 C=CCCCC(=O)NC WXVL_AK00442SB2920 [1,1,0,0,0,0|2,0,0]=4 107 B8R0.6 C=CCCCC(=O)NC WXVL_AK00442SB2920 [1,1,0,0,0,0|2,0,0]=4 108 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [1,1,0,0,0,0|2,0,0]=4 109 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [1,1,0,0,0,0|2,0,0]=4 110 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [1,1,0,0,0,0|1,0,1]=4 111 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [1,1,0,0,0,0|1,0,1]=4 112 B8R0.8 C=CCNC(=O)C(=O)C WXVL_AK00561SB0051 [1,1,0,0,0,0|1,0,1]=4 113 B8R0.8 C=CCNC(=O)C(=O)C WXVL_AK00561SB0051 [1,1,0,0,0,0|1,0,1]=4 114 B8R0.8 C=CCOC(C)C(=O)N WXVL_AK0084SBD933 [1,1,0,0,0,0|2,0,0]=4 115 B8R0.8 C=CCOC(C)C(=O)N WXVL_AK0084SBD933 [1,1,0,0,0,0|2,0,0]=4 116 B8R0.9 CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0150 [1,1,0,0,0,0|2,0,0]=4 117 B8R0.9 CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0150 [1,1,0,0,0,0|2,0,0]=4 118 B8R0.9 CC(=O)NC[C@H](O)CO WXVL_AK00483SB0150 [1,1,0,0,0,0|2,0,0]=4 119 B8R0.9 CC(=O)NC[C@H](O)CO WXVL_AK00483SB0150 [1,1,0,0,0,0|2,0,0]=4 120 B8R0.28 CC(=O)NCCC(=O)N WXVL_AK00443SB0150 [1,1,0,0,0,0|2,0,0]=4 121 B8R0.28 CC(=O)NCCC(=O)N WXVL_AK00443SB0150 [1,1,0,0,0,0|2,0,0]=4 122 B8R0.28 CC(=O)NCCC(=O)N WXVL_AK0084SB0374 [1,1,0,0,0,0|2,0,0]=4 123 B8R0.28 CC(=O)NCCC(=O)N WXVL_AK0084SB0374 [1,1,0,0,0,0|2,0,0]=4 124 B8R0.28 CC(=O)NCCC(C)C WXVL_AK0068SB0150 [1,1,0,0,0,0|1,0,1]=4 125 B8R0.28 CC(=O)NCCC(C)C WXVL_AK0068SB0150 [1,1,0,0,0,0|1,0,1]=4 126 B10R0.55 COC(=O)CCCCC(=O)N WXVL_AK0084SB1209 [0,2,0,0,0,0|2,0,0]=4 127 B10R0.55 COC(=O)CCCCC(=O)N WXVL_AK0084SB1209 [0,2,0,0,0,0|2,0,0]=4 128 B10R0.55 COC(=O)CCCNC(=O)C WXVL_AK00444SB0150 [0,2,0,0,0,0|1,0,1]=4 129 B10R0.55 COC(=O)CCCNC(=O)C WXVL_AK00444SB0150 [0,2,0,0,0,0|1,0,1]=4 130 B10R0.74 C#CC(=O)NCCCOC=C WXVL_AK7221SB0338 [0,2,0,0,0,0|1,0,1]=4 131 B10R0.74 C#CC(=O)NCCCOC=C WXVL_AK7221SB0338 [0,2,0,0,0,0|1,0,1]=4 132 B10R0.74 C=COCCCNC(=O)CC WXVL_AK7221SB0064 [0,2,0,0,0,0|1,0,0]=3 133 B10R0.74 C=COCCCNC(=O)CC WXVL_AK7221SB0064 [0,2,0,0,0,0|1,0,0]=3 134 B10R0.74 C=COCCCNC(=O)CO WXVL_AK7221SB2706 [0,2,0,0,0,0|1,0,0]=3 135 B10R0.74 C=COCCCNC(=O)CO WXVL_AK7221SB2706 [0,2,0,0,0,0|1,0,0]=3 136 B10R0.75 C=CCCCCN(C)C(=O)C WXVL_AN4222SB0150 [0,2,0,0,0,0|1,0,0]=3 137 B10R0.75 C=CCCCCN(C)C(=O)C WXVL_AN4222SB0150 [0,2,0,0,0,0|1,0,0]=3 138 B10R0.78 C=CCNC(=O)CCC(=O)C WXVL_AK00561SB0072 [0,2,0,0,0,0|1,0,1]=4 139 B10R0.78 C=CCNC(=O)CCC(=O)C WXVL_AK00561SB0072 [0,2,0,0,0,0|1,0,1]=4 140 B10R0.78 C=CCNC(=O)CNC(=O)C WXVL_AK00561SB0357 [0,2,0,0,0,0|1,0,1]=4 141 B10R0.78 C=CCNC(=O)CNC(=O)C WXVL_AK00561SB0357 [0,2,0,0,0,0|1,0,1]=4 142 B10R0.78 C=CCNC(=O)COC(=O)C WXVL_AK00561SB2824 [0,2,0,0,0,0|0,0,1]=3 143 B10R0.78 C=CCNC(=O)COC(=O)C WXVL_AK00561SB2824 [0,2,0,0,0,0|0,0,1]=3 144 B10R0.78 C=CCNC(=O)CSC(=O)C WXVL_AK00561SB3992 [0,2,0,0,0,0|0,1,1]=4 145 B10R0.78 C=CCNC(=O)CSC(=O)C WXVL_AK00561SB3992 [0,2,0,0,0,0|0,1,1]=4 146 B10R0.83 C=CCCNC(=O)C(=O)CC WXVL_AK00138SB0344 [0,2,0,0,0,0|2,0,0]=4 147 B10R0.83 C=CCCNC(=O)C(=O)CC WXVL_AK00138SB0344 [0,2,0,0,0,0|2,0,0]=4 148 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [1,0,0,1,0,0|1,0,1]=4 149 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [1,0,0,1,0,0|1,0,1]=4 150 B10R1.54 CC(=O)N[C@@H]1COC(=O)C1 WXVL_AK00458SB0150 [0,1,0,1,0,0|1,0,1]=4 151 B10R1.54 CC(=O)N[C@@H]1COC(=O)C1 WXVL_AK00458SB0150 [0,1,0,1,0,0|1,0,1]=4 152 B10R1.64 CC(=O)N[C@@H]1CCNC1=O WXVL_AK0496SB0150 [0,1,0,1,0,0|2,0,0]=4 153 B10R1.64 CC(=O)N[C@@H]1CCNC1=O WXVL_AK0496SB0150 [0,1,0,1,0,0|2,0,0]=4 154 B10R1.15 CNC(=O)C1=COCCC1 WXVL_AK00442SB2928 [0,1,0,1,0,0|2,0,0]=4 155 B10R1.15 CNC(=O)C1=COCCC1 WXVL_AK00442SB2928 [0,1,0,1,0,0|2,0,0]=4 156 B10R1.113 CC(=O)N1CCOC(=O)C1 WXVL_AN4960SB0150 [0,1,0,1,0,0|1,0,1]=4 157 B10R1.113 NC(=O)C1CCNC(=O)C1 WXVL_AK0084SB2983 [0,1,0,1,0,0|2,0,0]=4 158 B10R1.113 NC(=O)C1CCNC(=O)C1 WXVL_AK0084SB2983 [0,1,0,1,0,0|2,0,0]=4