0 B12R0.1 CCCCCCCCC(=O)NCC WXVL_AK00476SB0409 [0,1,0,0,0,0|2,0,0]=3 1 B12R0.1 CCCCCCCCC(=O)NCC WXVL_AK00476SB0409 [0,1,0,0,0,0|2,0,0]=3 2 B12R0.1 CCNC(=O)CCCCCCCBr WXVL_AK00476SB0559 [0,1,0,0,0,0|3,0,0]=4 3 B12R0.1 CCNC(=O)CCCCCCCBr WXVL_AK00476SB0559 [0,1,0,0,0,0|3,0,0]=4 4 B12R0.1 CCNC(=O)CCCCCCCO WXVL_AK00476SB1306 [0,1,0,0,0,0|3,0,0]=4 5 B12R0.1 CCNC(=O)CCCCCCCO WXVL_AK00476SB1306 [0,1,0,0,0,0|3,0,0]=4 6 B12R0.47 CC/C=C/CC(=O)NCCCCC WXVL_AK0076SB0349 [0,1,0,0,0,0|2,0,1]=4 7 B12R0.47 CC/C=C/CC(=O)NCCCCC WXVL_AK0076SB0349 [0,1,0,0,0,0|2,0,1]=4 8 B12R0.206 CCCCCCNC(=O)/C=C/CBr WXVL_AK0286SB0424 [0,1,0,0,0,0|2,0,1]=4 9 B12R0.206 CCCCCCNC(=O)/C=C/CBr WXVL_AK0286SB0424 [0,1,0,0,0,0|2,0,1]=4 10 B12R0.248 C#CC(=O)NCCCCCCCC WXVL_AK1818SB0338 [0,1,0,0,0,0|2,0,1]=4 11 B12R0.248 C#CC(=O)NCCCCCCCC WXVL_AK1818SB0338 [0,1,0,0,0,0|2,0,1]=4 12 B12R0.248 CCCCCCCCCC(=O)NC WXVL_AK00442SB0447 [0,1,0,0,0,0|2,0,1]=4 13 B12R0.248 CCCCCCCCCC(=O)NC WXVL_AK00442SB0447 [0,1,0,0,0,0|2,0,1]=4 14 B12R0.248 CCCCCCCCNC(=O)CC WXVL_AK1818SB0064 [0,1,0,0,0,0|2,0,0]=3 15 B12R0.248 CCCCCCCCNC(=O)CC WXVL_AK1818SB0064 [0,1,0,0,0,0|2,0,0]=3 16 B12R0.248 CCCCCCCCNC(=O)CO WXVL_AK1818SB2706 [0,1,0,0,0,0|1,0,0]=2 17 B12R0.248 CCCCCCCCNC(=O)CO WXVL_AK1818SB2706 [0,1,0,0,0,0|1,0,0]=2 18 B12R0.248 CCCCCCCCNC(=O)NC WXVL_AK00442YV0182 [0,1,0,0,0,0|3,0,0]=4 19 B12R0.248 CCCCCCCCNC(=O)NC WXVL_AK00442YV0182 [0,1,0,0,0,0|3,0,0]=4 20 B12R0.248 CCCCOCCCNC(=O)CC WXVL_AK2310SB0064 [0,1,0,0,0,0|3,0,0]=4 21 B12R0.248 CCCCOCCCNC(=O)CC WXVL_AK2310SB0064 [0,1,0,0,0,0|3,0,0]=4 22 B12R0.248 CCCCOCCCNC(=O)CO WXVL_AK2310SB2706 [0,1,0,0,0,0|2,0,0]=3 23 B12R0.248 CCCCOCCCNC(=O)CO WXVL_AK2310SB2706 [0,1,0,0,0,0|2,0,0]=3 24 B11R0.4 C/C=C/C(=O)NCCCCCC WXVL_AK0286SB0340 [1,1,0,0,0,0|1,0,1]=4 25 B11R0.4 C/C=C/C(=O)NCCCCCC WXVL_AK0286SB0340 [1,1,0,0,0,0|1,0,1]=4 26 B11R0.4 CCCCCCCC(=O)NCC WXVL_AK00476SB0393 [1,1,0,0,0,0|2,0,0]=4 27 B11R0.4 CCCCCCCC(=O)NCC WXVL_AK00476SB0393 [1,1,0,0,0,0|2,0,0]=4 28 B11R0.40 CCCCCCCCC(=O)NC WXVL_AK00442SB0409 [1,1,0,0,0,0|1,0,0]=3 29 B11R0.40 CCCCCCCCC(=O)NC WXVL_AK00442SB0409 [1,1,0,0,0,0|1,0,0]=3 30 B11R0.40 CCCCOCCNC(=O)CO WXVL_AK9674SB2706 [1,1,0,0,0,0|2,0,0]=4 31 B11R0.40 CCCCOCCNC(=O)CO WXVL_AK9674SB2706 [1,1,0,0,0,0|2,0,0]=4 32 B11R0.40 CNC(=O)CCCCCCCBr WXVL_AK00442SB0559 [1,1,0,0,0,0|2,0,0]=4 33 B11R0.40 CNC(=O)CCCCCCCBr WXVL_AK00442SB0559 [1,1,0,0,0,0|2,0,0]=4 34 B11R0.40 CNC(=O)CCCCCCCO WXVL_AK00442SB1306 [1,1,0,0,0,0|2,0,0]=4 35 B11R0.40 CNC(=O)CCCCCCCO WXVL_AK00442SB1306 [1,1,0,0,0,0|2,0,0]=4 36 B11R0.40 O=C(CO)NCCCCCCO WXVL_AK0751SB2706 [1,1,0,0,0,0|2,0,0]=4 37 B11R0.40 O=C(CO)NCCCCCCO WXVL_AK0751SB2706 [1,1,0,0,0,0|2,0,0]=4 38 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [1,1,0,0,0,0|0,0,2]=4 39 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [1,1,0,0,0,0|0,0,2]=4 40 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [1,1,0,0,0,0|1,0,0]=3 41 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [1,1,0,0,0,0|1,0,0]=3 42 B11R0.148 CCCCOCCCNC(=O)C WXVL_AK2310SB0150 [1,1,0,0,0,0|2,0,0]=4 43 B11R0.148 CCCCOCCCNC(=O)C WXVL_AK2310SB0150 [1,1,0,0,0,0|2,0,0]=4 44 B13R0.2 C#CCC(=O)NCCCCCCCC WXVL_AK1818SB3070 [0,2,0,0,0,0|2,0,0]=4 45 B13R0.2 C#CCC(=O)NCCCCCCCC WXVL_AK1818SB3070 [0,2,0,0,0,0|2,0,0]=4 46 B13R0.2 C/C=C/C(=O)NCCCCCCCC WXVL_AK1818SB0340 [0,2,0,0,0,0|1,0,1]=4 47 B13R0.2 C/C=C/C(=O)NCCCCCCCC WXVL_AK1818SB0340 [0,2,0,0,0,0|1,0,1]=4 48 B13R0.2 C=CCC(=O)NCCCCCCCC WXVL_AK1818SB2732 [0,2,0,0,0,0|2,0,0]=4 49 B13R0.2 C=CCC(=O)NCCCCCCCC WXVL_AK1818SB2732 [0,2,0,0,0,0|2,0,0]=4 50 B13R0.2 CCCCCCCCCC(=O)NCC WXVL_AK00476SB0447 [0,2,0,0,0,0|1,0,1]=4 51 B13R0.2 CCCCCCCCCC(=O)NCC WXVL_AK00476SB0447 [0,2,0,0,0,0|1,0,1]=4 52 B13R0.2 CCCCCCCCNC(=O)CC#N WXVL_AK1818SB0057 [0,2,0,0,0,0|2,0,0]=4 53 B13R0.2 CCCCCCCCNC(=O)CC#N WXVL_AK1818SB0057 [0,2,0,0,0,0|2,0,0]=4 54 B13R0.2 CCCCCCCCNC(=O)CCC WXVL_AK1818SB0073 [0,2,0,0,0,0|1,0,1]=4 55 B13R0.2 CCCCCCCCNC(=O)CCC WXVL_AK1818SB0073 [0,2,0,0,0,0|1,0,1]=4 56 B13R0.2 CCCCCCCCNC(=O)COC WXVL_AK1818SB0090 [0,2,0,0,0,0|1,0,0]=3 57 B13R0.2 CCCCCCCCNC(=O)COC WXVL_AK1818SB0090 [0,2,0,0,0,0|1,0,0]=3 58 B13R0.2 CCCCCCCCNC(=O)CSC WXVL_AK1818SB1267 [0,2,0,0,0,0|1,1,0]=4 59 B13R0.2 CCCCCCCCNC(=O)CSC WXVL_AK1818SB1267 [0,2,0,0,0,0|1,1,0]=4 60 B13R0.2 CCCCCCCCNC(=O)NCC WXVL_AK00476YV0182 [0,2,0,0,0,0|2,0,0]=4 61 B13R0.2 CCCCCCCCNC(=O)NCC WXVL_AK00476YV0182 [0,2,0,0,0,0|2,0,0]=4 62 B13R0.2 CCCCOCCCNC(=O)COC WXVL_AK2310SB0090 [0,2,0,0,0,0|2,0,0]=4 63 B13R0.2 CCCCOCCCNC(=O)COC WXVL_AK2310SB0090 [0,2,0,0,0,0|2,0,0]=4 64 B13R0.66 C=CCNC(=O)CCCCCCCC WXVL_AK00561SB0409 [0,2,0,0,0,0|2,0,0]=4 65 B13R0.66 C=CCNC(=O)CCCCCCCC WXVL_AK00561SB0409 [0,2,0,0,0,0|2,0,0]=4 66 B13R0.66 CCCCCCCCC(=O)NCC#N WXVL_AK0683SB0409 [0,2,0,0,0,0|2,0,0]=4 67 B13R0.66 CCCCCCCCC(=O)NCC#N WXVL_AK0683SB0409 [0,2,0,0,0,0|2,0,0]=4 68 B13R0.66 CCCCCCCCC(=O)NCCC WXVL_AK00504SB0409 [0,2,0,0,0,0|1,0,1]=4 69 B13R0.66 CCCCCCCCC(=O)NCCC WXVL_AK00504SB0409 [0,2,0,0,0,0|1,0,1]=4 70 B13R0.66 CCCCCCCCC(=O)NCCF WXVL_AK00466SB0409 [0,2,0,0,0,0|1,0,1]=4 71 B13R0.66 CCCCCCCCC(=O)NCCF WXVL_AK00466SB0409 [0,2,0,0,0,0|1,0,1]=4 72 B13R0.335 CCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0409 [0,2,0,0,0,0|2,0,0]=4 73 B13R0.335 CCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0409 [0,2,0,0,0,0|2,0,0]=4 74 B13R0.147 CCC(=O)NCCCCCCCCO WXVL_AK4142SB0064 [0,2,0,0,0,0|2,0,0]=4 75 B13R0.147 CCC(=O)NCCCCCCCCO WXVL_AK4142SB0064 [0,2,0,0,0,0|2,0,0]=4 76 B13R0.147 CCCCCCCCCNC(=O)CC WXVL_AK1826SB0064 [0,2,0,0,0,0|1,0,1]=4 77 B13R0.147 CCCCCCCCCNC(=O)CC WXVL_AK1826SB0064 [0,2,0,0,0,0|1,0,1]=4 78 B13R0.147 CCCCCCCCCNC(=O)CO WXVL_AK1826SB2706 [0,2,0,0,0,0|0,0,1]=3 79 B13R0.147 CCCCCCCCCNC(=O)CO WXVL_AK1826SB2706 [0,2,0,0,0,0|0,0,1]=3 80 B13R0.147 O=C(CO)NCCCCCCCCO WXVL_AK4142SB2706 [0,2,0,0,0,0|1,0,0]=3 81 B13R0.147 O=C(CO)NCCCCCCCCO WXVL_AK4142SB2706 [0,2,0,0,0,0|1,0,0]=3 82 B13R0.338 CC/C=C/CC(=O)NCCCCCC WXVL_AK0286SB0349 [0,2,0,0,0,0|1,0,1]=4 83 B13R0.338 CC/C=C/CC(=O)NCCCCCC WXVL_AK0286SB0349 [0,2,0,0,0,0|1,0,1]=4 84 B13R0.150 CCCCCCCCNC(=O)C(C)C WXVL_AK1818SB0052 [0,2,0,0,0,0|2,0,0]=4 85 B13R0.150 CCCCCCCCNC(=O)C(C)C WXVL_AK1818SB0052 [0,2,0,0,0,0|2,0,0]=4 86 B13R0.150 CCCCCCCCNC(=O)C(C)S WXVL_AK1818SB2708 [0,2,0,0,0,0|1,1,0]=4 87 B13R0.150 CCCCCCCCNC(=O)C(C)S WXVL_AK1818SB2708 [0,2,0,0,0,0|1,1,0]=4 88 B13R0.150 CCCCCCCCNC(=O)C(F)F WXVL_AK1818SB0079 [0,2,0,0,0,0|2,0,0]=4 89 B13R0.150 CCCCCCCCNC(=O)C(F)F WXVL_AK1818SB0079 [0,2,0,0,0,0|2,0,0]=4 90 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1818SB1085 [0,2,0,0,0,0|1,0,0]=3 91 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1818SB1085 [0,2,0,0,0,0|1,0,0]=3 92 B13R0.150 CCCCOCCCNC(=O)[C@@H](C)O WXVL_AK2310SB1085 [0,2,0,0,0,0|2,0,0]=4 93 B13R0.150 CCCCOCCCNC(=O)[C@@H](C)O WXVL_AK2310SB1085 [0,2,0,0,0,0|2,0,0]=4 94 B13R1.42 CCNC(=O)CCC1CCCCC1 WXVL_AK00476SB0049 [0,1,0,1,0,0|2,0,0]=4 95 B13R1.42 CCNC(=O)CCC1CCCCC1 WXVL_AK00476SB0049 [0,1,0,1,0,0|2,0,0]=4 96 B13R1.382 COCC1CCCCN1C(=O)CO WXVL_AN0507SB2706 [0,1,0,1,0,0|2,0,0]=4 97 B13R1.382 COCC1CCCCN1C(=O)CO WXVL_AN0507SB2706 [0,1,0,1,0,0|2,0,0]=4 98 B13R1.382 O=C(CO)N1CCCCC1CCO WXVL_AN2918SB2706 [0,1,0,1,0,0|2,0,0]=4 99 B13R1.382 O=C(CO)N1CCCC[C@@H]1CCO WXVL_AN00657SB2706 [0,1,0,1,0,0|2,0,0]=4 100 B13R1.536 O=C(CO)NCCCN1CCCC1 WXVL_AK0085SB2706 [0,1,0,1,0,0|2,0,0]=4 101 B13R1.536 O=C(CO)NCCCN1CCCC1 WXVL_AK0085SB2706 [0,1,0,1,0,0|2,0,0]=4 102 B13R1.536 O=C(CO)NCCOC1CCCC1 WXVL_AK3996SB2706 [0,1,0,1,0,0|2,0,0]=4 103 B13R1.536 O=C(CO)NCCOC1CCCC1 WXVL_AK3996SB2706 [0,1,0,1,0,0|2,0,0]=4 104 B13R1.581 CCCCC1CCCN1C(=O)CC WXVL_AN00739SB0064 [0,1,0,1,0,0|2,0,0]=4 105 B13R1.581 CCCCC1CCCN1C(=O)CO WXVL_AN00739SB2706 [0,1,0,1,0,0|1,0,0]=3 106 B13R1.599 CN1CCCC1CCNC(=O)CO WXVL_AK2343SB2706 [0,1,0,1,0,0|2,0,0]=4 107 B13R1.599 CN1CCCC1CCNC(=O)CO WXVL_AK2343SB2706 [0,1,0,1,0,0|2,0,0]=4 108 B13R1.718 CCC(=O)NCCC1CCCCC1 WXVL_AK1287SB0064 [0,1,0,1,0,0|2,0,0]=4 109 B13R1.718 CCC(=O)NCCC1CCCCC1 WXVL_AK1287SB0064 [0,1,0,1,0,0|2,0,0]=4 110 B13R1.718 O=C(CO)NCCC1CCCCC1 WXVL_AK1287SB2706 [0,1,0,1,0,0|1,0,0]=3 111 B13R1.718 O=C(CO)NCCC1CCCCC1 WXVL_AK1287SB2706 [0,1,0,1,0,0|1,0,0]=3 112 B13R1.718 O=C(CO)NCCC1CCOCC1 WXVL_AK0294SB2706 [0,1,0,1,0,0|2,0,0]=4 113 B13R1.718 O=C(CO)NCCC1CCOCC1 WXVL_AK0294SB2706 [0,1,0,1,0,0|2,0,0]=4 114 B13R1.718 O=C(CO)NCCN1CCCCC1 WXVL_AK0023SB2706 [0,1,0,1,0,0|2,0,0]=4 115 B13R1.718 O=C(CO)NCCN1CCCCC1 WXVL_AK0023SB2706 [0,1,0,1,0,0|2,0,0]=4