0 B12R0.239 C#CCCNC(=O)CC(=O)OCC WXVL_AK3109SB3094 [0,0,0,0,0,0|1,0,2]=3 1 B12R0.239 C#CCCNC(=O)CC(=O)OCC WXVL_AK3109SB3094 [0,0,0,0,0,0|1,0,2]=3 2 B12R0.239 C=CCCNC(=O)CC(=O)OCC WXVL_AK00138SB3094 [0,0,0,0,0,0|1,0,2]=3 3 B12R0.239 C=CCCNC(=O)CC(=O)OCC WXVL_AK00138SB3094 [0,0,0,0,0,0|1,0,2]=3 4 B12R0.239 CCCCNC(=O)CC(=O)OCC WXVL_AK00588SB3094 [0,0,0,0,0,0|1,0,0]=1 5 B12R0.239 CCCCNC(=O)CC(=O)OCC WXVL_AK00588SB3094 [0,0,0,0,0,0|1,0,0]=1 6 B12R0.239 CCOC(=O)CC(=O)NCCC#N WXVL_AK0087SB3094 [0,0,0,0,0,0|2,0,1]=3 7 B12R0.239 CCOC(=O)CC(=O)NCCC#N WXVL_AK0087SB3094 [0,0,0,0,0,0|2,0,1]=3 8 B12R0.239 CCOC(=O)CC(=O)NCCCO WXVL_AK0073SB3094 [0,0,0,0,0,0|2,0,0]=2 9 B12R0.239 CCOC(=O)CC(=O)NCCCO WXVL_AK0073SB3094 [0,0,0,0,0,0|2,0,0]=2 10 B12R0.239 CCOC(=O)CC(=O)NCCSC WXVL_AK00440SB3094 [0,0,0,0,0,0|2,0,0]=2 11 B12R0.239 CCOC(=O)CC(=O)NCCSC WXVL_AK00440SB3094 [0,0,0,0,0,0|2,0,0]=2 12 B11R0.4 CCCCC/C=C/C(=O)NCC WXVL_AK00476SB3331 [1,0,0,0,0,0|2,0,1]=4 13 B11R0.4 CCCCC/C=C/C(=O)NCC WXVL_AK00476SB3331 [1,0,0,0,0,0|2,0,1]=4 14 B11R0.4 CCCCCCCC(=O)NCC WXVL_AK00476SB0393 [1,0,0,0,0,0|2,0,1]=4 15 B11R0.4 CCCCCCCC(=O)NCC WXVL_AK00476SB0393 [1,0,0,0,0,0|2,0,1]=4 16 B11R0.5 C=CCNC(=O)CC(=O)OCC WXVL_AK00561SB3094 [1,0,0,0,0,0|1,0,2]=4 17 B11R0.5 C=CCNC(=O)CC(=O)OCC WXVL_AK00561SB3094 [1,0,0,0,0,0|1,0,2]=4 18 B11R0.5 CCCNC(=O)CC(=O)OCC WXVL_AK00504SB3094 [1,0,0,0,0,0|1,0,0]=2 19 B11R0.5 CCCNC(=O)CC(=O)OCC WXVL_AK00504SB3094 [1,0,0,0,0,0|1,0,0]=2 20 B11R0.5 CCOC(=O)CC(=O)NCC#N WXVL_AK0683SB3094 [1,0,0,0,0,0|2,0,1]=4 21 B11R0.5 CCOC(=O)CC(=O)NCC#N WXVL_AK0683SB3094 [1,0,0,0,0,0|2,0,1]=4 22 B11R0.5 CCOC(=O)CC(=O)NCCF WXVL_AK00466SB3094 [1,0,0,0,0,0|2,0,0]=3 23 B11R0.5 CCOC(=O)CC(=O)NCCF WXVL_AK00466SB3094 [1,0,0,0,0,0|2,0,0]=3 24 B11R0.140 CC/C=C/CC(=O)NCCCC WXVL_AK00588SB0349 [1,0,0,0,0,0|2,0,0]=3 25 B11R0.140 CC/C=C/CC(=O)NCCCC WXVL_AK00588SB0349 [1,0,0,0,0,0|2,0,0]=3 26 B11R0.140 CC/C=C/CC(=O)NCCCO WXVL_AK0073SB0349 [1,0,0,0,0,0|3,0,0]=4 27 B11R0.140 CC/C=C/CC(=O)NCCCO WXVL_AK0073SB0349 [1,0,0,0,0,0|3,0,0]=4 28 B11R0.140 CC/C=C/CC(=O)NCCSC WXVL_AK00440SB0349 [1,0,0,0,0,0|3,0,0]=4 29 B11R0.140 CC/C=C/CC(=O)NCCSC WXVL_AK00440SB0349 [1,0,0,0,0,0|3,0,0]=4 30 B11R0.140 CCCCNC(=O)/C=C/OCC WXVL_AK00588SB3226 [1,0,0,0,0,0|1,0,1]=3 31 B11R0.140 CCCCNC(=O)/C=C/OCC WXVL_AK00588SB3226 [1,0,0,0,0,0|1,0,1]=3 32 B11R0.140 CCO/C=C/C(=O)NCCCO WXVL_AK0073SB3226 [1,0,0,0,0,0|2,0,1]=4 33 B11R0.140 CCO/C=C/C(=O)NCCCO WXVL_AK0073SB3226 [1,0,0,0,0,0|2,0,1]=4 34 B11R0.140 CCO/C=C/C(=O)NCCSC WXVL_AK00440SB3226 [1,0,0,0,0,0|2,0,1]=4 35 B11R0.140 CCO/C=C/C(=O)NCCSC WXVL_AK00440SB3226 [1,0,0,0,0,0|2,0,1]=4 36 B11R0.154 C#CCCNC(=O)CC(=O)OC WXVL_AK3109SB2790 [1,0,0,0,0,0|1,0,2]=4 37 B11R0.154 C#CCCNC(=O)CC(=O)OC WXVL_AK3109SB2790 [1,0,0,0,0,0|1,0,2]=4 38 B11R0.154 C=CCCNC(=O)CC(=O)OC WXVL_AK00138SB2790 [1,0,0,0,0,0|1,0,2]=4 39 B11R0.154 C=CCCNC(=O)CC(=O)OC WXVL_AK00138SB2790 [1,0,0,0,0,0|1,0,2]=4 40 B11R0.154 CCCCNC(=O)CC(=O)OC WXVL_AK00588SB2790 [1,0,0,0,0,0|1,0,0]=2 41 B11R0.154 CCCCNC(=O)CC(=O)OC WXVL_AK00588SB2790 [1,0,0,0,0,0|1,0,0]=2 42 B11R0.154 CCCCNC(=O)CC(C)CC WXVL_AK00588SB0353 [1,0,0,0,0,0|2,0,1]=4 43 B11R0.154 CCCCNC(=O)CC(C)CC WXVL_AK00588SB0353 [1,0,0,0,0,0|2,0,1]=4 44 B11R0.154 CCCCNC(=O)CC(O)CC WXVL_AK00588SB4092 [1,0,0,0,0,0|1,0,2]=4 45 B11R0.154 CCCCNC(=O)CC(O)CC WXVL_AK00588SB4092 [1,0,0,0,0,0|1,0,2]=4 46 B11R0.154 CCCCNC(=O)C[C@H](C)CC WXVL_AK00588SB8650 [1,0,0,0,0,0|2,0,1]=4 47 B11R0.154 CCCCNC(=O)C[C@H](C)CC WXVL_AK00588SB8650 [1,0,0,0,0,0|2,0,1]=4 48 B11R0.154 COC(=O)CC(=O)NCCC#N WXVL_AK0087SB2790 [1,0,0,0,0,0|2,0,1]=4 49 B11R0.154 COC(=O)CC(=O)NCCC#N WXVL_AK0087SB2790 [1,0,0,0,0,0|2,0,1]=4 50 B11R0.154 COC(=O)CC(=O)NCCCO WXVL_AK0073SB2790 [1,0,0,0,0,0|2,0,0]=3 51 B11R0.154 COC(=O)CC(=O)NCCCO WXVL_AK0073SB2790 [1,0,0,0,0,0|2,0,0]=3 52 B11R0.154 COC(=O)CC(=O)NCCSC WXVL_AK00440SB2790 [1,0,0,0,0,0|2,0,0]=3 53 B11R0.154 COC(=O)CC(=O)NCCSC WXVL_AK00440SB2790 [1,0,0,0,0,0|2,0,0]=3 54 B13R0.39 CCOC(=O)CC(=O)N(C)CCOC WXVL_AN0085SB3094 [0,1,0,0,0,0|2,0,0]=3 55 B13R0.39 CCOC(=O)CC(=O)N(C)CCOC WXVL_AN0085SB3094 [0,1,0,0,0,0|2,0,0]=3 56 B13R0.89 CCC[C@H](C)NC(=O)CC(=O)OCC WXVL_AK00682SB3094 [0,1,0,0,0,0|1,0,0]=2 57 B13R0.89 CCC[C@H](C)NC(=O)CC(=O)OCC WXVL_AK00682SB3094 [0,1,0,0,0,0|1,0,0]=2 58 B13R0.89 CCOC(=O)CC(=O)NC(C)CCO WXVL_AK1288SB3094 [0,1,0,0,0,0|2,0,0]=3 59 B13R0.89 CCOC(=O)CC(=O)NC(C)CCO WXVL_AK1288SB3094 [0,1,0,0,0,0|2,0,0]=3 60 B13R0.89 CCOC(=O)CC(=O)N[C@@H](C)CC#N WXVL_AK00595SB3094 [0,1,0,0,0,0|2,0,1]=4 61 B13R0.89 CCOC(=O)CC(=O)N[C@@H](C)CC#N WXVL_AK00595SB3094 [0,1,0,0,0,0|2,0,1]=4 62 B13R0.89 CCOC(=O)CC(=O)N[C@@H](C)COC WXVL_AK0137SB3094 [0,1,0,0,0,0|2,0,0]=3 63 B13R0.89 CCOC(=O)CC(=O)N[C@@H](C)COC WXVL_AK0137SB3094 [0,1,0,0,0,0|2,0,0]=3 64 B13R0.89 CCOC(=O)CC(=O)N[C@H](C)COC WXVL_AK00613SB3094 [0,1,0,0,0,0|2,0,0]=3 65 B13R0.89 CCOC(=O)CC(=O)N[C@H](C)COC WXVL_AK00613SB3094 [0,1,0,0,0,0|2,0,0]=3 66 B13R0.330 C#CCCCNC(=O)CC(=O)OCC WXVL_AK00218SB3094 [0,1,0,0,0,0|1,0,1]=3 67 B13R0.330 C#CCCCNC(=O)CC(=O)OCC WXVL_AK00218SB3094 [0,1,0,0,0,0|1,0,1]=3 68 B13R0.330 CCCCCNC(=O)CC(=O)OCC WXVL_AK0076SB3094 [0,1,0,0,0,0|1,0,0]=2 69 B13R0.330 CCCCCNC(=O)CC(=O)OCC WXVL_AK0076SB3094 [0,1,0,0,0,0|1,0,0]=2 70 B13R0.330 CCOC(=O)CC(=O)NCCCCO WXVL_AK0075SB3094 [0,1,0,0,0,0|1,0,0]=2 71 B13R0.330 CCOC(=O)CC(=O)NCCCCO WXVL_AK0075SB3094 [0,1,0,0,0,0|1,0,0]=2 72 B13R0.330 CCOC(=O)CC(=O)NCCCOC WXVL_AK00637SB3094 [0,1,0,0,0,0|1,0,0]=2 73 B13R0.330 CCOC(=O)CC(=O)NCCCOC WXVL_AK00637SB3094 [0,1,0,0,0,0|1,0,0]=2 74 B13R0.330 CCOC(=O)CC(=O)NCCCSC WXVL_AK0965SB3094 [0,1,0,0,0,0|1,0,0]=2 75 B13R0.330 CCOC(=O)CC(=O)NCCCSC WXVL_AK0965SB3094 [0,1,0,0,0,0|1,0,0]=2 76 B13R0.330 CCOC(=O)CC(=O)NCCSCC WXVL_AK00494SB3094 [0,1,0,0,0,0|1,0,0]=2 77 B13R0.330 CCOC(=O)CC(=O)NCCSCC WXVL_AK00494SB3094 [0,1,0,0,0,0|1,0,0]=2 78 B13R0.331 CCOC(=O)CC(=O)NCCC(=O)N WXVL_AK00443SB3094 [0,1,0,0,0,0|2,0,1]=4 79 B13R0.331 CCOC(=O)CC(=O)NCCC(=O)N WXVL_AK00443SB3094 [0,1,0,0,0,0|2,0,1]=4 80 B13R0.331 CCOC(=O)CC(=O)NCCC(C)C WXVL_AK0068SB3094 [0,1,0,0,0,0|1,0,0]=2 81 B13R0.331 CCOC(=O)CC(=O)NCCC(C)C WXVL_AK0068SB3094 [0,1,0,0,0,0|1,0,0]=2 82 B13R0.331 CCOC(=O)CC(=O)NCCN(C)C WXVL_AK0058SB3094 [0,1,0,0,0,0|2,0,0]=3 83 B13R0.331 CCOC(=O)CC(=O)NCCN(C)C WXVL_AK0058SB3094 [0,1,0,0,0,0|2,0,0]=3 84 B13R0.809 CCCCNS(=O)(=O)CC(=O)OCC WXVL_AK00588HU0462 [0,1,0,0,0,0|2,0,0]=3 85 B13R0.809 CCCCNS(=O)(=O)CC(=O)OCC WXVL_AK00588HU0462 [0,1,0,0,0,0|2,0,0]=3 86 B13R0.809 CCOC(=O)CS(=O)(=O)NCCCO WXVL_AK0073HU0462 [0,1,0,0,0,0|3,0,0]=4 87 B13R0.809 CCOC(=O)CS(=O)(=O)NCCCO WXVL_AK0073HU0462 [0,1,0,0,0,0|3,0,0]=4 88 B13R0.809 CCOC(=O)CS(=O)(=O)NCCSC WXVL_AK00440HU0462 [0,1,0,0,0,0|3,0,0]=4 89 B13R0.809 CCOC(=O)CS(=O)(=O)NCCSC WXVL_AK00440HU0462 [0,1,0,0,0,0|3,0,0]=4 90 B13R0.1521 CCOC(=O)CC(=O)NCC(=O)NC WXVL_AK1222SB3094 [0,1,0,0,0,0|2,0,1]=4 91 B13R0.1521 CCOC(=O)CC(=O)NCC(=O)NC WXVL_AK1222SB3094 [0,1,0,0,0,0|2,0,1]=4 92 B13R0.1521 CCOC(=O)CC(=O)NC[C@@H](C)OC WXVL_AK00704SB3094 [0,1,0,0,0,0|2,0,0]=3 93 B13R0.1521 CCOC(=O)CC(=O)NC[C@@H](C)OC WXVL_AK00704SB3094 [0,1,0,0,0,0|2,0,0]=3 94 B13R0.1521 CCOC(=O)CC(=O)NC[C@@H](F)CO WXVL_AK00590SB3094 [0,1,0,0,0,0|2,0,0]=3 95 B13R0.1521 CCOC(=O)CC(=O)NC[C@@H](F)CO WXVL_AK00590SB3094 [0,1,0,0,0,0|2,0,0]=3 96 B13R0.1521 CCOC(=O)CC(=O)NC[C@H](O)CO WXVL_AK00483SB3094 [0,1,0,0,0,0|2,0,0]=3 97 B13R0.1521 CCOC(=O)CC(=O)NC[C@H](O)CO WXVL_AK00483SB3094 [0,1,0,0,0,0|2,0,0]=3 98 B13R1.33 CCOC(=O)CC(=O)N1CCCC1 WXVL_AN0008SB3094 [0,0,0,1,0,0|1,0,0]=2 99 B13R1.33 CCOC(=O)CC(=O)N1CCCC1 WXVL_AN0008SB3094 [0,0,0,1,0,0|1,0,0]=2 100 B13R1.725 CCCCNC(=O)C1=C(OCC1)C WXVL_AK00588SC00025 [0,0,0,1,0,0|2,0,1]=4 101 B13R1.725 CCCCNC(=O)C1=C(OCC1)C WXVL_AK00588SC00025 [0,0,0,1,0,0|2,0,1]=4 102 B13R1.2846 CCOC(=O)CC(=O)NC1CNC1 WXVL_AK1291SB3094 [0,0,0,1,0,0|2,0,0]=3 103 B13R1.2846 CCOC(=O)CC(=O)NC1CNC1 WXVL_AK1291SB3094 [0,0,0,1,0,0|2,0,0]=3 104 B13R1.2846 CCOC(=O)CC(=O)NC1CSC1 WXVL_AK2089SB3094 [0,0,0,1,0,0|2,0,0]=3 105 B13R1.2846 CCOC(=O)CC(=O)NC1CSC1 WXVL_AK2089SB3094 [0,0,0,1,0,0|2,0,0]=3 106 B11R0.155 C#CCCNC(=O)C(=O)OCC WXVL_AK3109SB4144 [0,0,0,0,1,0|1,0,2]=4 107 B11R0.155 C#CCCNC(=O)C(=O)OCC WXVL_AK3109SB4144 [0,0,0,0,1,0|1,0,2]=4 108 B11R0.155 C=CCCNC(=O)C(=O)OCC WXVL_AK00138SB4144 [0,0,0,0,1,0|1,0,2]=4 109 B11R0.155 C=CCCNC(=O)C(=O)OCC WXVL_AK00138SB4144 [0,0,0,0,1,0|1,0,2]=4 110 B11R0.155 CC/C=C(\C)/C(=O)NCCCC WXVL_AK00588SB0037 [0,0,0,0,1,0|3,0,0]=4 111 B11R0.155 CC/C=C(\C)/C(=O)NCCCC WXVL_AK00588SB0037 [0,0,0,0,1,0|3,0,0]=4 112 B11R0.155 CCCCNC(=O)C(=O)OCC WXVL_AK00588SB4144 [0,0,0,0,1,0|1,0,0]=2 113 B11R0.155 CCCCNC(=O)C(=O)OCC WXVL_AK00588SB4144 [0,0,0,0,1,0|1,0,0]=2 114 B11R0.155 CCOC(=O)C(=O)NCCC#N WXVL_AK0087SB4144 [0,0,0,0,1,0|2,0,1]=4 115 B11R0.155 CCOC(=O)C(=O)NCCC#N WXVL_AK0087SB4144 [0,0,0,0,1,0|2,0,1]=4 116 B11R0.155 CCOC(=O)C(=O)NCCCO WXVL_AK0073SB4144 [0,0,0,0,1,0|2,0,0]=3 117 B11R0.155 CCOC(=O)C(=O)NCCCO WXVL_AK0073SB4144 [0,0,0,0,1,0|2,0,0]=3 118 B11R0.155 CCOC(=O)C(=O)NCCSC WXVL_AK00440SB4144 [0,0,0,0,1,0|2,0,0]=3 119 B11R0.155 CCOC(=O)C(=O)NCCSC WXVL_AK00440SB4144 [0,0,0,0,1,0|2,0,0]=3 120 B13R0.193 C#CCCNC(=O)NCC(=O)OCC WXVL_AK3109YV0151 [0,0,0,0,0,1|1,0,2]=4 121 B13R0.193 C#CCCNC(=O)NCC(=O)OCC WXVL_AK3109YV0151 [0,0,0,0,0,1|1,0,2]=4 122 B13R0.193 C=CCCNC(=O)NCC(=O)OCC WXVL_AK00138YV0151 [0,0,0,0,0,1|1,0,2]=4 123 B13R0.193 C=CCCNC(=O)NCC(=O)OCC WXVL_AK00138YV0151 [0,0,0,0,0,1|1,0,2]=4 124 B13R0.193 CCCCNC(=O)/C=C/C(=O)OCC WXVL_AK00588SB0061 [0,0,0,0,0,1|1,0,1]=3 125 B13R0.193 CCCCNC(=O)/C=C/C(=O)OCC WXVL_AK00588SB0061 [0,0,0,0,0,1|1,0,1]=3 126 B13R0.193 CCCCNC(=O)NCC(=O)OCC WXVL_AK00588YV0151 [0,0,0,0,0,1|1,0,0]=2 127 B13R0.193 CCCCNC(=O)NCC(=O)OCC WXVL_AK00588YV0151 [0,0,0,0,0,1|1,0,0]=2 128 B13R0.193 CCOC(=O)/C=C/C(=O)NCCCO WXVL_AK0073SB0061 [0,0,0,0,0,1|2,0,1]=4 129 B13R0.193 CCOC(=O)/C=C/C(=O)NCCCO WXVL_AK0073SB0061 [0,0,0,0,0,1|2,0,1]=4 130 B13R0.193 CCOC(=O)/C=C/C(=O)NCCSC WXVL_AK00440SB0061 [0,0,0,0,0,1|2,0,1]=4 131 B13R0.193 CCOC(=O)/C=C/C(=O)NCCSC WXVL_AK00440SB0061 [0,0,0,0,0,1|2,0,1]=4 132 B13R0.193 CCOC(=O)CNC(=O)NCCC#N WXVL_AK0087YV0151 [0,0,0,0,0,1|2,0,1]=4 133 B13R0.193 CCOC(=O)CNC(=O)NCCC#N WXVL_AK0087YV0151 [0,0,0,0,0,1|2,0,1]=4 134 B13R0.193 CCOC(=O)CNC(=O)NCCCO WXVL_AK0073YV0151 [0,0,0,0,0,1|2,0,0]=3 135 B13R0.193 CCOC(=O)CNC(=O)NCCCO WXVL_AK0073YV0151 [0,0,0,0,0,1|2,0,0]=3 136 B13R0.193 CCOC(=O)CNC(=O)NCCSC WXVL_AK00440YV0151 [0,0,0,0,0,1|2,0,0]=3 137 B13R0.193 CCOC(=O)CNC(=O)NCCSC WXVL_AK00440YV0151 [0,0,0,0,0,1|2,0,0]=3 138 B10R0.1 CCNC(=O)COCCOC WXVL_AK00476SB0159 [2,0,0,0,0,0|2,0,0]=4 139 B10R0.1 CCNC(=O)COCCOC WXVL_AK00476SB0159 [2,0,0,0,0,0|2,0,0]=4 140 B10R0.2 CCNC(=O)CC(=O)OCC WXVL_AK00476SB3094 [2,0,0,0,0,0|1,0,0]=3 141 B10R0.2 CCNC(=O)CC(=O)OCC WXVL_AK00476SB3094 [2,0,0,0,0,0|1,0,0]=3 142 B10R0.18 CCCNC(=O)CC(=O)OC WXVL_AK00504SB2790 [2,0,0,0,0,0|1,0,0]=3 143 B10R0.18 CCCNC(=O)CC(=O)OC WXVL_AK00504SB2790 [2,0,0,0,0,0|1,0,0]=3 144 B10R0.18 COC(=O)CC(=O)NCCF WXVL_AK00466SB2790 [2,0,0,0,0,0|2,0,0]=4 145 B10R0.18 COC(=O)CC(=O)NCCF WXVL_AK00466SB2790 [2,0,0,0,0,0|2,0,0]=4 146 B10R0.91 CC/C=C/CC(=O)NCCC WXVL_AK00504SB0349 [2,0,0,0,0,0|2,0,0]=4 147 B10R0.91 CC/C=C/CC(=O)NCCC WXVL_AK00504SB0349 [2,0,0,0,0,0|2,0,0]=4 148 B10R0.91 CCCCNC(=O)CCOC WXVL_AK00588SB0156 [2,0,0,0,0,0|1,0,1]=4 149 B10R0.91 CCCCNC(=O)CCOC WXVL_AK00588SB0156 [2,0,0,0,0,0|1,0,1]=4 150 B10R0.91 CCCCNC(=O)COCC WXVL_AK00588SB0091 [2,0,0,0,0,0|1,0,0]=3 151 B10R0.91 CCCCNC(=O)COCC WXVL_AK00588SB0091 [2,0,0,0,0,0|1,0,0]=3 152 B10R0.91 CCCCNC(=O)CSCC WXVL_AK00588SB0002 [2,0,0,0,0,0|1,1,0]=4 153 B10R0.91 CCCCNC(=O)CSCC WXVL_AK00588SB0002 [2,0,0,0,0,0|1,1,0]=4 154 B10R0.91 CCCNC(=O)/C=C/OCC WXVL_AK00504SB3226 [2,0,0,0,0,0|1,0,1]=4 155 B10R0.91 CCCNC(=O)/C=C/OCC WXVL_AK00504SB3226 [2,0,0,0,0,0|1,0,1]=4 156 B10R0.91 CCOCC(=O)NCCCO WXVL_AK0073SB0091 [2,0,0,0,0,0|2,0,0]=4 157 B10R0.91 CCOCC(=O)NCCCO WXVL_AK0073SB0091 [2,0,0,0,0,0|2,0,0]=4 158 B10R0.91 CCOCC(=O)NCCSC WXVL_AK00440SB0091 [2,0,0,0,0,0|2,0,0]=4 159 B10R0.91 CCOCC(=O)NCCSC WXVL_AK00440SB0091 [2,0,0,0,0,0|2,0,0]=4 160 B12R0.1 CCCCOCCNC(=O)CCC WXVL_AK9674SB0073 [1,1,0,0,0,0|1,0,1]=4 161 B12R0.1 CCCCOCCNC(=O)CCC WXVL_AK9674SB0073 [1,1,0,0,0,0|1,0,1]=4 162 B12R0.68 CCOC(=O)CC(=O)N[C@@H](C)CC WXVL_AK00678SB3094 [1,1,0,0,0,0|1,0,0]=3 163 B12R0.68 CCOC(=O)CC(=O)N[C@@H](C)CC WXVL_AK00678SB3094 [1,1,0,0,0,0|1,0,0]=3 164 B12R0.68 CCOC(=O)CC(=O)N[C@@H](C)CF WXVL_AK00558SB3094 [1,1,0,0,0,0|2,0,0]=4 165 B12R0.68 CCOC(=O)CC(=O)N[C@@H](C)CF WXVL_AK00558SB3094 [1,1,0,0,0,0|2,0,0]=4 166 B12R0.68 CCOC(=O)CC(=O)N[C@@H](C)CO WXVL_AK0109SB3094 [1,1,0,0,0,0|2,0,0]=4 167 B12R0.68 CCOC(=O)CC(=O)N[C@@H](C)CO WXVL_AK0109SB3094 [1,1,0,0,0,0|2,0,0]=4 168 B12R0.69 CCOC(=O)CC(=O)N(C)CCO WXVL_AN2670SB3094 [1,1,0,0,0,0|2,0,0]=4 169 B12R0.69 CCOC(=O)CC(=O)N(C)CCO WXVL_AN2670SB3094 [1,1,0,0,0,0|2,0,0]=4 170 B12R0.283 C=C(C)CNC(=O)CC(=O)OCC WXVL_AK0761SB3094 [1,1,0,0,0,0|1,0,1]=4 171 B12R0.283 C=C(C)CNC(=O)CC(=O)OCC WXVL_AK0761SB3094 [1,1,0,0,0,0|1,0,1]=4 172 B12R0.283 CCOC(=O)CC(=O)NCC(C)C WXVL_AK00544SB3094 [1,1,0,0,0,0|1,0,0]=3 173 B12R0.283 CCOC(=O)CC(=O)NCC(C)C WXVL_AK00544SB3094 [1,1,0,0,0,0|1,0,0]=3 174 B12R0.283 CCOC(=O)CC(=O)NCC(C)O WXVL_AK0052SB3094 [1,1,0,0,0,0|1,0,0]=3 175 B12R0.283 CCOC(=O)CC(=O)NCC(C)O WXVL_AK0052SB3094 [1,1,0,0,0,0|1,0,0]=3 176 B12R0.283 CCOC(=O)CC(=O)NCC(F)F WXVL_AK0136SB3094 [1,1,0,0,0,0|2,0,0]=4 177 B12R0.283 CCOC(=O)CC(=O)NCC(F)F WXVL_AK0136SB3094 [1,1,0,0,0,0|2,0,0]=4 178 B12R0.283 CCOC(=O)CC(=O)NC[C@H](C)O WXVL_AK0113SB3094 [1,1,0,0,0,0|1,0,0]=3 179 B12R0.283 CCOC(=O)CC(=O)NC[C@H](C)O WXVL_AK0113SB3094 [1,1,0,0,0,0|1,0,0]=3 180 B12R0.661 CCCNS(=O)(=O)CC(=O)OCC WXVL_AK00504HU0462 [1,1,0,0,0,0|2,0,0]=4 181 B12R0.661 CCCNS(=O)(=O)CC(=O)OCC WXVL_AK00504HU0462 [1,1,0,0,0,0|2,0,0]=4 182 B12R0.47 CC/C=C/CC(=O)NCCCCC WXVL_AK0076SB0349 [1,1,0,0,0,0|2,0,0]=4 183 B12R0.47 CC/C=C/CC(=O)NCCCCC WXVL_AK0076SB0349 [1,1,0,0,0,0|2,0,0]=4 184 B12R0.47 CC/C=C/CC(=O)NCCCCO WXVL_AK0075SB0349 [1,1,0,0,0,0|2,0,0]=4 185 B12R0.47 CC/C=C/CC(=O)NCCCCO WXVL_AK0075SB0349 [1,1,0,0,0,0|2,0,0]=4 186 B12R0.47 CC/C=C/CC(=O)NCCCOC WXVL_AK00637SB0349 [1,1,0,0,0,0|2,0,0]=4 187 B12R0.47 CC/C=C/CC(=O)NCCCOC WXVL_AK00637SB0349 [1,1,0,0,0,0|2,0,0]=4 188 B12R0.47 CC/C=C/CC(=O)NCCCSC WXVL_AK0965SB0349 [1,1,0,0,0,0|2,0,0]=4 189 B12R0.47 CC/C=C/CC(=O)NCCCSC WXVL_AK0965SB0349 [1,1,0,0,0,0|2,0,0]=4 190 B12R0.47 CC/C=C/CC(=O)NCCSCC WXVL_AK00494SB0349 [1,1,0,0,0,0|2,0,0]=4 191 B12R0.47 CC/C=C/CC(=O)NCCSCC WXVL_AK00494SB0349 [1,1,0,0,0,0|2,0,0]=4 192 B12R0.47 CCCCCNC(=O)/C=C/OCC WXVL_AK0076SB3226 [1,1,0,0,0,0|1,0,1]=4 193 B12R0.47 CCCCCNC(=O)/C=C/OCC WXVL_AK0076SB3226 [1,1,0,0,0,0|1,0,1]=4 194 B12R0.47 CCO/C=C/C(=O)NCCCCO WXVL_AK0075SB3226 [1,1,0,0,0,0|1,0,1]=4 195 B12R0.47 CCO/C=C/C(=O)NCCCCO WXVL_AK0075SB3226 [1,1,0,0,0,0|1,0,1]=4 196 B12R0.47 CCO/C=C/C(=O)NCCCOC WXVL_AK00637SB3226 [1,1,0,0,0,0|1,0,1]=4 197 B12R0.47 CCO/C=C/C(=O)NCCCOC WXVL_AK00637SB3226 [1,1,0,0,0,0|1,0,1]=4 198 B12R0.47 CCO/C=C/C(=O)NCCCSC WXVL_AK0965SB3226 [1,1,0,0,0,0|1,0,1]=4 199 B12R0.47 CCO/C=C/C(=O)NCCCSC WXVL_AK0965SB3226 [1,1,0,0,0,0|1,0,1]=4 200 B12R0.47 CCO/C=C/C(=O)NCCSCC WXVL_AK00494SB3226 [1,1,0,0,0,0|1,0,1]=4 201 B12R0.47 CCO/C=C/C(=O)NCCSCC WXVL_AK00494SB3226 [1,1,0,0,0,0|1,0,1]=4 202 B12R0.233 CC/C=C/CC(=O)NCCC(C)C WXVL_AK0068SB0349 [1,1,0,0,0,0|2,0,0]=4 203 B12R0.233 CC/C=C/CC(=O)NCCC(C)C WXVL_AK0068SB0349 [1,1,0,0,0,0|2,0,0]=4 204 B12R0.233 CCO/C=C/C(=O)NCCC(C)C WXVL_AK0068SB3226 [1,1,0,0,0,0|1,0,1]=4 205 B12R0.233 CCO/C=C/C(=O)NCCC(C)C WXVL_AK0068SB3226 [1,1,0,0,0,0|1,0,1]=4 206 B12R0.110 CCCCNC(=O)C(C)C(=O)OC WXVL_AK00588SB5708 [1,1,0,0,0,0|1,0,0]=3 207 B12R0.110 CCCCNC(=O)C(C)C(=O)OC WXVL_AK00588SB5708 [1,1,0,0,0,0|1,0,0]=3 208 B12R0.110 COC(=O)C(C)C(=O)NCCCO WXVL_AK0073SB5708 [1,1,0,0,0,0|2,0,0]=4 209 B12R0.110 COC(=O)C(C)C(=O)NCCCO WXVL_AK0073SB5708 [1,1,0,0,0,0|2,0,0]=4 210 B12R0.110 COC(=O)C(C)C(=O)NCCSC WXVL_AK00440SB5708 [1,1,0,0,0,0|2,0,0]=4 211 B12R0.110 COC(=O)C(C)C(=O)NCCSC WXVL_AK00440SB5708 [1,1,0,0,0,0|2,0,0]=4 212 B12R0.113 C#CCCCNC(=O)CC(=O)OC WXVL_AK00218SB2790 [1,1,0,0,0,0|1,0,1]=4 213 B12R0.113 C#CCCCNC(=O)CC(=O)OC WXVL_AK00218SB2790 [1,1,0,0,0,0|1,0,1]=4 214 B12R0.113 CCCCCNC(=O)CC(=O)OC WXVL_AK0076SB2790 [1,1,0,0,0,0|1,0,0]=3 215 B12R0.113 CCCCCNC(=O)CC(=O)OC WXVL_AK0076SB2790 [1,1,0,0,0,0|1,0,0]=3 216 B12R0.113 CCSCCNC(=O)CC(=O)OC WXVL_AK00494SB2790 [1,1,0,0,0,0|1,0,0]=3 217 B12R0.113 CCSCCNC(=O)CC(=O)OC WXVL_AK00494SB2790 [1,1,0,0,0,0|1,0,0]=3 218 B12R0.113 COC(=O)CC(=O)NCCCCO WXVL_AK0075SB2790 [1,1,0,0,0,0|1,0,0]=3 219 B12R0.113 COC(=O)CC(=O)NCCCCO WXVL_AK0075SB2790 [1,1,0,0,0,0|1,0,0]=3 220 B12R0.113 COC(=O)CC(=O)NCCCSC WXVL_AK0965SB2790 [1,1,0,0,0,0|1,0,0]=3 221 B12R0.113 COC(=O)CC(=O)NCCCSC WXVL_AK0965SB2790 [1,1,0,0,0,0|1,0,0]=3 222 B12R0.113 COCCCNC(=O)CC(=O)OC WXVL_AK00637SB2790 [1,1,0,0,0,0|1,0,0]=3 223 B12R0.113 COCCCNC(=O)CC(=O)OC WXVL_AK00637SB2790 [1,1,0,0,0,0|1,0,0]=3 224 B12R0.147 COC(=O)CC(=O)NC[C@@H](C)OC WXVL_AK00704SB2790 [1,1,0,0,0,0|2,0,0]=4 225 B12R0.147 COC(=O)CC(=O)NC[C@@H](C)OC WXVL_AK00704SB2790 [1,1,0,0,0,0|2,0,0]=4 226 B12R0.147 COC(=O)CC(=O)NC[C@@H](F)CO WXVL_AK00590SB2790 [1,1,0,0,0,0|2,0,0]=4 227 B12R0.147 COC(=O)CC(=O)NC[C@@H](F)CO WXVL_AK00590SB2790 [1,1,0,0,0,0|2,0,0]=4 228 B12R0.147 COC(=O)CC(=O)NC[C@H](O)CO WXVL_AK00483SB2790 [1,1,0,0,0,0|2,0,0]=4 229 B12R0.147 COC(=O)CC(=O)NC[C@H](O)CO WXVL_AK00483SB2790 [1,1,0,0,0,0|2,0,0]=4 230 B12R0.240 COC(=O)CC(=O)NCCC(C)C WXVL_AK0068SB2790 [1,1,0,0,0,0|1,0,0]=3 231 B12R0.240 COC(=O)CC(=O)NCCC(C)C WXVL_AK0068SB2790 [1,1,0,0,0,0|1,0,0]=3 232 B12R0.240 COC(=O)CC(=O)NCCN(C)C WXVL_AK0058SB2790 [1,1,0,0,0,0|2,0,0]=4 233 B12R0.240 COC(=O)CC(=O)NCCN(C)C WXVL_AK0058SB2790 [1,1,0,0,0,0|2,0,0]=4 234 B12R0.252 COCCN(C)C(=O)CC(=O)OC WXVL_AN0085SB2790 [1,1,0,0,0,0|2,0,0]=4 235 B12R0.252 COCCN(C)C(=O)CC(=O)OC WXVL_AN0085SB2790 [1,1,0,0,0,0|2,0,0]=4 236 B12R0.318 CCCCNC(=O)CS(=O)(=O)CC WXVL_AK00588SBD438 [1,1,0,0,0,0|2,0,0]=4 237 B12R0.318 CCCCNC(=O)CS(=O)(=O)CC WXVL_AK00588SBD438 [1,1,0,0,0,0|2,0,0]=4 238 B12R0.657 CCCCNS(=O)(=O)CC(=O)OC WXVL_AK00588HU0075 [1,1,0,0,0,0|2,0,0]=4 239 B12R0.657 CCCCNS(=O)(=O)CC(=O)OC WXVL_AK00588HU0075 [1,1,0,0,0,0|2,0,0]=4 240 B12R0.54 CCOC(=O)C(=O)NCCC(C)C WXVL_AK0068SB4144 [0,1,0,0,1,0|1,0,0]=3 241 B12R0.54 CCOC(=O)C(=O)NCCC(C)C WXVL_AK0068SB4144 [0,1,0,0,1,0|1,0,0]=3 242 B12R0.54 CCOC(=O)C(=O)NCCN(C)C WXVL_AK0058SB4144 [0,1,0,0,1,0|2,0,0]=4 243 B12R0.54 CCOC(=O)C(=O)NCCN(C)C WXVL_AK0058SB4144 [0,1,0,0,1,0|2,0,0]=4 244 B12R0.193 CCOC(=O)C(=O)NC[C@@H](C)OC WXVL_AK00704SB4144 [0,1,0,0,1,0|2,0,0]=4 245 B12R0.193 CCOC(=O)C(=O)NC[C@@H](C)OC WXVL_AK00704SB4144 [0,1,0,0,1,0|2,0,0]=4 246 B12R0.193 CCOC(=O)C(=O)NC[C@@H](F)CO WXVL_AK00590SB4144 [0,1,0,0,1,0|2,0,0]=4 247 B12R0.193 CCOC(=O)C(=O)NC[C@@H](F)CO WXVL_AK00590SB4144 [0,1,0,0,1,0|2,0,0]=4 248 B12R0.193 CCOC(=O)C(=O)NC[C@H](O)CO WXVL_AK00483SB4144 [0,1,0,0,1,0|2,0,0]=4 249 B12R0.193 CCOC(=O)C(=O)NC[C@H](O)CO WXVL_AK00483SB4144 [0,1,0,0,1,0|2,0,0]=4 250 B14R0.33 CCC[C@H](C)NC(=O)/C=C/C(=O)OCC WXVL_AK00682SB0061 [0,1,0,0,0,1|1,0,1]=4 251 B14R0.33 CCC[C@H](C)NC(=O)/C=C/C(=O)OCC WXVL_AK00682SB0061 [0,1,0,0,0,1|1,0,1]=4 252 B14R0.33 CCC[C@H](C)NC(=O)NCC(=O)OCC WXVL_AK00682YV0151 [0,1,0,0,0,1|1,0,0]=3 253 B14R0.33 CCC[C@H](C)NC(=O)NCC(=O)OCC WXVL_AK00682YV0151 [0,1,0,0,0,1|1,0,0]=3 254 B14R0.33 CCOC(=O)CNC(=O)NC(C)CCO WXVL_AK1288YV0151 [0,1,0,0,0,1|2,0,0]=4 255 B14R0.33 CCOC(=O)CNC(=O)NC(C)CCO WXVL_AK1288YV0151 [0,1,0,0,0,1|2,0,0]=4 256 B14R0.33 CCOC(=O)CNC(=O)N[C@@H](C)COC WXVL_AK0137YV0151 [0,1,0,0,0,1|2,0,0]=4 257 B14R0.33 CCOC(=O)CNC(=O)N[C@@H](C)COC WXVL_AK0137YV0151 [0,1,0,0,0,1|2,0,0]=4 258 B14R0.33 CCOC(=O)CNC(=O)N[C@H](C)COC WXVL_AK00613YV0151 [0,1,0,0,0,1|2,0,0]=4 259 B14R0.33 CCOC(=O)CNC(=O)N[C@H](C)COC WXVL_AK00613YV0151 [0,1,0,0,0,1|2,0,0]=4 260 B14R0.199 C#CCCCNC(=O)NCC(=O)OCC WXVL_AK00218YV0151 [0,1,0,0,0,1|1,0,1]=4 261 B14R0.199 C#CCCCNC(=O)NCC(=O)OCC WXVL_AK00218YV0151 [0,1,0,0,0,1|1,0,1]=4 262 B14R0.199 CCCCCNC(=O)/C=C/C(=O)OCC WXVL_AK0076SB0061 [0,1,0,0,0,1|1,0,1]=4 263 B14R0.199 CCCCCNC(=O)/C=C/C(=O)OCC WXVL_AK0076SB0061 [0,1,0,0,0,1|1,0,1]=4 264 B14R0.199 CCCCCNC(=O)NCC(=O)OCC WXVL_AK0076YV0151 [0,1,0,0,0,1|1,0,0]=3 265 B14R0.199 CCCCCNC(=O)NCC(=O)OCC WXVL_AK0076YV0151 [0,1,0,0,0,1|1,0,0]=3 266 B14R0.199 CCOC(=O)/C=C/C(=O)NCCCCO WXVL_AK0075SB0061 [0,1,0,0,0,1|1,0,1]=4 267 B14R0.199 CCOC(=O)/C=C/C(=O)NCCCCO WXVL_AK0075SB0061 [0,1,0,0,0,1|1,0,1]=4 268 B14R0.199 CCOC(=O)/C=C/C(=O)NCCCOC WXVL_AK00637SB0061 [0,1,0,0,0,1|1,0,1]=4 269 B14R0.199 CCOC(=O)/C=C/C(=O)NCCCOC WXVL_AK00637SB0061 [0,1,0,0,0,1|1,0,1]=4 270 B14R0.199 CCOC(=O)/C=C/C(=O)NCCCSC WXVL_AK0965SB0061 [0,1,0,0,0,1|1,0,1]=4 271 B14R0.199 CCOC(=O)/C=C/C(=O)NCCCSC WXVL_AK0965SB0061 [0,1,0,0,0,1|1,0,1]=4 272 B14R0.199 CCOC(=O)/C=C/C(=O)NCCSCC WXVL_AK00494SB0061 [0,1,0,0,0,1|1,0,1]=4 273 B14R0.199 CCOC(=O)/C=C/C(=O)NCCSCC WXVL_AK00494SB0061 [0,1,0,0,0,1|1,0,1]=4 274 B14R0.199 CCOC(=O)CNC(=O)NCCCCO WXVL_AK0075YV0151 [0,1,0,0,0,1|1,0,0]=3 275 B14R0.199 CCOC(=O)CNC(=O)NCCCCO WXVL_AK0075YV0151 [0,1,0,0,0,1|1,0,0]=3 276 B14R0.199 CCOC(=O)CNC(=O)NCCCOC WXVL_AK00637YV0151 [0,1,0,0,0,1|1,0,0]=3 277 B14R0.199 CCOC(=O)CNC(=O)NCCCOC WXVL_AK00637YV0151 [0,1,0,0,0,1|1,0,0]=3 278 B14R0.199 CCOC(=O)CNC(=O)NCCCSC WXVL_AK0965YV0151 [0,1,0,0,0,1|1,0,0]=3 279 B14R0.199 CCOC(=O)CNC(=O)NCCCSC WXVL_AK0965YV0151 [0,1,0,0,0,1|1,0,0]=3 280 B14R0.199 CCOC(=O)CNC(=O)NCCSCC WXVL_AK00494YV0151 [0,1,0,0,0,1|1,0,0]=3 281 B14R0.199 CCOC(=O)CNC(=O)NCCSCC WXVL_AK00494YV0151 [0,1,0,0,0,1|1,0,0]=3 282 B14R0.227 CCCCNC(=O)CNC(=O)CC(C)C WXVL_AK00588SB2133 [0,1,0,0,0,1|2,0,0]=4 283 B14R0.227 CCCCNC(=O)CNC(=O)CC(C)C WXVL_AK00588SB2133 [0,1,0,0,0,1|2,0,0]=4 284 B14R0.232 CCOC(=O)[C@H](C)NC(=O)CCCCBr WXVL_AK1648SB3153 [0,1,0,0,0,1|2,0,0]=4 285 B14R0.232 CCOC(=O)[C@H](C)NC(=O)CCCCBr WXVL_AK1648SB3153 [0,1,0,0,0,1|2,0,0]=4 286 B14R0.232 CCOC(=O)[C@H](C)NC(=O)CCCCCl WXVL_AK1648SB0379 [0,1,0,0,0,1|2,0,0]=4 287 B14R0.232 CCOC(=O)[C@H](C)NC(=O)CCCCCl WXVL_AK1648SB0379 [0,1,0,0,0,1|2,0,0]=4 288 B14R0.232 CCOC(=O)[C@H](C)NC(=O)NCCCCl WXVL_AK1648YV0130 [0,1,0,0,0,1|2,0,0]=4 289 B14R0.232 CCOC(=O)[C@H](C)NC(=O)NCCCCl WXVL_AK1648YV0130 [0,1,0,0,0,1|2,0,0]=4 290 B14R0.431 CCOC(=O)/C=C/C(=O)NCCC(C)C WXVL_AK0068SB0061 [0,1,0,0,0,1|1,0,1]=4 291 B14R0.431 CCOC(=O)/C=C/C(=O)NCCC(C)C WXVL_AK0068SB0061 [0,1,0,0,0,1|1,0,1]=4 292 B14R0.431 CCOC(=O)CNC(=O)NCCC(C)C WXVL_AK0068YV0151 [0,1,0,0,0,1|1,0,0]=3 293 B14R0.431 CCOC(=O)CNC(=O)NCCC(C)C WXVL_AK0068YV0151 [0,1,0,0,0,1|1,0,0]=3 294 B14R0.431 CCOC(=O)CNC(=O)NCCN(C)C WXVL_AK0058YV0151 [0,1,0,0,0,1|2,0,0]=4 295 B14R0.431 CCOC(=O)CNC(=O)NCCN(C)C WXVL_AK0058YV0151 [0,1,0,0,0,1|2,0,0]=4 296 B14R0.597 CCOC(=O)CNC(=O)N(C)CCOC WXVL_AN0085YV0151 [0,1,0,0,0,1|2,0,0]=4 297 B14R0.597 CCOC(=O)CNC(=O)N(C)CCOC WXVL_AN0085YV0151 [0,1,0,0,0,1|2,0,0]=4 298 B14R0.1240 CCOC(=O)CNC(=O)NC[C@@H](C)OC WXVL_AK00704YV0151 [0,1,0,0,0,1|2,0,0]=4 299 B14R0.1240 CCOC(=O)CNC(=O)NC[C@@H](C)OC WXVL_AK00704YV0151 [0,1,0,0,0,1|2,0,0]=4 300 B14R0.1240 CCOC(=O)CNC(=O)NC[C@@H](F)CO WXVL_AK00590YV0151 [0,1,0,0,0,1|2,0,0]=4 301 B14R0.1240 CCOC(=O)CNC(=O)NC[C@@H](F)CO WXVL_AK00590YV0151 [0,1,0,0,0,1|2,0,0]=4 302 B14R0.1240 CCOC(=O)CNC(=O)NC[C@H](O)CO WXVL_AK00483YV0151 [0,1,0,0,0,1|2,0,0]=4 303 B14R0.1240 CCOC(=O)CNC(=O)NC[C@H](O)CO WXVL_AK00483YV0151 [0,1,0,0,0,1|2,0,0]=4 304 B14R0.2424 C/C=C/C(=O)N[C@@H](C)C(=O)OCCCC WXVL_AK1571SB0340 [0,1,0,0,0,1|1,0,1]=4 305 B14R0.2424 C/C=C/C(=O)N[C@@H](C)C(=O)OCCCC WXVL_AK1571SB0340 [0,1,0,0,0,1|1,0,1]=4 306 B14R0.2424 CC#CC(=O)N[C@@H](C)C(=O)OCCCC WXVL_AK1571SB1240 [0,1,0,0,0,1|1,0,1]=4 307 B14R0.2424 CC#CC(=O)N[C@@H](C)C(=O)OCCCC WXVL_AK1571SB1240 [0,1,0,0,0,1|1,0,1]=4 308 B14R0.2424 CCCCOC(=O)[C@H](C)NC(=O)CCC WXVL_AK1571SB0073 [0,1,0,0,0,1|1,0,0]=3 309 B14R0.2424 CCCCOC(=O)[C@H](C)NC(=O)CCC WXVL_AK1571SB0073 [0,1,0,0,0,1|1,0,0]=3 310 B14R0.2424 CCCCOC(=O)[C@H](C)NC(=O)COC WXVL_AK1571SB0090 [0,1,0,0,0,1|2,0,0]=4 311 B14R0.2424 CCCCOC(=O)[C@H](C)NC(=O)COC WXVL_AK1571SB0090 [0,1,0,0,0,1|2,0,0]=4 312 B14R0.2424 CCCCOC(=O)[C@H](C)NC(=O)CSC WXVL_AK1571SB1267 [0,1,0,0,0,1|2,0,0]=4 313 B14R0.2424 CCCCOC(=O)[C@H](C)NC(=O)CSC WXVL_AK1571SB1267 [0,1,0,0,0,1|2,0,0]=4 314 B14R0.1172 CCOC(=O)CC(=O)N(C)CCN(C)C WXVL_AN0052SB3094 [0,2,0,0,0,0|2,0,0]=4 315 B14R0.1172 CCOC(=O)CC(=O)N(C)CCN(C)C WXVL_AN0052SB3094 [0,2,0,0,0,0|2,0,0]=4 316 B14R0.390 CCOC(=O)CC(=O)NC(C)CN(C)C WXVL_AK0938SB3094 [0,2,0,0,0,0|2,0,0]=4 317 B14R0.390 CCOC(=O)CC(=O)NC(C)CN(C)C WXVL_AK0938SB3094 [0,2,0,0,0,0|2,0,0]=4 318 B14R0.722 CCC[C@H](C)NS(=O)(=O)CC(=O)OCC WXVL_AK00682HU0462 [0,2,0,0,0,0|2,0,0]=4 319 B14R0.722 CCC[C@H](C)NS(=O)(=O)CC(=O)OCC WXVL_AK00682HU0462 [0,2,0,0,0,0|2,0,0]=4 320 B14R0.1230 CCOC(=O)CC(=O)NC(C)(C)COC WXVL_AK1295SB3094 [0,2,0,0,0,0|2,0,0]=4 321 B14R0.1230 CCOC(=O)CC(=O)NC(C)(C)COC WXVL_AK1295SB3094 [0,2,0,0,0,0|2,0,0]=4 322 B14R0.2868 CCC[C@@H](CO)NC(=O)CC(=O)OCC WXVL_AK2551SB3094 [0,2,0,0,0,0|1,0,0]=3 323 B14R0.2868 CCC[C@@H](CO)NC(=O)CC(=O)OCC WXVL_AK2551SB3094 [0,2,0,0,0,0|1,0,0]=3 324 B14R0.73 C#CCCCCNC(=O)CC(=O)OCC WXVL_AK00614SB3094 [0,2,0,0,0,0|1,0,0]=3 325 B14R0.73 C#CCCCCNC(=O)CC(=O)OCC WXVL_AK00614SB3094 [0,2,0,0,0,0|1,0,0]=3 326 B14R0.73 C#CCOCCNC(=O)CC(=O)OCC WXVL_AK00687SB3094 [0,2,0,0,0,0|1,0,1]=4 327 B14R0.73 C#CCOCCNC(=O)CC(=O)OCC WXVL_AK00687SB3094 [0,2,0,0,0,0|1,0,1]=4 328 B14R0.73 C=COCCCNC(=O)CC(=O)OCC WXVL_AK7221SB3094 [0,2,0,0,0,0|1,0,1]=4 329 B14R0.73 C=COCCCNC(=O)CC(=O)OCC WXVL_AK7221SB3094 [0,2,0,0,0,0|1,0,1]=4 330 B14R0.73 CCCCCCNC(=O)CC(=O)OCC WXVL_AK0286SB3094 [0,2,0,0,0,0|1,0,0]=3 331 B14R0.73 CCCCCCNC(=O)CC(=O)OCC WXVL_AK0286SB3094 [0,2,0,0,0,0|1,0,0]=3 332 B14R0.73 CCOC(=O)CC(=O)NCCCCCO WXVL_AK0077SB3094 [0,2,0,0,0,0|1,0,0]=3 333 B14R0.73 CCOC(=O)CC(=O)NCCCCCO WXVL_AK0077SB3094 [0,2,0,0,0,0|1,0,0]=3 334 B14R0.73 CCOC(=O)CC(=O)NCCNCCO WXVL_AK0954SB3094 [0,2,0,0,0,0|1,0,0]=3 335 B14R0.73 CCOC(=O)CC(=O)NCCNCCO WXVL_AK0954SB3094 [0,2,0,0,0,0|1,0,0]=3 336 B14R0.73 CCOCCCNC(=O)CC(=O)OCC WXVL_AK0072SB3094 [0,2,0,0,0,0|1,0,0]=3 337 B14R0.73 CCOCCCNC(=O)CC(=O)OCC WXVL_AK0072SB3094 [0,2,0,0,0,0|1,0,0]=3 338 B14R0.1824 CCCCCNS(=O)(=O)CC(=O)OCC WXVL_AK0076HU0462 [0,2,0,0,0,0|2,0,0]=4 339 B14R0.1824 CCCCCNS(=O)(=O)CC(=O)OCC WXVL_AK0076HU0462 [0,2,0,0,0,0|2,0,0]=4 340 B14R0.1824 CCOC(=O)CS(=O)(=O)NCCCCO WXVL_AK0075HU0462 [0,2,0,0,0,0|2,0,0]=4 341 B14R0.1824 CCOC(=O)CS(=O)(=O)NCCCCO WXVL_AK0075HU0462 [0,2,0,0,0,0|2,0,0]=4 342 B14R0.1824 CCOC(=O)CS(=O)(=O)NCCCOC WXVL_AK00637HU0462 [0,2,0,0,0,0|2,0,0]=4 343 B14R0.1824 CCOC(=O)CS(=O)(=O)NCCCOC WXVL_AK00637HU0462 [0,2,0,0,0,0|2,0,0]=4 344 B14R0.1824 CCOC(=O)CS(=O)(=O)NCCCSC WXVL_AK0965HU0462 [0,2,0,0,0,0|2,0,0]=4 345 B14R0.1824 CCOC(=O)CS(=O)(=O)NCCCSC WXVL_AK0965HU0462 [0,2,0,0,0,0|2,0,0]=4 346 B14R0.1824 CCOC(=O)CS(=O)(=O)NCCSCC WXVL_AK00494HU0462 [0,2,0,0,0,0|2,0,0]=4 347 B14R0.1824 CCOC(=O)CS(=O)(=O)NCCSCC WXVL_AK00494HU0462 [0,2,0,0,0,0|2,0,0]=4 348 B14R0.2861 CCOC(=O)CC(=O)NCCC(C)CO WXVL_AK4143SB3094 [0,2,0,0,0,0|1,0,0]=3 349 B14R0.2861 CCOC(=O)CC(=O)NCCC(C)CO WXVL_AK4143SB3094 [0,2,0,0,0,0|1,0,0]=3 350 B14R0.2863 CCOC(=O)CC(=O)NCCNC(=O)C WXVL_AK0057SB3094 [0,2,0,0,0,0|1,0,1]=4 351 B14R0.2863 CCOC(=O)CC(=O)NCCNC(=O)C WXVL_AK0057SB3094 [0,2,0,0,0,0|1,0,1]=4 352 B14R0.2863 CCOC(=O)CC(=O)NCCOC(C)C WXVL_AK0128SB3094 [0,2,0,0,0,0|1,0,0]=3 353 B14R0.2863 CCOC(=O)CC(=O)NCCOC(C)C WXVL_AK0128SB3094 [0,2,0,0,0,0|1,0,0]=3 354 B14R0.423 CCOC(=O)CC(=O)NCCC(C)(C)O WXVL_AK1558SB3094 [0,2,0,0,0,0|1,0,0]=3 355 B14R0.423 CCOC(=O)CC(=O)NCCC(C)(C)O WXVL_AK1558SB3094 [0,2,0,0,0,0|1,0,0]=3 356 B14R0.423 CCOC(=O)CC(=O)NCCC(F)(F)F WXVL_AK0145SB3094 [0,2,0,0,0,0|2,0,0]=4 357 B14R0.423 CCOC(=O)CC(=O)NCCC(F)(F)F WXVL_AK0145SB3094 [0,2,0,0,0,0|2,0,0]=4 358 B14R0.423 CCOC(=O)CC(=O)NCCS(=O)(=O)C WXVL_AK0333SB3094 [0,2,0,0,0,0|2,0,0]=4 359 B14R0.423 CCOC(=O)CC(=O)NCCS(=O)(=O)C WXVL_AK0333SB3094 [0,2,0,0,0,0|2,0,0]=4 360 B14R0.2211 CCOC(=O)CS(=O)(=O)NCCC(C)C WXVL_AK0068HU0462 [0,2,0,0,0,0|2,0,0]=4 361 B14R0.2211 CCOC(=O)CS(=O)(=O)NCCC(C)C WXVL_AK0068HU0462 [0,2,0,0,0,0|2,0,0]=4 362 B14R0.656 CCCCNC(=O)C(C)(C)C(=O)OCC WXVL_AK00588SB2306 [0,2,0,0,0,0|1,0,0]=3 363 B14R0.656 CCCCNC(=O)C(C)(C)C(=O)OCC WXVL_AK00588SB2306 [0,2,0,0,0,0|1,0,0]=3 364 B14R0.656 CCOC(=O)C(C)(C)C(=O)NCCCO WXVL_AK0073SB2306 [0,2,0,0,0,0|2,0,0]=4 365 B14R0.656 CCOC(=O)C(C)(C)C(=O)NCCCO WXVL_AK0073SB2306 [0,2,0,0,0,0|2,0,0]=4 366 B14R0.656 CCOC(=O)C(C)(C)C(=O)NCCSC WXVL_AK00440SB2306 [0,2,0,0,0,0|2,0,0]=4 367 B14R0.656 CCOC(=O)C(C)(C)C(=O)NCCSC WXVL_AK00440SB2306 [0,2,0,0,0,0|2,0,0]=4 368 B14R0.425 CCOC(=O)CC(=O)NCC(C)(C)CO WXVL_AK0104SB3094 [0,2,0,0,0,0|2,0,0]=4 369 B14R0.425 CCOC(=O)CC(=O)NCC(C)(C)CO WXVL_AK0104SB3094 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.32 CCNC(=O)CC1CCCCO1 WXVL_AK00476SB1464 [1,0,0,1,0,0|1,0,1]=4 371 B12R1.32 CCNC(=O)CC1CCCCO1 WXVL_AK00476SB1464 [1,0,0,1,0,0|1,0,1]=4 372 B12R1.521 CCOC(=O)CC(=O)NC1CC1 WXVL_AK0001SB3094 [1,0,0,1,0,0|1,0,0]=3 373 B12R1.521 CCOC(=O)CC(=O)NC1CC1 WXVL_AK0001SB3094 [1,0,0,1,0,0|1,0,0]=3 374 B12R1.35 CC/C=C/CC(=O)N1CCCC1 WXVL_AN0008SB0349 [1,0,0,1,0,0|2,0,0]=4 375 B12R1.35 CC/C=C/CC(=O)N1CCCC1 WXVL_AN0008SB0349 [1,0,0,1,0,0|2,0,0]=4 376 B12R1.35 CCO/C=C/C(=O)N1CCCC1 WXVL_AN0008SB3226 [1,0,0,1,0,0|1,0,1]=4 377 B12R1.35 CCO/C=C/C(=O)N1CCCC1 WXVL_AN0008SB3226 [1,0,0,1,0,0|1,0,1]=4 378 B12R1.15 COC(=O)CC(=O)N1CCCC1 WXVL_AN0008SB2790 [1,0,0,1,0,0|1,0,0]=3 379 B12R1.15 COC(=O)CC(=O)N1CCCC1 WXVL_AN0008SB2790 [1,0,0,1,0,0|1,0,0]=3 380 B12R1.304 COC(=O)CC(=O)NC1CNC1 WXVL_AK1291SB2790 [1,0,0,1,0,0|2,0,0]=4 381 B12R1.304 COC(=O)CC(=O)NC1CNC1 WXVL_AK1291SB2790 [1,0,0,1,0,0|2,0,0]=4 382 B12R1.304 COC(=O)CC(=O)NC1CSC1 WXVL_AK2089SB2790 [1,0,0,1,0,0|2,0,0]=4 383 B12R1.304 COC(=O)CC(=O)NC1CSC1 WXVL_AK2089SB2790 [1,0,0,1,0,0|2,0,0]=4 384 B12R1.55 CCOC(=O)C(=O)N1CCCC1 WXVL_AN0008SB4144 [0,0,0,1,1,0|1,0,0]=3 385 B12R1.55 CCOC(=O)C(=O)N1CCCC1 WXVL_AN0008SB4144 [0,0,0,1,1,0|1,0,0]=3 386 B12R1.555 CCOC(=O)C(=O)NC1CNC1 WXVL_AK1291SB4144 [0,0,0,1,1,0|2,0,0]=4 387 B12R1.555 CCOC(=O)C(=O)NC1CNC1 WXVL_AK1291SB4144 [0,0,0,1,1,0|2,0,0]=4 388 B12R1.555 CCOC(=O)C(=O)NC1CSC1 WXVL_AK2089SB4144 [0,0,0,1,1,0|2,0,0]=4 389 B12R1.555 CCOC(=O)C(=O)NC1CSC1 WXVL_AK2089SB4144 [0,0,0,1,1,0|2,0,0]=4 390 B12R1.689 CCCCNC(=O)C(=O)C1CC1 WXVL_AK00588SB3659 [0,0,0,1,1,0|2,0,0]=4 391 B12R1.689 CCCCNC(=O)C(=O)C1CC1 WXVL_AK00588SB3659 [0,0,0,1,1,0|2,0,0]=4 392 B14R1.20 CCCCNC(=O)C1CCNC(=O)C1 WXVL_AK00588SB2983 [0,0,0,1,0,1|2,0,0]=4 393 B14R1.20 CCCCNC(=O)C1CCNC(=O)C1 WXVL_AK00588SB2983 [0,0,0,1,0,1|2,0,0]=4 394 B14R1.20 O=C1CN(CCO1)C(=O)CCCCBr WXVL_AN4960SB3153 [0,0,0,1,0,1|2,0,0]=4 395 B14R1.20 O=C1CN(CCO1)C(=O)CCCCCl WXVL_AN4960SB0379 [0,0,0,1,0,1|2,0,0]=4 396 B14R1.20 O=C1CN(CCO1)C(=O)NCCCCl WXVL_AN4960YV0130 [0,0,0,1,0,1|2,0,0]=4 397 B14R1.100 CCCC(=O)NCC(=O)N1CCCC1 WXVL_AK00165SB0073 [0,0,0,1,0,1|2,0,0]=4 398 B14R1.100 CCCC(=O)NCC(=O)N1CCCC1 WXVL_AK00165SB0073 [0,0,0,1,0,1|2,0,0]=4 399 B14R1.100 CCNC(=O)CCC(=O)N1CCCC1 WXVL_AK00476SB1507 [0,0,0,1,0,1|2,0,0]=4 400 B14R1.100 CCNC(=O)CCC(=O)N1CCCC1 WXVL_AK00476SB1507 [0,0,0,1,0,1|2,0,0]=4 401 B14R1.100 CCOC(=O)/C=C/C(=O)N1CCCC1 WXVL_AN0008SB0061 [0,0,0,1,0,1|1,0,1]=4 402 B14R1.100 CCOC(=O)/C=C/C(=O)N1CCCC1 WXVL_AN0008SB0061 [0,0,0,1,0,1|1,0,1]=4 403 B14R1.100 CCOC(=O)CNC(=O)N1CCCC1 WXVL_AN0008YV0151 [0,0,0,1,0,1|1,0,0]=3 404 B14R1.100 CCOC(=O)CNC(=O)N1CCCC1 WXVL_AN0008YV0151 [0,0,0,1,0,1|1,0,0]=3 405 B14R1.1047 CCCCNC(=O)CN1CCCC1=O WXVL_AK00588SB0190 [0,0,0,1,0,1|2,0,0]=4 406 B14R1.1047 CCCCNC(=O)CN1CCCC1=O WXVL_AK00588SB0190 [0,0,0,1,0,1|2,0,0]=4 407 B14R1.1047 CCCCNC(=O)CN1CCOC1=O WXVL_AK00588SB8467 [0,0,0,1,0,1|1,0,0]=3 408 B14R1.1047 CCCCNC(=O)CN1CCOC1=O WXVL_AK00588SB8467 [0,0,0,1,0,1|1,0,0]=3 409 B14R1.1047 CSCCNC(=O)CN1CCOC1=O WXVL_AK00440SB8467 [0,0,0,1,0,1|2,0,0]=4 410 B14R1.1047 CSCCNC(=O)CN1CCOC1=O WXVL_AK00440SB8467 [0,0,0,1,0,1|2,0,0]=4 411 B14R1.1047 O=C(CN1CCOC1=O)NCCCO WXVL_AK0073SB8467 [0,0,0,1,0,1|2,0,0]=4 412 B14R1.1047 O=C(CN1CCOC1=O)NCCCO WXVL_AK0073SB8467 [0,0,0,1,0,1|2,0,0]=4 413 B14R1.1423 CCCCNC(=O)CNC(=O)C1CC1 WXVL_AK00588SBA651 [0,0,0,1,0,1|2,0,0]=4 414 B14R1.1423 CCCCNC(=O)CNC(=O)C1CC1 WXVL_AK00588SBA651 [0,0,0,1,0,1|2,0,0]=4 415 B14R1.3709 CCOC(=O)CNC(=O)NC1CNC1 WXVL_AK1291YV0151 [0,0,0,1,0,1|2,0,0]=4 416 B14R1.3709 CCOC(=O)CNC(=O)NC1CNC1 WXVL_AK1291YV0151 [0,0,0,1,0,1|2,0,0]=4 417 B14R1.3709 CCOC(=O)CNC(=O)NC1CSC1 WXVL_AK2089YV0151 [0,0,0,1,0,1|2,0,0]=4 418 B14R1.3709 CCOC(=O)CNC(=O)NC1CSC1 WXVL_AK2089YV0151 [0,0,0,1,0,1|2,0,0]=4 419 B14R1.28 CCOC(=O)CC(=O)N1CCC(C1)Br WXVL_AN00715SB3094 [0,1,0,1,0,0|1,0,0]=3 420 B14R1.28 CCOC(=O)CC(=O)N1CCC(C1)C WXVL_AN0556SB3094 [0,1,0,1,0,0|1,0,0]=3 421 B14R1.28 CCOC(=O)CC(=O)N1CCC(C1)C WXVL_AN0556SB3094 [0,1,0,1,0,0|1,0,0]=3 422 B14R1.28 CCOC(=O)CC(=O)N1CCC(C1)F WXVL_AN00338SB3094 [0,1,0,1,0,0|1,0,0]=3 423 B14R1.28 CCOC(=O)CC(=O)N1CCC(C1)F WXVL_AN00338SB3094 [0,1,0,1,0,0|1,0,0]=3 424 B14R1.28 CCOC(=O)CC(=O)N1CCC(C1)O WXVL_AN0158SB3094 [0,1,0,1,0,0|1,0,0]=3 425 B14R1.28 CCOC(=O)CC(=O)N1CCC(C1)O WXVL_AN0158SB3094 [0,1,0,1,0,0|1,0,0]=3 426 B14R1.28 CCOC(=O)CC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB3094 [0,1,0,1,0,0|1,0,0]=3 427 B14R1.28 CCOC(=O)CC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB3094 [0,1,0,1,0,0|1,0,0]=3 428 B14R1.28 CCOC(=O)CC(=O)N1CC[C@@H](C1)O WXVL_AN00391SB3094 [0,1,0,1,0,0|1,0,0]=3 429 B14R1.28 CCOC(=O)CC(=O)N1CC[C@@H](C1)O WXVL_AN00391SB3094 [0,1,0,1,0,0|1,0,0]=3 430 B14R1.28 CCOC(=O)CC(=O)N1CC[C@H](C1)C WXVL_AN00488SB3094 [0,1,0,1,0,0|1,0,0]=3 431 B14R1.28 CCOC(=O)CC(=O)N1CC[C@H](C1)C WXVL_AN00488SB3094 [0,1,0,1,0,0|1,0,0]=3 432 B14R1.28 CCOC(=O)CC(=O)N1CC[C@H](C1)F WXVL_AN00035SB3094 [0,1,0,1,0,0|1,0,0]=3 433 B14R1.28 CCOC(=O)CC(=O)N1CC[C@H](C1)F WXVL_AN00035SB3094 [0,1,0,1,0,0|1,0,0]=3 434 B14R1.28 CCOC(=O)CC(=O)N1CC[C@H](C1)O WXVL_AN00543SB3094 [0,1,0,1,0,0|1,0,0]=3 435 B14R1.29 CCOC(=O)CC(=O)N1CCOCC1 WXVL_AN00478SB3094 [0,1,0,1,0,0|1,0,0]=3 436 B14R1.29 CCOC(=O)CC(=O)N1CCOCC1 WXVL_AN00478SB3094 [0,1,0,1,0,0|1,0,0]=3 437 B14R1.29 CCOC(=O)CC(=O)N1CCSCC1 WXVL_AN0896SB3094 [0,1,0,1,0,0|1,0,0]=3 438 B14R1.2627 CCOC(=O)CC(=O)NC(C)C1CC1 WXVL_AK00200SB3094 [0,1,0,1,0,0|1,0,0]=3 439 B14R1.2627 CCOC(=O)CC(=O)NC(C)C1CC1 WXVL_AK00200SB3094 [0,1,0,1,0,0|1,0,0]=3 440 B14R1.2627 CCOC(=O)CC(=O)N[C@@H](C)C1CC1 WXVL_AK0484SB3094 [0,1,0,1,0,0|1,0,0]=3 441 B14R1.2627 CCOC(=O)CC(=O)N[C@@H](C)C1CC1 WXVL_AK0484SB3094 [0,1,0,1,0,0|1,0,0]=3 442 B14R1.3242 CCOC(=O)CC(=O)N1CCC[C@H]1C WXVL_AN00593SB3094 [0,1,0,1,0,0|1,0,0]=3 443 B14R1.3244 CCOC(=O)CC(=O)NC1CC(C1)C WXVL_AK0309SB3094 [0,1,0,1,0,0|1,0,0]=3 444 B14R1.3244 CCOC(=O)CC(=O)NC1CC(C1)C WXVL_AK0309SB3094 [0,1,0,1,0,0|1,0,0]=3 445 B14R1.3244 CCOC(=O)CC(=O)NC1CC(C1)F WXVL_AK0307SB3094 [0,1,0,1,0,0|1,0,0]=3 446 B14R1.3244 CCOC(=O)CC(=O)NC1CC(C1)F WXVL_AK0307SB3094 [0,1,0,1,0,0|1,0,0]=3 447 B14R1.3244 CCOC(=O)CC(=O)NC1CC(C1)O WXVL_AK0306SB3094 [0,1,0,1,0,0|1,0,0]=3 448 B14R1.3244 CCOC(=O)CC(=O)NC1CC(C1)O WXVL_AK0306SB3094 [0,1,0,1,0,0|1,0,0]=3 449 B14R1.3244 CCOC(=O)CC(=O)NC1CN(C1)C WXVL_AK1377SB3094 [0,1,0,1,0,0|2,0,0]=4 450 B14R1.3244 CCOC(=O)CC(=O)NC1CN(C1)C WXVL_AK1377SB3094 [0,1,0,1,0,0|2,0,0]=4 451 B14R1.3244 CCOC(=O)CC(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB3094 [0,1,0,1,0,0|1,0,0]=3 452 B14R1.3244 CCOC(=O)CC(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB3094 [0,1,0,1,0,0|1,0,0]=3 453 B14R1.3243 CCOC(=O)CC(=O)N1CC[C@@H]1CO WXVL_AN00694SB3094 [0,1,0,1,0,0|1,0,0]=3 454 B14R1.3243 CCOC(=O)CC(=O)N1CC[C@H]1CO WXVL_AN3414SB3094 [0,1,0,1,0,0|1,0,0]=3 455 B14R1.3243 CCOC(=O)CC(=O)N1CC[C@H]1CO WXVL_AN3414SB3094 [0,1,0,1,0,0|1,0,0]=3 456 B14R1.7237 CCOC(=O)CC(=O)NCC1CCC1 WXVL_AK00492SB3094 [0,1,0,1,0,0|1,0,0]=3 457 B14R1.7237 CCOC(=O)CC(=O)NCC1CCC1 WXVL_AK00492SB3094 [0,1,0,1,0,0|1,0,0]=3 458 B14R1.7237 CCOC(=O)CC(=O)NCC1CCO1 WXVL_AK1433SB3094 [0,1,0,1,0,0|1,0,0]=3 459 B14R1.7237 CCOC(=O)CC(=O)NCC1CCO1 WXVL_AK1433SB3094 [0,1,0,1,0,0|1,0,0]=3 460 B14R1.7237 CCOC(=O)CC(=O)NCC1COC1 WXVL_AK0186SB3094 [0,1,0,1,0,0|1,0,0]=3 461 B14R1.7237 CCOC(=O)CC(=O)NCC1COC1 WXVL_AK0186SB3094 [0,1,0,1,0,0|1,0,0]=3 462 B14R1.7238 CCOC(=O)CC(=O)NCCC1CC1 WXVL_AK00594SB3094 [0,1,0,1,0,0|1,0,0]=3 463 B14R1.7238 CCOC(=O)CC(=O)NCCC1CC1 WXVL_AK00594SB3094 [0,1,0,1,0,0|1,0,0]=3 464 B14R1.10097 CCOC(=O)CC(=O)NC1CC1(F)F WXVL_AK0397SB3094 [0,1,0,1,0,0|2,0,0]=4 465 B14R1.10097 CCOC(=O)CC(=O)NC1CC1(F)F WXVL_AK0397SB3094 [0,1,0,1,0,0|2,0,0]=4 466 B14R1.620 CCOC(=O)CS(=O)(=O)N1CCCC1 WXVL_AN0008HU0462 [0,1,0,1,0,0|2,0,0]=4 467 B14R1.620 CCOC(=O)CS(=O)(=O)N1CCCC1 WXVL_AN0008HU0462 [0,1,0,1,0,0|2,0,0]=4 468 B14R1.2691 CCOC(=O)CC(=O)NCC1(CC1)C WXVL_AK00811SB3094 [0,1,0,1,0,0|1,0,0]=3 469 B14R1.2691 CCOC(=O)CC(=O)NCC1(CC1)C WXVL_AK00811SB3094 [0,1,0,1,0,0|1,0,0]=3 470 B14R1.2691 CCOC(=O)CC(=O)NCC1(CC1)O WXVL_AK0301SB3094 [0,1,0,1,0,0|1,0,0]=3 471 B14R1.2691 CCOC(=O)CC(=O)NCC1(CC1)O WXVL_AK0301SB3094 [0,1,0,1,0,0|1,0,0]=3 472 B10R0.19 CCCNC(=O)C(=O)OCC WXVL_AK00504SB4144 [1,0,0,0,1,0|1,0,0]=3 473 B10R0.19 CCCNC(=O)C(=O)OCC WXVL_AK00504SB4144 [1,0,0,0,1,0|1,0,0]=3 474 B10R0.19 CCOC(=O)C(=O)NCCF WXVL_AK00466SB4144 [1,0,0,0,1,0|2,0,0]=4 475 B10R0.19 CCOC(=O)C(=O)NCCF WXVL_AK00466SB4144 [1,0,0,0,1,0|2,0,0]=4 476 B10R0.83 CCC(=O)C(=O)NCCCO WXVL_AK0073SB0344 [1,0,0,0,1,0|2,0,0]=4 477 B10R0.83 CCC(=O)C(=O)NCCCO WXVL_AK0073SB0344 [1,0,0,0,1,0|2,0,0]=4 478 B10R0.83 CCC(=O)C(=O)NCCSC WXVL_AK00440SB0344 [1,0,0,0,1,0|2,0,0]=4 479 B10R0.83 CCC(=O)C(=O)NCCSC WXVL_AK00440SB0344 [1,0,0,0,1,0|2,0,0]=4 480 B10R0.83 CCCCNC(=O)C(=O)CC WXVL_AK00588SB0344 [1,0,0,0,1,0|1,0,0]=3 481 B10R0.83 CCCCNC(=O)C(=O)CC WXVL_AK00588SB0344 [1,0,0,0,1,0|1,0,0]=3 482 B14R0.2432 CCOC(=O)CCNC(=O)CCCCBr WXVL_AK0465SB3153 [0,0,0,0,0,2|2,0,0]=4 483 B14R0.2432 CCOC(=O)CCNC(=O)CCCCBr WXVL_AK0465SB3153 [0,0,0,0,0,2|2,0,0]=4 484 B14R0.2432 CCOC(=O)CCNC(=O)CCCCCl WXVL_AK0465SB0379 [0,0,0,0,0,2|2,0,0]=4 485 B14R0.2432 CCOC(=O)CCNC(=O)CCCCCl WXVL_AK0465SB0379 [0,0,0,0,0,2|2,0,0]=4 486 B14R0.2432 CCOC(=O)CCNC(=O)NCCCCl WXVL_AK0465YV0130 [0,0,0,0,0,2|2,0,0]=4 487 B14R0.2432 CCOC(=O)CCNC(=O)NCCCCl WXVL_AK0465YV0130 [0,0,0,0,0,2|2,0,0]=4