0 B12R1.308 C#CCC(=O)c1ccccc1Br 1458a_100000188424_100000184674 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.308 C#CCC(=O)c1ccccc1C 1458a_100000212026_100000184674 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.308 C#CCC(=O)c1ccccc1Cl 1458a_100000185844_100000184674 [0,0,0,0,0,0|2,0,2]=4 3 B12R1.308 C#CCC(=O)c1ccccc1F 1458a_100000188656_100000184674 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.308 C#CCC(=O)c1ccccc1I 1458a_100000187884_100000184674 [0,0,0,0,0,0|2,0,2]=4 5 B12R1.308 C#CCC(=O)c1ccccc1O 1458a_100015234032_100000184674 [0,0,0,0,0,0|1,0,2]=3 6 B12R1.308 C#CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000184674 [0,0,0,0,0,0|1,0,3]=4 7 B12R1.308 C=CCC(=O)c1ccccc1Br 1458a_100000188424_100000210623 [0,0,0,0,0,0|2,0,2]=4 8 B12R1.308 C=CCC(=O)c1ccccc1C 1458a_100000212026_100000210623 [0,0,0,0,0,0|2,0,2]=4 9 B12R1.308 C=CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210623 [0,0,0,0,0,0|2,0,2]=4 10 B12R1.308 C=CCC(=O)c1ccccc1F 1458a_100000188656_100000210623 [0,0,0,0,0,0|2,0,2]=4 11 B12R1.308 C=CCC(=O)c1ccccc1I 1458a_100000187884_100000210623 [0,0,0,0,0,0|2,0,2]=4 12 B12R1.308 C=CCC(=O)c1ccccc1O 1458a_100015234032_100000210623 [0,0,0,0,0,0|1,0,2]=3 13 B12R1.308 C=CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210623 [0,0,0,0,0,0|1,0,3]=4 14 B12R1.308 CC(OCF)c1ccccc1Br 34a_100000702211_100015361967 [0,0,0,0,0,0|3,0,1]=4 15 B12R1.308 CC(OCF)c1ccccc1Br 7a_100000702211_100015361967 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.308 CC(OCF)c1ccccc1Cl 34a_100000740796_100015361967 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.308 CC(OCF)c1ccccc1Cl 7a_100000740796_100015361967 [0,0,0,0,0,0|3,0,1]=4 18 B12R1.308 CC(OCF)c1ccccc1F 34a_100000697922_100015361967 [0,0,0,0,0,0|3,0,1]=4 19 B12R1.308 CC(OCF)c1ccccc1F 7a_100000697922_100015361967 [0,0,0,0,0,0|3,0,1]=4 20 B12R1.308 CC(OCF)c1ccccc1N 7a_100011405641_100015361967 [0,0,0,0,0,0|3,0,1]=4 21 B12R1.308 CCCC(=O)c1ccccc1Br 1458a_100000188424_100000210303 [0,0,0,0,0,0|2,0,0]=2 22 B12R1.308 CCCC(=O)c1ccccc1C 1458a_100000212026_100000210303 [0,0,0,0,0,0|2,0,0]=2 23 B12R1.308 CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210303 [0,0,0,0,0,0|2,0,0]=2 24 B12R1.308 CCCC(=O)c1ccccc1F 1458a_100000188656_100000210303 [0,0,0,0,0,0|2,0,0]=2 25 B12R1.308 CCCC(=O)c1ccccc1I 1458a_100000187884_100000210303 [0,0,0,0,0,0|2,0,0]=2 26 B12R1.308 CCCC(=O)c1ccccc1O 1458a_100015234032_100000210303 [0,0,0,0,0,0|1,0,0]=1 27 B12R1.308 CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210303 [0,0,0,0,0,0|1,0,1]=2 28 B12R1.308 CCCN(C)c1ccccc1Br 2230a_100020606079_100000210303 [0,0,0,0,0,0|4,0,0]=4 29 B12R1.308 CCCN(C)c1ccccc1Br 269982a_100020606079_100000210303 [0,0,0,0,0,0|4,0,0]=4 30 B12R1.308 CCCN(C)c1ccccc1Br 34a_100020606079_100000210303 [0,0,0,0,0,0|4,0,0]=4 31 B12R1.308 CCCN(C)c1ccccc1C 2230a_100000219699_100000210303 [0,0,0,0,0,0|4,0,0]=4 32 B12R1.308 CCCN(C)c1ccccc1C 269982a_100000219699_100000210303 [0,0,0,0,0,0|4,0,0]=4 33 B12R1.308 CCCN(C)c1ccccc1C 34a_100000219699_100000210303 [0,0,0,0,0,0|4,0,0]=4 34 B12R1.308 CCCN(C)c1ccccc1Cl 2230a_100000219374_100000210303 [0,0,0,0,0,0|4,0,0]=4 35 B12R1.308 CCCN(C)c1ccccc1Cl 269982a_100000219374_100000210303 [0,0,0,0,0,0|4,0,0]=4 36 B12R1.308 CCCN(C)c1ccccc1Cl 34a_100000219374_100000210303 [0,0,0,0,0,0|4,0,0]=4 37 B12R1.308 CCCN(C)c1ccccc1F 2230a_100000220357_100000210303 [0,0,0,0,0,0|4,0,0]=4 38 B12R1.308 CCCN(C)c1ccccc1F 2230a_100011231789_200000210301 [0,0,0,0,0,0|4,0,0]=4 39 B12R1.308 CCCN(C)c1ccccc1F 269982a_100000220357_100000210303 [0,0,0,0,0,0|4,0,0]=4 40 B12R1.308 CCCN(C)c1ccccc1F 269982a_100011231789_200000210301 [0,0,0,0,0,0|4,0,0]=4 41 B12R1.308 CCCN(C)c1ccccc1F 34a_100000220357_100000210303 [0,0,0,0,0,0|4,0,0]=4 42 B12R1.308 CCCN(C)c1ccccc1F 34a_100011231789_200000210301 [0,0,0,0,0,0|4,0,0]=4 43 B12R1.308 CCCN(C)c1ccccc1F 38a_100000220357_100000210303 [0,0,0,0,0,0|4,0,0]=4 44 B12R1.308 CCCN(C)c1ccccc1O 269982a_100000033821_100000210303 [0,0,0,0,0,0|3,0,0]=3 45 B12R1.308 CCCN([13CH3])c1ccccc1F 2230a_100011231789_200025704644 [0,0,0,0,0,0|4,0,0]=4 46 B12R1.308 CCCN([13CH3])c1ccccc1F 269982a_100011231789_200025704644 [0,0,0,0,0,0|4,0,0]=4 47 B12R1.308 CCCN([13CH3])c1ccccc1F 34a_100011231789_200025704644 [0,0,0,0,0,0|4,0,0]=4 48 B12R1.308 CCNC(=O)c1ccccc1Br 11a_100015525214_100000188424 [0,0,0,0,0,0|2,0,0]=2 49 B12R1.308 CCNC(=O)c1ccccc1Br 240690a_100015525214_100000188424 [0,0,0,0,0,0|2,0,0]=2 50 B12R1.308 CCNC(=O)c1ccccc1Br 527a_100015525214_100000188424 [0,0,0,0,0,0|2,0,0]=2 51 B12R1.308 CCNC(=O)c1ccccc1C 11a_100015525214_100000212026 [0,0,0,0,0,0|2,0,0]=2 52 B12R1.308 CCNC(=O)c1ccccc1C 240690a_100015525214_100000212026 [0,0,0,0,0,0|2,0,0]=2 53 B12R1.308 CCNC(=O)c1ccccc1C 527a_100015525214_100000212026 [0,0,0,0,0,0|2,0,0]=2 54 B12R1.308 CCNC(=O)c1ccccc1Cl 11a_100015525214_100000185844 [0,0,0,0,0,0|2,0,0]=2 55 B12R1.308 CCNC(=O)c1ccccc1Cl 240690a_100015525214_100000185844 [0,0,0,0,0,0|2,0,0]=2 56 B12R1.308 CCNC(=O)c1ccccc1Cl 527a_100015525214_100000185844 [0,0,0,0,0,0|2,0,0]=2 57 B12R1.308 CCNC(=O)c1ccccc1F 11a_100015525214_100000188656 [0,0,0,0,0,0|2,0,0]=2 58 B12R1.308 CCNC(=O)c1ccccc1F 240690a_100015525214_100000188656 [0,0,0,0,0,0|2,0,0]=2 59 B12R1.308 CCNC(=O)c1ccccc1F 527a_100015525214_100000188656 [0,0,0,0,0,0|2,0,0]=2 60 B12R1.308 CCNC(=O)c1ccccc1I 11a_100015525214_100000187884 [0,0,0,0,0,0|2,0,0]=2 61 B12R1.308 CCNC(=O)c1ccccc1I 240690a_100015525214_100000187884 [0,0,0,0,0,0|2,0,0]=2 62 B12R1.308 CCNC(=O)c1ccccc1I 527a_100015525214_100000187884 [0,0,0,0,0,0|2,0,0]=2 63 B12R1.308 CCNC(=O)c1ccccc1O 240690a_100015525214_100015234032 [0,0,0,0,0,0|1,0,0]=1 64 B12R1.308 CCNC(=O)c1ccccc1O 271570a_203496583355_200000155173 [0,0,0,0,0,0|1,0,0]=1 65 B12R1.308 CCNC(=O)c1ccccc1[O-] 240690a_100015525214_100009911694 [0,0,0,0,0,0|1,0,1]=2 66 B12R1.308 CCNC(=O)c1ccccc1[O-] 527a_100015525214_100009911694 [0,0,0,0,0,0|1,0,1]=2 67 B12R1.308 CCNC(=O)c1cccnc1O 271570a_203496583355_100000160120 [0,0,0,0,0,0|2,0,0]=2 68 B12R1.308 CCNC(C)c1ccccc1Br 2230a_100000181357_100000210202 [0,0,0,0,0,0|3,0,1]=4 69 B12R1.308 CCNC(C)c1ccccc1Br 269862a_100015525214_100000187085 [0,0,0,0,0,0|3,0,1]=4 70 B12R1.308 CCNC(C)c1ccccc1C 2230a_100000181355_100000210202 [0,0,0,0,0,0|3,0,1]=4 71 B12R1.308 CCNC(C)c1ccccc1C 269862a_100015525214_100000211656 [0,0,0,0,0,0|3,0,1]=4 72 B12R1.308 CCNC(C)c1ccccc1C 34a_100000181355_100000210202 [0,0,0,0,0,0|3,0,1]=4 73 B12R1.308 CCNC(C)c1ccccc1Cl 2230a_100000174978_100000210202 [0,0,0,0,0,0|3,0,1]=4 74 B12R1.308 CCNC(C)c1ccccc1Cl 2230a_100015525214_100000181259 [0,0,0,0,0,0|3,0,1]=4 75 B12R1.308 CCNC(C)c1ccccc1Cl 269862a_100015525214_100000210134 [0,0,0,0,0,0|3,0,1]=4 76 B12R1.308 CCNC(C)c1ccccc1Cl 34a_100000174978_100000210202 [0,0,0,0,0,0|3,0,1]=4 77 B12R1.308 CCNC(C)c1ccccc1F 2230a_100000181408_100000210202 [0,0,0,0,0,0|3,0,1]=4 78 B12R1.308 CCNC(C)c1ccccc1F 2230a_100015525214_200000741388 [0,0,0,0,0,0|3,0,1]=4 79 B12R1.308 CCNC(C)c1ccccc1F 269862a_100015525214_100000210632 [0,0,0,0,0,0|3,0,1]=4 80 B12R1.308 CCNC(C)c1ccccc1F 34a_100000181408_100000210202 [0,0,0,0,0,0|3,0,1]=4 81 B12R1.308 CCNC(C)c1ccccc1I 269862a_100015525214_100000751169 [0,0,0,0,0,0|3,0,1]=4 82 B12R1.308 CCNC(C)c1cccnc1O 2230a_100159269580_100000210202 [0,0,0,0,0,0|3,0,1]=4 83 B12R1.308 CCN[C@H](C)c1ccccc1O 2230a_100025703389_100000210202 [0,0,0,0,0,0|2,0,1]=3 84 B12R1.308 CCOC(=O)c1ccccc1O 271570a_203496583355_100000169879 [0,0,0,0,0,0|0,0,0]=0 85 B12R1.308 CCOC(=O)c1cccnc1O 271570a_203496583355_100000170124 [0,0,0,0,0,0|1,0,0]=1 86 B12R1.308 CCOC(=O)c1ccncc1O 271570a_203496583355_100010238393 [0,0,0,0,0,0|1,0,0]=1 87 B12R1.308 CCOC(=O)c1cnccc1O 271570a_203496583355_100016987518 [0,0,0,0,0,0|1,0,0]=1 88 B12R1.308 CCOC(=O)c1cncnc1O 271570a_203496583355_100011998183 [0,0,0,0,0,0|2,0,0]=2 89 B12R1.308 CCOC(=O)c1ncccc1O 271570a_203496583355_100012351660 [0,0,0,0,0,0|1,0,0]=1 90 B12R1.308 CCOC(=O)c1ncncc1O 271570a_203496583355_100012344254 [0,0,0,0,0,0|2,0,0]=2 91 B12R1.308 CCOC(C)c1ccccc1Br 34a_100000702211_100000210202 [0,0,0,0,0,0|2,0,1]=3 92 B12R1.308 CCOC(C)c1ccccc1Br 7a_100000702211_100000210202 [0,0,0,0,0,0|2,0,1]=3 93 B12R1.308 CCOC(C)c1ccccc1C 34a_100000742021_100000210202 [0,0,0,0,0,0|2,0,1]=3 94 B12R1.308 CCOC(C)c1ccccc1C 7a_100000742021_100000210202 [0,0,0,0,0,0|2,0,1]=3 95 B12R1.308 CCOC(C)c1ccccc1Cl 34a_100000740796_100000210202 [0,0,0,0,0,0|2,0,1]=3 96 B12R1.308 CCOC(C)c1ccccc1Cl 7a_100000740796_100000210202 [0,0,0,0,0,0|2,0,1]=3 97 B12R1.308 CCOC(C)c1ccccc1F 34a_100000697922_100000210202 [0,0,0,0,0,0|2,0,1]=3 98 B12R1.308 CCOC(C)c1ccccc1F 34a_100121572206_200000741388 [0,0,0,0,0,0|2,0,1]=3 99 B12R1.308 CCOC(C)c1ccccc1F 7a_100000697922_100000210202 [0,0,0,0,0,0|2,0,1]=3 100 B12R1.308 CCOC(C)c1ccccc1N 7a_100011405641_100000210202 [0,0,0,0,0,0|2,0,1]=3 101 B12R1.308 CCOC(C)c1cccnc1Cl 34a_100009865335_100000210202 [0,0,0,0,0,0|3,0,1]=4 102 B12R1.308 CCOC(C)c1cccnc1Cl 7a_100009865335_100000210202 [0,0,0,0,0,0|3,0,1]=4 103 B12R1.308 CCOC(C)c1ccncc1F 34a_100012180158_100000210202 [0,0,0,0,0,0|3,0,1]=4 104 B12R1.308 CCO[C@@H](C)c1ncccc1Br 7a_100013325542_100000210202 [0,0,0,0,0,0|3,0,1]=4 105 B12R1.308 CCSC(C)c1ccccc1Cl 62a_100000181259_100000210202 [0,0,0,0,0,0|2,1,1]=4 106 B12R1.308 CCSC(C)c1ccccc1Cl 62a_100000210202_100000181259 [0,0,0,0,0,0|2,1,1]=4 107 B12R1.308 CCSC(C)c1ccccc1F 62a_100000210202_200000741388 [0,0,0,0,0,0|2,1,1]=4 108 B12R1.308 CCSC(C)c1ccccc1F 62a_200000741388_100000210202 [0,0,0,0,0,0|2,1,1]=4 109 B12R1.308 CN(CCF)c1ccccc1O 269982a_100000033821_100011217306 [0,0,0,0,0,0|4,0,0]=4 110 B12R1.308 CN(CCO)c1ccccc1O 269982a_100000033821_100000211926 [0,0,0,0,0,0|4,0,0]=4 111 B12R1.308 CNCC(=O)c1ccccc1Br 34a_100102657272_100000199116 [0,0,0,0,0,0|3,0,0]=3 112 B12R1.308 CNCC(=O)c1ccccc1C 2230a_106832991635_100000741374 [0,0,0,0,0,0|3,0,0]=3 113 B12R1.308 CNCC(=O)c1ccccc1C 34a_100102657272_100000741374 [0,0,0,0,0,0|3,0,0]=3 114 B12R1.308 CNCC(=O)c1ccccc1C 7a_106832991635_100000741374 [0,0,0,0,0,0|3,0,0]=3 115 B12R1.308 CNCC(=O)c1ccccc1Cl 34a_100102657272_100000211432 [0,0,0,0,0,0|3,0,0]=3 116 B12R1.308 CNCC(=O)c1ccccc1F 34a_100102657272_100000204681 [0,0,0,0,0,0|3,0,0]=3 117 B12R1.308 CNCC(=O)c1ccccc1F 7a_106832991635_100000204681 [0,0,0,0,0,0|3,0,0]=3 118 B12R1.308 CNCC(=O)c1ccccc1O 7a_106832991635_100000188908 [0,0,0,0,0,0|2,0,0]=2 119 B12R1.308 CNNC(=O)c1ccccc1Br 22a_100016993582_100000188424 [0,0,0,0,0,0|3,0,0]=3 120 B12R1.308 CNNC(=O)c1ccccc1C 22a_100016993582_100000212026 [0,0,0,0,0,0|3,0,0]=3 121 B12R1.308 CNNC(=O)c1ccccc1Cl 22a_100016993582_100000185844 [0,0,0,0,0,0|3,0,0]=3 122 B12R1.308 CNNC(=O)c1ccccc1F 22a_100016993582_100000188656 [0,0,0,0,0,0|3,0,0]=3 123 B12R1.308 CNNC(=O)c1ccccc1I 22a_100016993582_100000187884 [0,0,0,0,0,0|3,0,0]=3 124 B12R1.308 CNNC(=O)c1ccccc1O 22a_100016993582_100015234032 [0,0,0,0,0,0|2,0,0]=2 125 B12R1.308 CNNC(=O)c1ccccc1[O-] 22a_100016993582_100009911694 [0,0,0,0,0,0|2,0,1]=3 126 B12R1.308 COCC(=O)c1ccccc1Br 34a_100138415774_100000199116 [0,0,0,0,0,0|3,0,0]=3 127 B12R1.308 COCC(=O)c1ccccc1C 34a_100138415774_100000741374 [0,0,0,0,0,0|3,0,0]=3 128 B12R1.308 COCC(=O)c1ccccc1Cl 34a_100138415774_100000211432 [0,0,0,0,0,0|3,0,0]=3 129 B12R1.308 COCC(=O)c1ccccc1F 34a_100138415774_100000204681 [0,0,0,0,0,0|3,0,0]=3 130 B12R1.308 COCN(C)c1ccccc1O 269982a_100000033821_100000766300 [0,0,0,0,0,0|4,0,0]=4 131 B12R1.308 CSCC(=O)c1ccccc1Br 62a_100000199116_200000210301 [0,0,0,0,0,0|3,0,0]=3 132 B12R1.308 CSCC(=O)c1ccccc1C 62a_100000741374_200000210301 [0,0,0,0,0,0|3,0,0]=3 133 B12R1.308 CSCC(=O)c1ccccc1C 62a_200000210301_100000741374 [0,0,0,0,0,0|3,0,0]=3 134 B12R1.308 CSCC(=O)c1ccccc1Cl 62a_100000211432_200000210301 [0,0,0,0,0,0|3,0,0]=3 135 B12R1.308 CSCC(=O)c1ccccc1Cl 62a_200000210301_100000211432 [0,0,0,0,0,0|3,0,0]=3 136 B12R1.308 CSCC(=O)c1ccccc1F 62a_100000204681_200000210301 [0,0,0,0,0,0|3,0,0]=3 137 B12R1.308 CSCC(=O)c1ccccc1F 62a_200000210301_100000204681 [0,0,0,0,0,0|3,0,0]=3 138 B12R1.308 CSCC(=O)c1ccccc1O 62a_100000188908_200000210301 [0,0,0,0,0,0|2,0,0]=2 139 B12R1.308 CSCC(=O)c1ccccc1O 62a_200000210301_100000188908 [0,0,0,0,0,0|2,0,0]=2 140 B12R1.308 CSCN(C)c1ccccc1O 269982a_100000033821_100011218213 [0,0,0,0,0,0|4,0,0]=4 141 B12R1.308 Cc1ccccc1C(=O)CC#N 1458a_100000212026_100011214920 [0,0,0,0,0,0|3,0,1]=4 142 B12R1.308 Cc1ccccc1C(=O)CCF 1458a_100000212026_100011217306 [0,0,0,0,0,0|3,0,0]=3 143 B12R1.308 Cc1ccccc1C(=O)CCO 1458a_100000212026_100000211926 [0,0,0,0,0,0|3,0,0]=3 144 B12R1.308 Cc1ccccc1C(=O)CS[13CH3] 62a_100000741374_200025704644 [0,0,0,0,0,0|3,0,0]=3 145 B12R1.308 Cc1ccccc1C(=O)CS[13CH3] 62a_200025704644_100000741374 [0,0,0,0,0,0|3,0,0]=3 146 B12R1.308 Cc1ccccc1C(C)OCF 34a_100000742021_100015361967 [0,0,0,0,0,0|3,0,1]=4 147 B12R1.308 Cc1ccccc1C(C)OCF 7a_100000742021_100015361967 [0,0,0,0,0,0|3,0,1]=4 148 B12R1.308 N#CCC(=O)c1ccccc1Br 1458a_100000188424_100011214920 [0,0,0,0,0,0|3,0,1]=4 149 B12R1.308 N#CCC(=O)c1ccccc1Cl 1458a_100000185844_100011214920 [0,0,0,0,0,0|3,0,1]=4 150 B12R1.308 N#CCC(=O)c1ccccc1F 1458a_100000188656_100011214920 [0,0,0,0,0,0|3,0,1]=4 151 B12R1.308 N#CCC(=O)c1ccccc1I 1458a_100000187884_100011214920 [0,0,0,0,0,0|3,0,1]=4 152 B12R1.308 N#CCC(=O)c1ccccc1O 1458a_100015234032_100011214920 [0,0,0,0,0,0|2,0,1]=3 153 B12R1.308 N#CCC(=O)c1ccccc1O 271570a_203496583355_100011225204 [0,0,0,0,0,0|2,0,1]=3 154 B12R1.308 N#CCC(=O)c1ccccc1[O-] 1458a_100009911694_100011214920 [0,0,0,0,0,0|2,0,2]=4 155 B12R1.308 O=C(CCF)c1ccccc1Br 1458a_100000188424_100011217306 [0,0,0,0,0,0|3,0,0]=3 156 B12R1.308 O=C(CCF)c1ccccc1Cl 1458a_100000185844_100011217306 [0,0,0,0,0,0|3,0,0]=3 157 B12R1.308 O=C(CCF)c1ccccc1F 1458a_100000188656_100011217306 [0,0,0,0,0,0|3,0,0]=3 158 B12R1.308 O=C(CCF)c1ccccc1I 1458a_100000187884_100011217306 [0,0,0,0,0,0|3,0,0]=3 159 B12R1.308 O=C(CCF)c1ccccc1O 1458a_100015234032_100011217306 [0,0,0,0,0,0|2,0,0]=2 160 B12R1.308 O=C(CCF)c1ccccc1[O-] 1458a_100009911694_100011217306 [0,0,0,0,0,0|2,0,1]=3 161 B12R1.308 O=C(CCO)c1ccccc1Br 1458a_100000188424_100000211926 [0,0,0,0,0,0|3,0,0]=3 162 B12R1.308 O=C(CCO)c1ccccc1Cl 1458a_100000185844_100000211926 [0,0,0,0,0,0|3,0,0]=3 163 B12R1.308 O=C(CCO)c1ccccc1F 1458a_100000188656_100000211926 [0,0,0,0,0,0|3,0,0]=3 164 B12R1.308 O=C(CCO)c1ccccc1I 1458a_100000187884_100000211926 [0,0,0,0,0,0|3,0,0]=3 165 B12R1.308 O=C(CCO)c1ccccc1O 1458a_100015234032_100000211926 [0,0,0,0,0,0|2,0,0]=2 166 B12R1.308 O=C(CCO)c1ccccc1[O-] 1458a_100009911694_100000211926 [0,0,0,0,0,0|2,0,1]=3 167 B12R1.308 [13CH3]SCC(=O)c1ccccc1Br 62a_100000199116_200025704644 [0,0,0,0,0,0|3,0,0]=3 168 B12R1.308 [13CH3]SCC(=O)c1ccccc1Cl 62a_100000211432_200025704644 [0,0,0,0,0,0|3,0,0]=3 169 B12R1.308 [13CH3]SCC(=O)c1ccccc1Cl 62a_200025704644_100000211432 [0,0,0,0,0,0|3,0,0]=3 170 B12R1.308 [13CH3]SCC(=O)c1ccccc1F 62a_100000204681_200025704644 [0,0,0,0,0,0|3,0,0]=3 171 B12R1.308 [13CH3]SCC(=O)c1ccccc1F 62a_200025704644_100000204681 [0,0,0,0,0,0|3,0,0]=3 172 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_100000188908_200025704644 [0,0,0,0,0,0|2,0,0]=2 173 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_200025704644_100000188908 [0,0,0,0,0,0|2,0,0]=2 174 B11R1.16 C#CCC(=O)c1ccccc1 1458a_100000185807_100000184674 [1,0,0,0,0,0|1,0,2]=4 175 B11R1.16 C=CCC(=O)c1ccccc1 1458a_100000185807_100000210623 [1,0,0,0,0,0|1,0,2]=4 176 B11R1.16 CCCC(=O)c1ccccc1 1458a_100000185807_100000210303 [1,0,0,0,0,0|1,0,0]=2 177 B11R1.16 CCCN(C)c1ccccc1 2230a_100000210012_100000210303 [1,0,0,0,0,0|3,0,0]=4 178 B11R1.16 CCCN(C)c1ccccc1 2230a_200011218496_200000210301 [1,0,0,0,0,0|3,0,0]=4 179 B11R1.16 CCCN(C)c1ccccc1 269982a_100000210012_100000210303 [1,0,0,0,0,0|3,0,0]=4 180 B11R1.16 CCCN(C)c1ccccc1 269982a_200011218496_200000210301 [1,0,0,0,0,0|3,0,0]=4 181 B11R1.16 CCCN(C)c1ccccc1 34a_100000210012_100000210303 [1,0,0,0,0,0|3,0,0]=4 182 B11R1.16 CCCN(C)c1ccccc1 34a_200011218496_200000210301 [1,0,0,0,0,0|3,0,0]=4 183 B11R1.16 CCCN([13CH3])c1ccccc1 2230a_200011218496_200025704644 [1,0,0,0,0,0|3,0,0]=4 184 B11R1.16 CCCN([13CH3])c1ccccc1 269982a_200011218496_200025704644 [1,0,0,0,0,0|3,0,0]=4 185 B11R1.16 CCCN([13CH3])c1ccccc1 34a_200011218496_200025704644 [1,0,0,0,0,0|3,0,0]=4 186 B11R1.16 CCNC(=O)c1ccccc1 11a_100015525214_100000185807 [1,0,0,0,0,0|1,0,0]=2 187 B11R1.16 CCNC(=O)c1ccccc1 240690a_100015525214_100000185807 [1,0,0,0,0,0|1,0,0]=2 188 B11R1.16 CCNC(=O)c1ccccc1 527a_100015525214_100000185807 [1,0,0,0,0,0|1,0,0]=2 189 B11R1.16 CCNC(C)c1ccccc1 2230a_100015525214_100000230085 [1,0,0,0,0,0|2,0,1]=4 190 B11R1.16 CCNC(C)c1ccccc1 269862a_100015525214_100000185851 [1,0,0,0,0,0|2,0,1]=4 191 B11R1.16 CCN[C@H](C)c1ccccc1 2230a_100000751104_100000210202 [1,0,0,0,0,0|2,0,1]=4 192 B11R1.16 CCOC(C)c1ccccc1 34a_100121572206_100000211855 [1,0,0,0,0,0|1,0,1]=3 193 B11R1.16 CCO[C@H](C)c1ccccc1 34a_100000761318_100000210202 [1,0,0,0,0,0|1,0,1]=3 194 B11R1.16 CCO[C@H](C)c1ccccc1 7a_100000761318_100000210202 [1,0,0,0,0,0|1,0,1]=3 195 B11R1.16 CCSC(C)c1ccccc1 62a_100000210202_100000230085 [1,0,0,0,0,0|1,1,1]=4 196 B11R1.16 CCSC(C)c1ccccc1 62a_100000230085_100000210202 [1,0,0,0,0,0|1,1,1]=4 197 B11R1.16 CNCC(=O)c1ccccc1 7a_106832991635_100000211460 [1,0,0,0,0,0|2,0,0]=3 198 B11R1.16 CNCC(=O)c1ccccn1 34a_100102657272_100000027445 [1,0,0,0,0,0|3,0,0]=4 199 B11R1.16 CNCC(=O)c1ccccn1 7a_106832991635_100000027445 [1,0,0,0,0,0|3,0,0]=4 200 B11R1.16 CNCC(=O)c1ccncc1 7a_106832991635_100015248511 [1,0,0,0,0,0|3,0,0]=4 201 B11R1.16 CNNC(=O)c1ccccc1 22a_100016993582_100000185807 [1,0,0,0,0,0|2,0,0]=3 202 B11R1.16 COCC(=O)c1ccccn1 34a_100138415774_100000027445 [1,0,0,0,0,0|3,0,0]=4 203 B11R1.16 CSCC(=O)c1ccccc1 62a_100000211460_200000210301 [1,0,0,0,0,0|2,0,0]=3 204 B11R1.16 CSCC(=O)c1ccccc1 62a_200000210301_100000211460 [1,0,0,0,0,0|2,0,0]=3 205 B11R1.16 CSCC(=O)c1ccccn1 62a_100000027445_200000210301 [1,0,0,0,0,0|3,0,0]=4 206 B11R1.16 CSCC(=O)c1ccccn1 62a_200000210301_100000027445 [1,0,0,0,0,0|3,0,0]=4 207 B11R1.16 CSCC(=O)c1cccnc1 62a_100000757877_200000210301 [1,0,0,0,0,0|3,0,0]=4 208 B11R1.16 CSCC(=O)c1cccnc1 62a_200000210301_100000757877 [1,0,0,0,0,0|3,0,0]=4 209 B11R1.16 CSCC(=O)c1ccncc1 62a_100000027454_200000210301 [1,0,0,0,0,0|3,0,0]=4 210 B11R1.16 CSCC(=O)c1ccncc1 62a_200000210301_100000027454 [1,0,0,0,0,0|3,0,0]=4 211 B11R1.16 CSCS(=O)c1ccccc1 62a_200000210301_100000031784 [1,0,0,0,0,0|3,0,0]=4 212 B11R1.16 C[C@@H](OCF)c1ccccc1 34a_100000761318_100015361967 [1,0,0,0,0,0|2,0,1]=4 213 B11R1.16 C[C@@H](OCF)c1ccccc1 7a_100000761318_100015361967 [1,0,0,0,0,0|2,0,1]=4 214 B11R1.16 N#CCC(=O)c1ccccc1 1458a_100000185807_100011214920 [1,0,0,0,0,0|2,0,1]=4 215 B11R1.16 O=C(CCF)c1ccccc1 1458a_100000185807_100011217306 [1,0,0,0,0,0|2,0,0]=3 216 B11R1.16 O=C(CCO)c1ccccc1 1458a_100000185807_100000211926 [1,0,0,0,0,0|2,0,0]=3 217 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_100000211460_200025704644 [1,0,0,0,0,0|2,0,0]=3 218 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_200025704644_100000211460 [1,0,0,0,0,0|2,0,0]=3 219 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_100000027445_200025704644 [1,0,0,0,0,0|3,0,0]=4 220 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_200025704644_100000027445 [1,0,0,0,0,0|3,0,0]=4 221 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_100000757877_200025704644 [1,0,0,0,0,0|3,0,0]=4 222 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_200025704644_100000757877 [1,0,0,0,0,0|3,0,0]=4 223 B11R1.16 [13CH3]SCC(=O)c1ccncc1 62a_100000027454_200025704644 [1,0,0,0,0,0|3,0,0]=4 224 B11R1.16 [13CH3]SCC(=O)c1ccncc1 62a_200025704644_100000027454 [1,0,0,0,0,0|3,0,0]=4 225 B11R1.16 [13CH3]SCS(=O)c1ccccc1 62a_200025704644_100000031784 [1,0,0,0,0,0|3,0,0]=4 226 B11R1.17 CCCCc1ccccc1Br 271570a_100020621405_100000695589 [1,0,0,0,0,0|2,0,1]=4 227 B11R1.17 CCCCc1ccccc1C 271570a_100020621405_100000210755 [1,0,0,0,0,0|2,0,1]=4 228 B11R1.17 CCCCc1ccccc1Cl 271570a_100020621405_100000764095 [1,0,0,0,0,0|2,0,1]=4 229 B11R1.17 CCCCc1ccccc1F 271570a_100020621405_100011215700 [1,0,0,0,0,0|2,0,1]=4 230 B11R1.17 CCCCc1ccccc1N 271570a_100020621405_100000210017 [1,0,0,0,0,0|2,0,1]=4 231 B11R1.17 CCCCc1ccccc1O 271570a_100020621405_100000739446 [1,0,0,0,0,0|1,0,1]=3 232 B11R1.17 CCCCc1ccncc1O 271570a_100020621405_100009817591 [1,0,0,0,0,0|2,0,1]=4 233 B11R1.17 CCCCc1ncccc1O 271570a_100020621405_100000034122 [1,0,0,0,0,0|2,0,1]=4 234 B11R1.17 CCCNc1ccccc1Br 34a_100000210017_100000210303 [1,0,0,0,0,0|3,0,0]=4 235 B11R1.17 CCCNc1ccccc1C 34a_100015192222_100000210303 [1,0,0,0,0,0|3,0,0]=4 236 B11R1.17 CCCNc1ccccc1Cl 34a_100000185783_100000210303 [1,0,0,0,0,0|3,0,0]=4 237 B11R1.17 CCCNc1ccccc1F 34a_100000210422_100000210303 [1,0,0,0,0,0|3,0,0]=4 238 B11R1.17 CCCNc1ccccc1I 34a_100000210053_100000210303 [1,0,0,0,0,0|3,0,0]=4 239 B11R1.17 CCCNc1ccccc1O 34a_100000185747_100000210303 [1,0,0,0,0,0|2,0,0]=3 240 B11R1.17 CCCOc1ccccc1Br 34a_100000181306_100000210303 [1,0,0,0,0,0|3,0,0]=4 241 B11R1.17 CCCOc1ccccc1Br 7a_100000181306_100000210303 [1,0,0,0,0,0|3,0,0]=4 242 B11R1.17 CCCOc1ccccc1C 34a_100000210338_100000210303 [1,0,0,0,0,0|3,0,0]=4 243 B11R1.17 CCCOc1ccccc1C 7a_100000210338_100000210303 [1,0,0,0,0,0|3,0,0]=4 244 B11R1.17 CCCOc1ccccc1Cl 34a_100000210172_100000210303 [1,0,0,0,0,0|3,0,0]=4 245 B11R1.17 CCCOc1ccccc1Cl 7a_100000210172_100000210303 [1,0,0,0,0,0|3,0,0]=4 246 B11R1.17 CCCOc1ccccc1F 34a_100000210171_100000210303 [1,0,0,0,0,0|3,0,0]=4 247 B11R1.17 CCCOc1ccccc1F 7a_100000210171_100000210303 [1,0,0,0,0,0|3,0,0]=4 248 B11R1.17 CCCOc1ccccc1I 34a_100000739446_100000210303 [1,0,0,0,0,0|3,0,0]=4 249 B11R1.17 CCCOc1ccccc1I 7a_100000739446_100000210303 [1,0,0,0,0,0|3,0,0]=4 250 B11R1.17 CCCOc1ccccc1N 34a_100000185747_100000210303 [1,0,0,0,0,0|3,0,0]=4 251 B11R1.17 CCCOc1ccccc1N 7a_100000185747_100000210303 [1,0,0,0,0,0|3,0,0]=4 252 B11R1.17 CCCOc1ccccc1O 271570a_203496583355_100000174042 [1,0,0,0,0,0|2,0,0]=3 253 B11R1.17 CCCOc1ncccc1O 271570a_203496583355_200011465209 [1,0,0,0,0,0|3,0,0]=4 254 B11R1.17 CCCSc1ccccc1Br 62a_100000210303_100000695589 [1,0,0,0,0,0|3,0,0]=4 255 B11R1.17 CCCSc1ccccc1Br 62a_100000695589_100000210303 [1,0,0,0,0,0|3,0,0]=4 256 B11R1.17 CCCSc1ccccc1C 62a_100000210303_100000210755 [1,0,0,0,0,0|3,0,0]=4 257 B11R1.17 CCCSc1ccccc1C 62a_100000210755_100000210303 [1,0,0,0,0,0|3,0,0]=4 258 B11R1.17 CCCSc1ccccc1Cl 62a_100000210303_100000764095 [1,0,0,0,0,0|3,0,0]=4 259 B11R1.17 CCCSc1ccccc1Cl 62a_100000764095_100000210303 [1,0,0,0,0,0|3,0,0]=4 260 B11R1.17 CCCSc1ccccc1F 62a_100000210303_100011215700 [1,0,0,0,0,0|3,0,0]=4 261 B11R1.17 CCCSc1ccccc1F 62a_100011215700_100000210303 [1,0,0,0,0,0|3,0,0]=4 262 B11R1.17 CCCSc1ccccc1N 62a_100000210017_100000210303 [1,0,0,0,0,0|3,0,0]=4 263 B11R1.17 CCCSc1ccccc1N 62a_100000210303_100000210017 [1,0,0,0,0,0|3,0,0]=4 264 B11R1.17 CCCSc1ccccc1O 62a_100000210303_100000739446 [1,0,0,0,0,0|2,0,0]=3 265 B11R1.17 CCCSc1ccccc1O 62a_100000739446_100000210303 [1,0,0,0,0,0|2,0,0]=3 266 B11R1.17 CCCSc1cccnc1O 62a_100000210303_100000760158 [1,0,0,0,0,0|3,0,0]=4 267 B11R1.17 CCCSc1cccnc1O 62a_100000760158_100000210303 [1,0,0,0,0,0|3,0,0]=4 268 B11R1.17 CCCSc1ccncc1O 62a_100000210303_100009817591 [1,0,0,0,0,0|3,0,0]=4 269 B11R1.17 CCCSc1ccncc1O 62a_100009817591_100000210303 [1,0,0,0,0,0|3,0,0]=4 270 B11R1.17 CCCSc1ncccc1O 62a_100000034122_100000210303 [1,0,0,0,0,0|3,0,0]=4 271 B11R1.17 CCCSc1ncccc1O 62a_100000210303_100000034122 [1,0,0,0,0,0|3,0,0]=4 272 B11R1.17 CCNCc1ccccc1Br 207a_100015525214_100000211189 [1,0,0,0,0,0|2,0,1]=4 273 B11R1.17 CCNCc1ccccc1Br 2230a_100000689332_100000210202 [1,0,0,0,0,0|2,0,1]=4 274 B11R1.17 CCNCc1ccccc1Br 2230a_100015525214_100000184730 [1,0,0,0,0,0|2,0,1]=4 275 B11R1.17 CCNCc1ccccc1Br 270004a_100015525214_100000211189 [1,0,0,0,0,0|2,0,1]=4 276 B11R1.17 CCNCc1ccccc1Br 34a_100000689332_100000210202 [1,0,0,0,0,0|2,0,1]=4 277 B11R1.17 CCNCc1ccccc1C 207a_100015525214_100000211143 [1,0,0,0,0,0|2,0,1]=4 278 B11R1.17 CCNCc1ccccc1C 2230a_100015525214_100000211839 [1,0,0,0,0,0|2,0,1]=4 279 B11R1.17 CCNCc1ccccc1C 270004a_100015525214_100000211143 [1,0,0,0,0,0|2,0,1]=4 280 B11R1.17 CCNCc1ccccc1C 34a_100000174972_100000210202 [1,0,0,0,0,0|2,0,1]=4 281 B11R1.17 CCNCc1ccccc1Cl 207a_100015525214_100000210073 [1,0,0,0,0,0|2,0,1]=4 282 B11R1.17 CCNCc1ccccc1Cl 2230a_100000174879_100000210202 [1,0,0,0,0,0|2,0,1]=4 283 B11R1.17 CCNCc1ccccc1Cl 2230a_100015525214_100000187162 [1,0,0,0,0,0|2,0,1]=4 284 B11R1.17 CCNCc1ccccc1Cl 270004a_100015525214_100000210073 [1,0,0,0,0,0|2,0,1]=4 285 B11R1.17 CCNCc1ccccc1Cl 34a_100000174879_100000210202 [1,0,0,0,0,0|2,0,1]=4 286 B11R1.17 CCNCc1ccccc1F 207a_100015525214_100000210811 [1,0,0,0,0,0|2,0,1]=4 287 B11R1.17 CCNCc1ccccc1F 2230a_100015525214_100000211605 [1,0,0,0,0,0|2,0,1]=4 288 B11R1.17 CCNCc1ccccc1F 270004a_100015525214_100000210811 [1,0,0,0,0,0|2,0,1]=4 289 B11R1.17 CCNCc1ccccc1F 34a_100000174869_100000210202 [1,0,0,0,0,0|2,0,1]=4 290 B11R1.17 CCNCc1ccccc1I 207a_100015525214_100000010305 [1,0,0,0,0,0|2,0,1]=4 291 B11R1.17 CCNCc1ccccc1I 2230a_100015525214_100011215278 [1,0,0,0,0,0|2,0,1]=4 292 B11R1.17 CCNCc1ccccc1I 270004a_100015525214_100000010305 [1,0,0,0,0,0|2,0,1]=4 293 B11R1.17 CCNCc1ccccc1O 34a_100000185550_100000210202 [1,0,0,0,0,0|1,0,1]=3 294 B11R1.17 CCNCc1cccnc1O 207a_100015525214_100011998315 [1,0,0,0,0,0|2,0,1]=4 295 B11R1.17 CCNCc1cccnc1O 270004a_100015525214_100011998315 [1,0,0,0,0,0|2,0,1]=4 296 B11R1.17 CCOCc1ccccc1Br 34a_100000756307_100000210202 [1,0,0,0,0,0|1,0,1]=3 297 B11R1.17 CCOCc1ccccc1Br 34a_100121572206_100000184730 [1,0,0,0,0,0|1,0,1]=3 298 B11R1.17 CCOCc1ccccc1Br 7a_100000756307_100000210202 [1,0,0,0,0,0|1,0,1]=3 299 B11R1.17 CCOCc1ccccc1C 34a_100000698903_100000210202 [1,0,0,0,0,0|1,0,1]=3 300 B11R1.17 CCOCc1ccccc1C 34a_100121572206_100000211839 [1,0,0,0,0,0|1,0,1]=3 301 B11R1.17 CCOCc1ccccc1C 7a_100000698903_100000210202 [1,0,0,0,0,0|1,0,1]=3 302 B11R1.17 CCOCc1ccccc1Cl 34a_100000210847_100000210202 [1,0,0,0,0,0|1,0,1]=3 303 B11R1.17 CCOCc1ccccc1Cl 34a_100121572206_100000187162 [1,0,0,0,0,0|1,0,1]=3 304 B11R1.17 CCOCc1ccccc1Cl 7a_100000210847_100000210202 [1,0,0,0,0,0|1,0,1]=3 305 B11R1.17 CCOCc1ccccc1F 34a_100000211962_100000210202 [1,0,0,0,0,0|1,0,1]=3 306 B11R1.17 CCOCc1ccccc1F 34a_100121572206_100000211605 [1,0,0,0,0,0|1,0,1]=3 307 B11R1.17 CCOCc1ccccc1F 7a_100000211962_100000210202 [1,0,0,0,0,0|1,0,1]=3 308 B11R1.17 CCOCc1ccccc1I 34a_100000187465_100000210202 [1,0,0,0,0,0|1,0,1]=3 309 B11R1.17 CCOCc1ccccc1I 34a_100121572206_100011215278 [1,0,0,0,0,0|1,0,1]=3 310 B11R1.17 CCOCc1ccccc1I 7a_100000187465_100000210202 [1,0,0,0,0,0|1,0,1]=3 311 B11R1.17 CCOCc1ccccc1N 34a_100000212039_100000210202 [1,0,0,0,0,0|1,0,1]=3 312 B11R1.17 CCOCc1ccccc1O 271570a_203496583355_200011493690 [1,0,0,0,0,0|0,0,1]=2 313 B11R1.17 CCOCc1cccnc1Br 34a_100000719692_100000210202 [1,0,0,0,0,0|2,0,1]=4 314 B11R1.17 CCOCc1cccnc1Br 34a_100121572206_100010140945 [1,0,0,0,0,0|2,0,1]=4 315 B11R1.17 CCOCc1cccnc1Br 7a_100000719692_100000210202 [1,0,0,0,0,0|2,0,1]=4 316 B11R1.17 CCOCc1cccnc1C 34a_100000729262_100000210202 [1,0,0,0,0,0|2,0,1]=4 317 B11R1.17 CCOCc1cccnc1C 34a_100121572206_100000732876 [1,0,0,0,0,0|2,0,1]=4 318 B11R1.17 CCOCc1cccnc1C 7a_100000729262_100000210202 [1,0,0,0,0,0|2,0,1]=4 319 B11R1.17 CCOCc1cccnc1Cl 34a_100000748726_100000210202 [1,0,0,0,0,0|2,0,1]=4 320 B11R1.17 CCOCc1cccnc1Cl 34a_100121572206_100000045678 [1,0,0,0,0,0|2,0,1]=4 321 B11R1.17 CCOCc1cccnc1Cl 7a_100000748726_100000210202 [1,0,0,0,0,0|2,0,1]=4 322 B11R1.17 CCOCc1cccnc1F 34a_100000079888_100000210202 [1,0,0,0,0,0|2,0,1]=4 323 B11R1.17 CCOCc1cccnc1F 34a_100121572206_100000099810 [1,0,0,0,0,0|2,0,1]=4 324 B11R1.17 CCOCc1cccnc1F 7a_100000079888_100000210202 [1,0,0,0,0,0|2,0,1]=4 325 B11R1.17 CCOCc1ccncc1C 34a_100011997032_100000210202 [1,0,0,0,0,0|2,0,1]=4 326 B11R1.17 CCOCc1ccncc1C 34a_100121572206_100020672809 [1,0,0,0,0,0|2,0,1]=4 327 B11R1.17 CCOCc1ccncc1F 34a_100012172863_100000210202 [1,0,0,0,0,0|2,0,1]=4 328 B11R1.17 CCOCc1cnccc1C 34a_100011996381_100000210202 [1,0,0,0,0,0|2,0,1]=4 329 B11R1.17 CCOCc1cnccc1C 34a_100121572206_100000690890 [1,0,0,0,0,0|2,0,1]=4 330 B11R1.17 CCOCc1cnccc1Cl 34a_100000117392_100000210202 [1,0,0,0,0,0|2,0,1]=4 331 B11R1.17 CCOCc1ncccc1Br 34a_100011996772_100000210202 [1,0,0,0,0,0|2,0,1]=4 332 B11R1.17 CCOCc1ncccc1Br 34a_100121572206_100025702911 [1,0,0,0,0,0|2,0,1]=4 333 B11R1.17 CCOCc1ncccc1C 34a_100000698912_100000210202 [1,0,0,0,0,0|2,0,1]=4 334 B11R1.17 CCOCc1ncccc1C 34a_100121572206_100000696600 [1,0,0,0,0,0|2,0,1]=4 335 B11R1.17 CCOCc1ncccc1Cl 34a_100012002383_100000210202 [1,0,0,0,0,0|2,0,1]=4 336 B11R1.17 CCOCc1ncccc1F 34a_100011934865_100000210202 [1,0,0,0,0,0|2,0,1]=4 337 B11R1.17 CCOCc1ncccc1F 34a_100121572206_100000104219 [1,0,0,0,0,0|2,0,1]=4 338 B11R1.17 CCOCc1ncccc1N 34a_114873767017_100000210202 [1,0,0,0,0,0|2,0,1]=4 339 B11R1.17 CCOCc1ncccc1O 34a_100121572206_200020655725 [1,0,0,0,0,0|1,0,1]=3 340 B11R1.17 CCSCc1ccccc1Br 62a_100000184730_100000210202 [1,0,0,0,0,0|1,1,1]=4 341 B11R1.17 CCSCc1ccccc1Br 62a_100000210202_100000184730 [1,0,0,0,0,0|1,1,1]=4 342 B11R1.17 CCSCc1ccccc1C 62a_100000210202_100000211839 [1,0,0,0,0,0|1,1,1]=4 343 B11R1.17 CCSCc1ccccc1C 62a_100000211839_100000210202 [1,0,0,0,0,0|1,1,1]=4 344 B11R1.17 CCSCc1ccccc1Cl 62a_100000187162_100000210202 [1,0,0,0,0,0|1,1,1]=4 345 B11R1.17 CCSCc1ccccc1Cl 62a_100000210202_100000187162 [1,0,0,0,0,0|1,1,1]=4 346 B11R1.17 CCSCc1ccccc1F 62a_100000210202_100000211605 [1,0,0,0,0,0|1,1,1]=4 347 B11R1.17 CCSCc1ccccc1F 62a_100000211605_100000210202 [1,0,0,0,0,0|1,1,1]=4 348 B11R1.17 CCSCc1ccccc1I 62a_100000210202_100011216222 [1,0,0,0,0,0|1,1,1]=4 349 B11R1.17 CCSCc1ccccc1I 62a_100011216222_100000210202 [1,0,0,0,0,0|1,1,1]=4 350 B11R1.17 CCSCc1ccccc1O 271570a_203496583355_200000173030 [1,0,0,0,0,0|0,1,1]=3 351 B11R1.17 CCSCc1ncccc1O 62a_100000210202_200020655725 [1,0,0,0,0,0|1,1,1]=4 352 B11R1.17 CCSCc1ncccc1O 62a_200020655725_100000210202 [1,0,0,0,0,0|1,1,1]=4 353 B11R1.17 CNCCc1ccccc1O 34a_100011207237_200000210301 [1,0,0,0,0,0|2,0,1]=4 354 B11R1.17 CNCCc1ccccc1O 34a_100102657272_100000722297 [1,0,0,0,0,0|2,0,1]=4 355 B11R1.17 CNCCc1ccccc1O 7a_106832991635_100000722297 [1,0,0,0,0,0|2,0,1]=4 356 B11R1.17 COCCc1ccccc1O 34a_100138415774_100000722297 [1,0,0,0,0,0|2,0,1]=4 357 B11R1.17 COCOc1ccccc1O 271570a_203496583355_200000230759 [1,0,0,0,0,0|3,0,0]=4 358 B11R1.17 COCSc1ccccc1O 62a_100000739446_100000766300 [1,0,0,0,0,0|3,0,0]=4 359 B11R1.17 COCSc1ccccc1O 62a_100000766300_100000739446 [1,0,0,0,0,0|3,0,0]=4 360 B11R1.17 CSCCc1ccccc1O 62a_100000722297_200000210301 [1,0,0,0,0,0|2,0,1]=4 361 B11R1.17 CSCCc1ccccc1O 62a_200000210301_100000722297 [1,0,0,0,0,0|2,0,1]=4 362 B11R1.17 CSCNc1ccccc1O 34a_100000185747_100011218213 [1,0,0,0,0,0|3,0,0]=4 363 B11R1.17 CSCSc1ccccc1O 62a_100000739446_100011218213 [1,0,0,0,0,0|3,0,0]=4 364 B11R1.17 CSCSc1ccccc1O 62a_100011218213_100000739446 [1,0,0,0,0,0|3,0,0]=4 365 B11R1.17 Cc1ccccc1COCF 34a_100000698903_100015361967 [1,0,0,0,0,0|2,0,1]=4 366 B11R1.17 Cc1ccccc1COCF 7a_100000698903_100015361967 [1,0,0,0,0,0|2,0,1]=4 367 B11R1.17 FCOCc1ccccc1Br 34a_100000756307_100015361967 [1,0,0,0,0,0|2,0,1]=4 368 B11R1.17 FCOCc1ccccc1Br 7a_100000756307_100015361967 [1,0,0,0,0,0|2,0,1]=4 369 B11R1.17 FCOCc1ccccc1Cl 34a_100000210847_100015361967 [1,0,0,0,0,0|2,0,1]=4 370 B11R1.17 FCOCc1ccccc1Cl 7a_100000210847_100015361967 [1,0,0,0,0,0|2,0,1]=4 371 B11R1.17 FCOCc1ccccc1F 34a_100000211962_100015361967 [1,0,0,0,0,0|2,0,1]=4 372 B11R1.17 FCOCc1ccccc1F 7a_100000211962_100015361967 [1,0,0,0,0,0|2,0,1]=4 373 B11R1.17 FCOCc1ccccc1I 34a_100000187465_100015361967 [1,0,0,0,0,0|2,0,1]=4 374 B11R1.17 FCOCc1ccccc1I 7a_100000187465_100015361967 [1,0,0,0,0,0|2,0,1]=4 375 B11R1.17 NCCOc1ccccc1O 271570a_203496583355_100000744007 [1,0,0,0,0,0|3,0,0]=4 376 B11R1.17 Nc1ccccc1COCF 34a_100000212039_100015361967 [1,0,0,0,0,0|2,0,1]=4 377 B11R1.17 OCC#Cc1ccccc1O 271570a_203496583355_100009814404 [1,0,0,0,0,0|2,0,1]=4 378 B11R1.17 OCCCc1ccccc1O 271570a_203496583355_100000699526 [1,0,0,0,0,0|2,0,1]=4 379 B11R1.17 OCCNc1ccccc1O 34a_100000185747_100000211926 [1,0,0,0,0,0|3,0,0]=4 380 B11R1.17 OCCOc1ccccc1O 271570a_203496583355_100000230753 [1,0,0,0,0,0|3,0,0]=4 381 B11R1.17 OCCSc1ccccc1O 271570a_203496583355_200000230852 [1,0,0,0,0,0|3,0,0]=4 382 B11R1.17 OCCSc1ccccc1O 62a_100000211926_100000739446 [1,0,0,0,0,0|3,0,0]=4 383 B11R1.17 OCCSc1ccccc1O 62a_100000739446_100000211926 [1,0,0,0,0,0|3,0,0]=4 384 B11R1.17 Oc1ccccc1CNCF 34a_100000185550_100015361967 [1,0,0,0,0,0|2,0,1]=4 385 B11R1.17 Oc1ccccc1NCCF 34a_100000185747_100011217306 [1,0,0,0,0,0|3,0,0]=4 386 B11R1.17 Oc1ccccc1SCCF 62a_100000739446_100011217306 [1,0,0,0,0,0|3,0,0]=4 387 B11R1.17 Oc1ccccc1SCCF 62a_100011217306_100000739446 [1,0,0,0,0,0|3,0,0]=4 388 B11R1.17 [13CH3]NCCc1ccccc1O 34a_100011207237_200025704644 [1,0,0,0,0,0|2,0,1]=4 389 B11R1.17 [13CH3]SCCc1ccccc1O 62a_100000722297_200025704644 [1,0,0,0,0,0|2,0,1]=4 390 B11R1.17 [13CH3]SCCc1ccccc1O 62a_200025704644_100000722297 [1,0,0,0,0,0|2,0,1]=4 391 B11R1.222 CC(O[13CH3])c1ccccc1Br 34a_100000702211_200025704644 [1,0,0,0,0,0|2,0,1]=4 392 B11R1.222 CC(O[13CH3])c1ccccc1Br 7a_100000702211_200025704644 [1,0,0,0,0,0|2,0,1]=4 393 B11R1.222 CC(O[13CH3])c1ccccc1Cl 34a_100000740796_200025704644 [1,0,0,0,0,0|2,0,1]=4 394 B11R1.222 CC(O[13CH3])c1ccccc1Cl 7a_100000740796_200025704644 [1,0,0,0,0,0|2,0,1]=4 395 B11R1.222 CC(O[13CH3])c1ccccc1F 34a_100000697922_200025704644 [1,0,0,0,0,0|2,0,1]=4 396 B11R1.222 CC(O[13CH3])c1ccccc1F 7a_100000697922_200025704644 [1,0,0,0,0,0|2,0,1]=4 397 B11R1.222 CC(O[13CH3])c1ccccc1N 7a_100011405641_200025704644 [1,0,0,0,0,0|2,0,1]=4 398 B11R1.222 CCC(=O)c1ccccc1Br 1458a_100000188424_100000210202 [1,0,0,0,0,0|1,0,0]=2 399 B11R1.222 CCC(=O)c1ccccc1C 1458a_100000212026_100000210202 [1,0,0,0,0,0|1,0,0]=2 400 B11R1.222 CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210202 [1,0,0,0,0,0|1,0,0]=2 401 B11R1.222 CCC(=O)c1ccccc1F 1458a_100000188656_100000210202 [1,0,0,0,0,0|1,0,0]=2 402 B11R1.222 CCC(=O)c1ccccc1I 1458a_100000187884_100000210202 [1,0,0,0,0,0|1,0,0]=2 403 B11R1.222 CCC(=O)c1ccccc1O 1458a_100015234032_100000210202 [1,0,0,0,0,0|0,0,0]=1 404 B11R1.222 CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210202 [1,0,0,0,0,0|0,0,1]=2 405 B11R1.222 CCN(C)c1ccccc1Br 2230a_100020606079_100000210202 [1,0,0,0,0,0|3,0,0]=4 406 B11R1.222 CCN(C)c1ccccc1Br 2230a_114873767003_200000210301 [1,0,0,0,0,0|3,0,0]=4 407 B11R1.222 CCN(C)c1ccccc1Br 269982a_100020606079_100000204670 [1,0,0,0,0,0|3,0,0]=4 408 B11R1.222 CCN(C)c1ccccc1Br 269982a_114873767003_200000210301 [1,0,0,0,0,0|3,0,0]=4 409 B11R1.222 CCN(C)c1ccccc1Br 34a_100020606079_100000210202 [1,0,0,0,0,0|3,0,0]=4 410 B11R1.222 CCN(C)c1ccccc1Br 34a_114873767003_200000210301 [1,0,0,0,0,0|3,0,0]=4 411 B11R1.222 CCN(C)c1ccccc1C 2230a_100000211084_200000210301 [1,0,0,0,0,0|3,0,0]=4 412 B11R1.222 CCN(C)c1ccccc1C 2230a_100000219699_100000210202 [1,0,0,0,0,0|3,0,0]=4 413 B11R1.222 CCN(C)c1ccccc1C 269982a_100000211084_200000210301 [1,0,0,0,0,0|3,0,0]=4 414 B11R1.222 CCN(C)c1ccccc1C 269982a_100000219699_100000204670 [1,0,0,0,0,0|3,0,0]=4 415 B11R1.222 CCN(C)c1ccccc1C 34a_100000211084_200000210301 [1,0,0,0,0,0|3,0,0]=4 416 B11R1.222 CCN(C)c1ccccc1C 34a_100000219699_100000210202 [1,0,0,0,0,0|3,0,0]=4 417 B11R1.222 CCN(C)c1ccccc1Cl 2230a_100000219374_100000210202 [1,0,0,0,0,0|3,0,0]=4 418 B11R1.222 CCN(C)c1ccccc1Cl 269982a_100000219374_100000204670 [1,0,0,0,0,0|3,0,0]=4 419 B11R1.222 CCN(C)c1ccccc1Cl 34a_100000219374_100000210202 [1,0,0,0,0,0|3,0,0]=4 420 B11R1.222 CCN(C)c1ccccc1F 2230a_100000220357_100000210202 [1,0,0,0,0,0|3,0,0]=4 421 B11R1.222 CCN(C)c1ccccc1F 2230a_100000220365_200000210301 [1,0,0,0,0,0|3,0,0]=4 422 B11R1.222 CCN(C)c1ccccc1F 269982a_100000220357_100000204670 [1,0,0,0,0,0|3,0,0]=4 423 B11R1.222 CCN(C)c1ccccc1F 269982a_100000220365_200000210301 [1,0,0,0,0,0|3,0,0]=4 424 B11R1.222 CCN(C)c1ccccc1F 34a_100000220357_100000210202 [1,0,0,0,0,0|3,0,0]=4 425 B11R1.222 CCN(C)c1ccccc1F 34a_100000220365_200000210301 [1,0,0,0,0,0|3,0,0]=4 426 B11R1.222 CCN(C)c1ccccc1F 38a_100000220357_100000204670 [1,0,0,0,0,0|3,0,0]=4 427 B11R1.222 CCN(C)c1ccccc1O 269982a_100000033821_100000204670 [1,0,0,0,0,0|2,0,0]=3 428 B11R1.222 CCN(C)c1ccccc1O 269982a_103624766699_200000210301 [1,0,0,0,0,0|2,0,0]=3 429 B11R1.222 CCN([13CH3])c1ccccc1Br 2230a_114873767003_200025704644 [1,0,0,0,0,0|3,0,0]=4 430 B11R1.222 CCN([13CH3])c1ccccc1Br 269982a_114873767003_200025704644 [1,0,0,0,0,0|3,0,0]=4 431 B11R1.222 CCN([13CH3])c1ccccc1Br 34a_114873767003_200025704644 [1,0,0,0,0,0|3,0,0]=4 432 B11R1.222 CCN([13CH3])c1ccccc1C 2230a_100000211084_200025704644 [1,0,0,0,0,0|3,0,0]=4 433 B11R1.222 CCN([13CH3])c1ccccc1C 269982a_100000211084_200025704644 [1,0,0,0,0,0|3,0,0]=4 434 B11R1.222 CCN([13CH3])c1ccccc1C 34a_100000211084_200025704644 [1,0,0,0,0,0|3,0,0]=4 435 B11R1.222 CCN([13CH3])c1ccccc1F 2230a_100000220365_200025704644 [1,0,0,0,0,0|3,0,0]=4 436 B11R1.222 CCN([13CH3])c1ccccc1F 269982a_100000220365_200025704644 [1,0,0,0,0,0|3,0,0]=4 437 B11R1.222 CCN([13CH3])c1ccccc1F 34a_100000220365_200025704644 [1,0,0,0,0,0|3,0,0]=4 438 B11R1.222 CCN([13CH3])c1ccccc1O 269982a_103624766699_200025704644 [1,0,0,0,0,0|2,0,0]=3 439 B11R1.222 CN(CF)c1ccccc1O 269982a_100000033821_100015361967 [1,0,0,0,0,0|3,0,0]=4 440 B11R1.222 CNC(=O)c1ccccc1Br 11a_106832991635_100000188424 [1,0,0,0,0,0|2,0,0]=3 441 B11R1.222 CNC(=O)c1ccccc1Br 1626a_100102657272_100000188424 [1,0,0,0,0,0|2,0,0]=3 442 B11R1.222 CNC(=O)c1ccccc1Br 240690a_100102657272_100000188424 [1,0,0,0,0,0|2,0,0]=3 443 B11R1.222 CNC(=O)c1ccccc1Br 527a_100102657272_100000188424 [1,0,0,0,0,0|2,0,0]=3 444 B11R1.222 CNC(=O)c1ccccc1C 11a_106832991635_100000212026 [1,0,0,0,0,0|2,0,0]=3 445 B11R1.222 CNC(=O)c1ccccc1C 1626a_100102657272_100000212026 [1,0,0,0,0,0|2,0,0]=3 446 B11R1.222 CNC(=O)c1ccccc1C 240690a_100102657272_100000212026 [1,0,0,0,0,0|2,0,0]=3 447 B11R1.222 CNC(=O)c1ccccc1C 527a_100102657272_100000212026 [1,0,0,0,0,0|2,0,0]=3 448 B11R1.222 CNC(=O)c1ccccc1Cl 11a_106832991635_100000185844 [1,0,0,0,0,0|2,0,0]=3 449 B11R1.222 CNC(=O)c1ccccc1Cl 1626a_100102657272_100000185844 [1,0,0,0,0,0|2,0,0]=3 450 B11R1.222 CNC(=O)c1ccccc1Cl 240690a_100102657272_100000185844 [1,0,0,0,0,0|2,0,0]=3 451 B11R1.222 CNC(=O)c1ccccc1Cl 527a_100102657272_100000185844 [1,0,0,0,0,0|2,0,0]=3 452 B11R1.222 CNC(=O)c1ccccc1F 11a_106832991635_100000188656 [1,0,0,0,0,0|2,0,0]=3 453 B11R1.222 CNC(=O)c1ccccc1F 1626a_100102657272_100000188656 [1,0,0,0,0,0|2,0,0]=3 454 B11R1.222 CNC(=O)c1ccccc1F 240690a_100102657272_100000188656 [1,0,0,0,0,0|2,0,0]=3 455 B11R1.222 CNC(=O)c1ccccc1F 527a_100102657272_100000188656 [1,0,0,0,0,0|2,0,0]=3 456 B11R1.222 CNC(=O)c1ccccc1I 11a_106832991635_100000187884 [1,0,0,0,0,0|2,0,0]=3 457 B11R1.222 CNC(=O)c1ccccc1I 1626a_100102657272_100000187884 [1,0,0,0,0,0|2,0,0]=3 458 B11R1.222 CNC(=O)c1ccccc1I 240690a_100102657272_100000187884 [1,0,0,0,0,0|2,0,0]=3 459 B11R1.222 CNC(=O)c1ccccc1I 527a_100102657272_100000187884 [1,0,0,0,0,0|2,0,0]=3 460 B11R1.222 CNC(=O)c1ccccc1O 240690a_100102657272_100015234032 [1,0,0,0,0,0|1,0,0]=2 461 B11R1.222 CNC(=O)c1ccccc1O 271570a_203496583355_100000155073 [1,0,0,0,0,0|1,0,0]=2 462 B11R1.222 CNC(=O)c1ccccc1[O-] 1626a_100102657272_100009911694 [1,0,0,0,0,0|1,0,1]=3 463 B11R1.222 CNC(=O)c1ccccc1[O-] 240690a_100102657272_100009911694 [1,0,0,0,0,0|1,0,1]=3 464 B11R1.222 CNC(=O)c1ccccc1[O-] 527a_100102657272_100009911694 [1,0,0,0,0,0|1,0,1]=3 465 B11R1.222 CNC(=O)c1cccnc1O 271570a_203496583355_100000159833 [1,0,0,0,0,0|2,0,0]=3 466 B11R1.222 CNC(C)c1ccccc1O 271570a_203496583355_100000692418 [1,0,0,0,0,0|2,0,1]=4 467 B11R1.222 CN[C@H](C)c1ccccc1O 2230a_100025703389_200000210301 [1,0,0,0,0,0|2,0,1]=4 468 B11R1.222 COC(=O)c1ccccc1O 271570a_203496583355_100000148710 [1,0,0,0,0,0|0,0,0]=1 469 B11R1.222 COC(=O)c1cccnc1O 271570a_203496583355_100000150852 [1,0,0,0,0,0|1,0,0]=2 470 B11R1.222 COC(=O)c1ccncc1O 271570a_203496583355_100010008606 [1,0,0,0,0,0|1,0,0]=2 471 B11R1.222 COC(=O)c1cnccc1O 271570a_203496583355_100020629055 [1,0,0,0,0,0|1,0,0]=2 472 B11R1.222 COC(=O)c1cncnc1O 271570a_203496583355_100000726419 [1,0,0,0,0,0|2,0,0]=3 473 B11R1.222 COC(=O)c1ncccc1O 271570a_203496583355_100011935214 [1,0,0,0,0,0|1,0,0]=2 474 B11R1.222 COC(=O)c1nccnc1O 271570a_203496583355_100000688410 [1,0,0,0,0,0|2,0,0]=3 475 B11R1.222 COC(=O)c1ncncc1O 271570a_203496583355_100012360100 [1,0,0,0,0,0|2,0,0]=3 476 B11R1.222 COC(C)c1ccccc1Br 34a_100000702211_200000210301 [1,0,0,0,0,0|2,0,1]=4 477 B11R1.222 COC(C)c1ccccc1Br 7a_100000702211_200000210301 [1,0,0,0,0,0|2,0,1]=4 478 B11R1.222 COC(C)c1ccccc1C 34a_100000742021_200000210301 [1,0,0,0,0,0|2,0,1]=4 479 B11R1.222 COC(C)c1ccccc1C 7a_100000742021_200000210301 [1,0,0,0,0,0|2,0,1]=4 480 B11R1.222 COC(C)c1ccccc1Cl 34a_100000740796_200000210301 [1,0,0,0,0,0|2,0,1]=4 481 B11R1.222 COC(C)c1ccccc1Cl 7a_100000740796_200000210301 [1,0,0,0,0,0|2,0,1]=4 482 B11R1.222 COC(C)c1ccccc1F 34a_100000697922_200000210301 [1,0,0,0,0,0|2,0,1]=4 483 B11R1.222 COC(C)c1ccccc1F 34a_100138415774_200000741388 [1,0,0,0,0,0|2,0,1]=4 484 B11R1.222 COC(C)c1ccccc1F 7a_100000697922_200000210301 [1,0,0,0,0,0|2,0,1]=4 485 B11R1.222 COC(C)c1ccccc1N 7a_100011405641_200000210301 [1,0,0,0,0,0|2,0,1]=4 486 B11R1.222 CO[C@@H](C)c1ncccc1O 271570a_203496583355_106256553109 [1,0,0,0,0,0|2,0,1]=4 487 B11R1.222 C[C@@H](N[13CH3])c1ccccc1O 2230a_100025703389_200025704644 [1,0,0,0,0,0|2,0,1]=4 488 B11R1.222 Cc1ccccc1C(=O)CF 1458a_100000212026_100015361967 [1,0,0,0,0,0|2,0,0]=3 489 B11R1.222 Cc1ccccc1C(C)O[13CH3] 34a_100000742021_200025704644 [1,0,0,0,0,0|2,0,1]=4 490 B11R1.222 Cc1ccccc1C(C)O[13CH3] 7a_100000742021_200025704644 [1,0,0,0,0,0|2,0,1]=4 491 B11R1.222 NCC(O)c1ccccc1O 271570a_203496583355_100011236429 [1,0,0,0,0,0|1,0,2]=4 492 B11R1.222 NNC(=O)c1ccccc1O 271570a_203496583355_100000190081 [1,0,0,0,0,0|2,0,0]=3 493 B11R1.222 N[C@H](CO)c1ccccc1O 271570a_203496583355_100161155918 [1,0,0,0,0,0|2,0,1]=4 494 B11R1.222 O=C(CF)c1ccccc1Br 1458a_100000188424_100015361967 [1,0,0,0,0,0|2,0,0]=3 495 B11R1.222 O=C(CF)c1ccccc1Cl 1458a_100000185844_100015361967 [1,0,0,0,0,0|2,0,0]=3 496 B11R1.222 O=C(CF)c1ccccc1F 1458a_100000188656_100015361967 [1,0,0,0,0,0|2,0,0]=3 497 B11R1.222 O=C(CF)c1ccccc1I 1458a_100000187884_100015361967 [1,0,0,0,0,0|2,0,0]=3 498 B11R1.222 O=C(CF)c1ccccc1O 1458a_100015234032_100015361967 [1,0,0,0,0,0|1,0,0]=2 499 B11R1.222 O=C(CF)c1ccccc1[O-] 1458a_100009911694_100015361967 [1,0,0,0,0,0|1,0,1]=3 500 B13R1.12 C#CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000184674 [0,1,0,0,0,0|1,0,2]=4 501 B13R1.12 C#CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000184674 [0,1,0,0,0,0|1,0,2]=4 502 B13R1.12 C#CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000184674 [0,1,0,0,0,0|1,0,2]=4 503 B13R1.12 C#CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000184674 [0,1,0,0,0,0|1,0,2]=4 504 B13R1.12 C#CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000184674 [0,1,0,0,0,0|1,0,2]=4 505 B13R1.12 C=CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210623 [0,1,0,0,0,0|1,0,2]=4 506 B13R1.12 C=CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210623 [0,1,0,0,0,0|1,0,2]=4 507 B13R1.12 C=CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210623 [0,1,0,0,0,0|1,0,2]=4 508 B13R1.12 C=CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210623 [0,1,0,0,0,0|1,0,2]=4 509 B13R1.12 C=CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210623 [0,1,0,0,0,0|1,0,2]=4 510 B13R1.12 CCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210303 [0,1,0,0,0,0|2,0,0]=3 511 B13R1.12 CCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210303 [0,1,0,0,0,0|2,0,0]=3 512 B13R1.12 CCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210303 [0,1,0,0,0,0|2,0,0]=3 513 B13R1.12 CCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210303 [0,1,0,0,0,0|2,0,0]=3 514 B13R1.12 CCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210303 [0,1,0,0,0,0|2,0,0]=3 515 B13R1.12 CCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210303 [0,1,0,0,0,0|2,0,0]=3 516 B13R1.12 CCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210303 [0,1,0,0,0,0|2,0,0]=3 517 B13R1.12 CCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210303 [0,1,0,0,0,0|2,0,0]=3 518 B13R1.12 CCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210303 [0,1,0,0,0,0|2,0,0]=3 519 B13R1.12 CCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210303 [0,1,0,0,0,0|2,0,0]=3 520 B13R1.12 CCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210303 [0,1,0,0,0,0|2,0,0]=3 521 B13R1.12 CCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210303 [0,1,0,0,0,0|2,0,0]=3 522 B13R1.12 CCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210303 [0,1,0,0,0,0|2,0,0]=3 523 B13R1.12 CCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210303 [0,1,0,0,0,0|2,0,0]=3 524 B13R1.12 CCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210303 [0,1,0,0,0,0|2,0,0]=3 525 B13R1.12 CCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210303 [0,1,0,0,0,0|2,0,0]=3 526 B13R1.12 CCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210303 [0,1,0,0,0,0|2,0,0]=3 527 B13R1.12 CCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210303 [0,1,0,0,0,0|2,0,0]=3 528 B13R1.12 CCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210303 [0,1,0,0,0,0|2,0,0]=3 529 B13R1.12 CCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210303 [0,1,0,0,0,0|2,0,0]=3 530 B13R1.12 CCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210303 [0,1,0,0,0,0|2,0,0]=3 531 B13R1.12 CCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210303 [0,1,0,0,0,0|2,0,0]=3 532 B13R1.12 CCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210303 [0,1,0,0,0,0|2,0,0]=3 533 B13R1.12 CCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210303 [0,1,0,0,0,0|2,0,0]=3 534 B13R1.12 CCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210303 [0,1,0,0,0,0|2,0,0]=3 535 B13R1.12 CCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210303 [0,1,0,0,0,0|2,0,0]=3 536 B13R1.12 CCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210303 [0,1,0,0,0,0|2,0,0]=3 537 B13R1.12 CCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210303 [0,1,0,0,0,0|2,0,0]=3 538 B13R1.12 CCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210303 [0,1,0,0,0,0|2,0,0]=3 539 B13R1.12 CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210303 [0,1,0,0,0,0|1,0,0]=2 540 B13R1.12 CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210303 [0,1,0,0,0,0|1,0,0]=2 541 B13R1.12 CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210303 [0,1,0,0,0,0|1,0,0]=2 542 B13R1.12 CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210303 [0,1,0,0,0,0|1,0,0]=2 543 B13R1.12 CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210303 [0,1,0,0,0,0|1,0,0]=2 544 B13R1.12 CCNC(=O)c1cccc(c1Br)Br 11a_100015525214_100012360534 [0,1,0,0,0,0|2,0,0]=3 545 B13R1.12 CCNC(=O)c1cccc(c1Br)Br 240690a_100015525214_100012360534 [0,1,0,0,0,0|2,0,0]=3 546 B13R1.12 CCNC(=O)c1cccc(c1Br)Br 527a_100015525214_100012360534 [0,1,0,0,0,0|2,0,0]=3 547 B13R1.12 CCNC(=O)c1cccc(c1Br)C 11a_100015525214_100000692419 [0,1,0,0,0,0|2,0,0]=3 548 B13R1.12 CCNC(=O)c1cccc(c1Br)C 240690a_100015525214_100000692419 [0,1,0,0,0,0|2,0,0]=3 549 B13R1.12 CCNC(=O)c1cccc(c1Br)C 527a_100015525214_100000692419 [0,1,0,0,0,0|2,0,0]=3 550 B13R1.12 CCNC(=O)c1cccc(c1Br)Cl 11a_100015525214_100012339722 [0,1,0,0,0,0|2,0,0]=3 551 B13R1.12 CCNC(=O)c1cccc(c1Br)Cl 240690a_100015525214_100012339722 [0,1,0,0,0,0|2,0,0]=3 552 B13R1.12 CCNC(=O)c1cccc(c1Br)Cl 527a_100015525214_100012339722 [0,1,0,0,0,0|2,0,0]=3 553 B13R1.12 CCNC(=O)c1cccc(c1Br)F 11a_100015525214_100011217547 [0,1,0,0,0,0|2,0,0]=3 554 B13R1.12 CCNC(=O)c1cccc(c1Br)F 240690a_100015525214_100011217547 [0,1,0,0,0,0|2,0,0]=3 555 B13R1.12 CCNC(=O)c1cccc(c1Br)F 527a_100015525214_100011217547 [0,1,0,0,0,0|2,0,0]=3 556 B13R1.12 CCNC(=O)c1cccc(c1Br)I 11a_100015525214_100010232522 [0,1,0,0,0,0|2,0,0]=3 557 B13R1.12 CCNC(=O)c1cccc(c1Br)I 240690a_100015525214_100010232522 [0,1,0,0,0,0|2,0,0]=3 558 B13R1.12 CCNC(=O)c1cccc(c1Br)I 527a_100015525214_100010232522 [0,1,0,0,0,0|2,0,0]=3 559 B13R1.12 CCNC(=O)c1cccc(c1Br)O 240690a_100015525214_100010230362 [0,1,0,0,0,0|2,0,0]=3 560 B13R1.12 CCNC(=O)c1cccc(c1Br)O 527a_100015525214_100010230362 [0,1,0,0,0,0|2,0,0]=3 561 B13R1.12 CCNC(=O)c1cccc(c1C)Br 11a_100015525214_100000760464 [0,1,0,0,0,0|2,0,0]=3 562 B13R1.12 CCNC(=O)c1cccc(c1C)Br 240690a_100015525214_100000760464 [0,1,0,0,0,0|2,0,0]=3 563 B13R1.12 CCNC(=O)c1cccc(c1C)Br 527a_100015525214_100000760464 [0,1,0,0,0,0|2,0,0]=3 564 B13R1.12 CCNC(=O)c1cccc(c1C)C 11a_100015525214_100000183679 [0,1,0,0,0,0|2,0,0]=3 565 B13R1.12 CCNC(=O)c1cccc(c1C)C 240690a_100015525214_100000183679 [0,1,0,0,0,0|2,0,0]=3 566 B13R1.12 CCNC(=O)c1cccc(c1C)C 527a_100015525214_100000183679 [0,1,0,0,0,0|2,0,0]=3 567 B13R1.12 CCNC(=O)c1cccc(c1C)Cl 11a_100015525214_100000690184 [0,1,0,0,0,0|2,0,0]=3 568 B13R1.12 CCNC(=O)c1cccc(c1C)Cl 240690a_100015525214_100000690184 [0,1,0,0,0,0|2,0,0]=3 569 B13R1.12 CCNC(=O)c1cccc(c1C)Cl 527a_100015525214_100000690184 [0,1,0,0,0,0|2,0,0]=3 570 B13R1.12 CCNC(=O)c1cccc(c1C)F 11a_100015525214_100011218272 [0,1,0,0,0,0|2,0,0]=3 571 B13R1.12 CCNC(=O)c1cccc(c1C)F 240690a_100015525214_100011218272 [0,1,0,0,0,0|2,0,0]=3 572 B13R1.12 CCNC(=O)c1cccc(c1C)F 527a_100015525214_100011218272 [0,1,0,0,0,0|2,0,0]=3 573 B13R1.12 CCNC(=O)c1cccc(c1C)I 11a_100015525214_100000751865 [0,1,0,0,0,0|2,0,0]=3 574 B13R1.12 CCNC(=O)c1cccc(c1C)I 240690a_100015525214_100000751865 [0,1,0,0,0,0|2,0,0]=3 575 B13R1.12 CCNC(=O)c1cccc(c1C)I 527a_100015525214_100000751865 [0,1,0,0,0,0|2,0,0]=3 576 B13R1.12 CCNC(=O)c1cccc(c1C)O 240690a_100015525214_100000766327 [0,1,0,0,0,0|2,0,0]=3 577 B13R1.12 CCNC(=O)c1cccc(c1C)O 527a_100015525214_100000766327 [0,1,0,0,0,0|2,0,0]=3 578 B13R1.12 CCNC(=O)c1cccc(c1Cl)Br 11a_100015525214_100000760540 [0,1,0,0,0,0|2,0,0]=3 579 B13R1.12 CCNC(=O)c1cccc(c1Cl)Br 240690a_100015525214_100000760540 [0,1,0,0,0,0|2,0,0]=3 580 B13R1.12 CCNC(=O)c1cccc(c1Cl)Br 527a_100015525214_100000760540 [0,1,0,0,0,0|2,0,0]=3 581 B13R1.12 CCNC(=O)c1cccc(c1Cl)C 11a_100015525214_100000693142 [0,1,0,0,0,0|2,0,0]=3 582 B13R1.12 CCNC(=O)c1cccc(c1Cl)C 240690a_100015525214_100000693142 [0,1,0,0,0,0|2,0,0]=3 583 B13R1.12 CCNC(=O)c1cccc(c1Cl)C 527a_100015525214_100000693142 [0,1,0,0,0,0|2,0,0]=3 584 B13R1.12 CCNC(=O)c1cccc(c1Cl)Cl 11a_100015525214_100000183631 [0,1,0,0,0,0|2,0,0]=3 585 B13R1.12 CCNC(=O)c1cccc(c1Cl)Cl 240690a_100015525214_100000183631 [0,1,0,0,0,0|2,0,0]=3 586 B13R1.12 CCNC(=O)c1cccc(c1Cl)Cl 527a_100015525214_100000183631 [0,1,0,0,0,0|2,0,0]=3 587 B13R1.12 CCNC(=O)c1cccc(c1Cl)F 11a_100015525214_100000759904 [0,1,0,0,0,0|2,0,0]=3 588 B13R1.12 CCNC(=O)c1cccc(c1Cl)F 240690a_100015525214_100000759904 [0,1,0,0,0,0|2,0,0]=3 589 B13R1.12 CCNC(=O)c1cccc(c1Cl)F 527a_100015525214_100000759904 [0,1,0,0,0,0|2,0,0]=3 590 B13R1.12 CCNC(=O)c1cccc(c1Cl)I 11a_100015525214_100010176783 [0,1,0,0,0,0|2,0,0]=3 591 B13R1.12 CCNC(=O)c1cccc(c1Cl)I 240690a_100015525214_100010176783 [0,1,0,0,0,0|2,0,0]=3 592 B13R1.12 CCNC(=O)c1cccc(c1Cl)I 527a_100015525214_100010176783 [0,1,0,0,0,0|2,0,0]=3 593 B13R1.12 CCNC(=O)c1cccc(c1Cl)O 240690a_100015525214_100000092362 [0,1,0,0,0,0|2,0,0]=3 594 B13R1.12 CCNC(=O)c1cccc(c1Cl)O 527a_100015525214_100000092362 [0,1,0,0,0,0|2,0,0]=3 595 B13R1.12 CCNC(=O)c1cccc(c1F)Br 11a_100015525214_100000756403 [0,1,0,0,0,0|2,0,0]=3 596 B13R1.12 CCNC(=O)c1cccc(c1F)Br 240690a_100015525214_100000756403 [0,1,0,0,0,0|2,0,0]=3 597 B13R1.12 CCNC(=O)c1cccc(c1F)Br 527a_100015525214_100000756403 [0,1,0,0,0,0|2,0,0]=3 598 B13R1.12 CCNC(=O)c1cccc(c1F)C 11a_100015525214_100000766181 [0,1,0,0,0,0|2,0,0]=3 599 B13R1.12 CCNC(=O)c1cccc(c1F)C 240690a_100015525214_100000766181 [0,1,0,0,0,0|2,0,0]=3 600 B13R1.12 CCNC(=O)c1cccc(c1F)C 527a_100015525214_100000766181 [0,1,0,0,0,0|2,0,0]=3 601 B13R1.12 CCNC(=O)c1cccc(c1F)Cl 11a_100015525214_100000688816 [0,1,0,0,0,0|2,0,0]=3 602 B13R1.12 CCNC(=O)c1cccc(c1F)Cl 240690a_100015525214_100000688816 [0,1,0,0,0,0|2,0,0]=3 603 B13R1.12 CCNC(=O)c1cccc(c1F)Cl 527a_100015525214_100000688816 [0,1,0,0,0,0|2,0,0]=3 604 B13R1.12 CCNC(=O)c1cccc(c1F)F 11a_100015525214_100000748134 [0,1,0,0,0,0|2,0,0]=3 605 B13R1.12 CCNC(=O)c1cccc(c1F)F 240690a_100015525214_100000748134 [0,1,0,0,0,0|2,0,0]=3 606 B13R1.12 CCNC(=O)c1cccc(c1F)F 527a_100015525214_100000748134 [0,1,0,0,0,0|2,0,0]=3 607 B13R1.12 CCNC(=O)c1cccc(c1F)I 11a_100015525214_100010185205 [0,1,0,0,0,0|2,0,0]=3 608 B13R1.12 CCNC(=O)c1cccc(c1F)I 240690a_100015525214_100010185205 [0,1,0,0,0,0|2,0,0]=3 609 B13R1.12 CCNC(=O)c1cccc(c1F)I 527a_100015525214_100010185205 [0,1,0,0,0,0|2,0,0]=3 610 B13R1.12 CCNC(=O)c1cccc(c1F)O 240690a_100015525214_100000037433 [0,1,0,0,0,0|2,0,0]=3 611 B13R1.12 CCNC(=O)c1cccc(c1F)O 527a_100015525214_100000037433 [0,1,0,0,0,0|2,0,0]=3 612 B13R1.12 CCNC(=O)c1cccc(c1I)Br 11a_100015525214_100000688019 [0,1,0,0,0,0|2,0,0]=3 613 B13R1.12 CCNC(=O)c1cccc(c1I)Br 240690a_100015525214_100000688019 [0,1,0,0,0,0|2,0,0]=3 614 B13R1.12 CCNC(=O)c1cccc(c1I)Br 527a_100015525214_100000688019 [0,1,0,0,0,0|2,0,0]=3 615 B13R1.12 CCNC(=O)c1cccc(c1I)C 11a_100015525214_100000739377 [0,1,0,0,0,0|2,0,0]=3 616 B13R1.12 CCNC(=O)c1cccc(c1I)C 240690a_100015525214_100000739377 [0,1,0,0,0,0|2,0,0]=3 617 B13R1.12 CCNC(=O)c1cccc(c1I)C 527a_100015525214_100000739377 [0,1,0,0,0,0|2,0,0]=3 618 B13R1.12 CCNC(=O)c1cccc(c1I)Cl 11a_100015525214_100010176784 [0,1,0,0,0,0|2,0,0]=3 619 B13R1.12 CCNC(=O)c1cccc(c1I)Cl 240690a_100015525214_100010176784 [0,1,0,0,0,0|2,0,0]=3 620 B13R1.12 CCNC(=O)c1cccc(c1I)Cl 527a_100015525214_100010176784 [0,1,0,0,0,0|2,0,0]=3 621 B13R1.12 CCNC(=O)c1cccc(c1I)F 11a_100015525214_100000690930 [0,1,0,0,0,0|2,0,0]=3 622 B13R1.12 CCNC(=O)c1cccc(c1I)F 240690a_100015525214_100000690930 [0,1,0,0,0,0|2,0,0]=3 623 B13R1.12 CCNC(=O)c1cccc(c1I)F 527a_100015525214_100000690930 [0,1,0,0,0,0|2,0,0]=3 624 B13R1.12 CCNC(=O)c1cccc(c1I)O 527a_100015525214_100010084636 [0,1,0,0,0,0|2,0,0]=3 625 B13R1.12 CCNC(=O)c1cccc(c1O)Br 240690a_100015525214_100000752940 [0,1,0,0,0,0|1,0,0]=2 626 B13R1.12 CCNC(=O)c1cccc(c1O)Br 527a_100015525214_100000752940 [0,1,0,0,0,0|1,0,0]=2 627 B13R1.12 CCNC(=O)c1cccc(c1O)C 240690a_100015525214_100000183896 [0,1,0,0,0,0|1,0,0]=2 628 B13R1.12 CCNC(=O)c1cccc(c1O)C 527a_100015525214_100000183896 [0,1,0,0,0,0|1,0,0]=2 629 B13R1.12 CCNC(=O)c1cccc(c1O)Cl 240690a_100015525214_100000742801 [0,1,0,0,0,0|1,0,0]=2 630 B13R1.12 CCNC(=O)c1cccc(c1O)Cl 527a_100015525214_100000742801 [0,1,0,0,0,0|1,0,0]=2 631 B13R1.12 CCNC(=O)c1cccc(c1O)F 240690a_100015525214_100011217230 [0,1,0,0,0,0|1,0,0]=2 632 B13R1.12 CCNC(=O)c1cccc(c1O)F 527a_100015525214_100011217230 [0,1,0,0,0,0|1,0,0]=2 633 B13R1.12 CCNC(=O)c1cccc(c1O)O 527a_100015525214_100000690420 [0,1,0,0,0,0|1,0,0]=2 634 B13R1.12 CCNC(C)c1cccc(c1O)Br 269862a_100015525214_100009815558 [0,1,0,0,0,0|2,0,1]=4 635 B13R1.12 CCNC(C)c1cccc(c1O)C 269862a_100015525214_100009847209 [0,1,0,0,0,0|2,0,1]=4 636 B13R1.12 CCNC(C)c1cccc(c1O)Cl 269862a_100015525214_100000043392 [0,1,0,0,0,0|2,0,1]=4 637 B13R1.12 CCNC(C)c1cccc(c1O)F 269862a_100015525214_100011246037 [0,1,0,0,0,0|2,0,1]=4 638 B13R1.12 CCOC(=O)c1cccc(c1C)O 271570a_203496583355_100012298221 [0,1,0,0,0,0|1,0,0]=2 639 B13R1.12 CCOC(=O)c1cccc(c1F)O 271570a_203496583355_100012350793 [0,1,0,0,0,0|1,0,0]=2 640 B13R1.12 CCOC(=O)c1cccc(c1N)O 271570a_203496583355_200011356557 [0,1,0,0,0,0|1,0,0]=2 641 B13R1.12 CCOC(=O)c1cccc(c1O)C 271570a_203496583355_200012184857 [0,1,0,0,0,0|0,0,0]=1 642 B13R1.12 CCOC(=O)c1cccc(c1O)F 271570a_203496583355_100012357632 [0,1,0,0,0,0|0,0,0]=1 643 B13R1.12 CCOC(=O)c1ccnc(c1C)O 271570a_203496583355_100000080207 [0,1,0,0,0,0|2,0,0]=3 644 B13R1.12 CCOC(=O)c1cncc(c1C)O 271570a_203496583355_100000726969 [0,1,0,0,0,0|2,0,0]=3 645 B13R1.12 CCOC(=O)c1cncc(c1N)O 271570a_203496583355_100010080842 [0,1,0,0,0,0|2,0,0]=3 646 B13R1.12 CCOC(=O)c1nccc(c1F)O 271570a_203496583355_100010222487 [0,1,0,0,0,0|2,0,0]=3 647 B13R1.12 CCOC(C)c1cccc(c1C)C 34a_100121572206_100012183177 [0,1,0,0,0,0|2,0,1]=4 648 B13R1.12 CCOC(C)c1cccc(c1F)Br 34a_200012356376_100000210202 [0,1,0,0,0,0|2,0,1]=4 649 B13R1.12 CCOC(C)c1cccc(c1F)Br 7a_200012356376_100000210202 [0,1,0,0,0,0|2,0,1]=4 650 B13R1.12 CCOC(C)c1cccc(c1F)F 34a_100011944069_100000210202 [0,1,0,0,0,0|2,0,1]=4 651 B13R1.12 CCOC(C)c1cccc(c1F)F 7a_100011944069_100000210202 [0,1,0,0,0,0|2,0,1]=4 652 B13R1.12 CNCC(=O)c1cccc(c1C)I 34a_100102657272_100160470822 [0,1,0,0,0,0|3,0,0]=4 653 B13R1.12 CNCC(=O)c1cccc(c1C)I 7a_106832991635_100160470822 [0,1,0,0,0,0|3,0,0]=4 654 B13R1.12 CNCC(=O)c1cccc(c1F)Br 2230a_106832991635_100012356374 [0,1,0,0,0,0|3,0,0]=4 655 B13R1.12 CNCC(=O)c1cccc(c1F)Br 34a_100102657272_100012356374 [0,1,0,0,0,0|3,0,0]=4 656 B13R1.12 CNCC(=O)c1cccc(c1F)Br 7a_106832991635_100012356374 [0,1,0,0,0,0|3,0,0]=4 657 B13R1.12 CNCC(=O)c1cccc(c1F)Cl 2230a_106832991635_200012351890 [0,1,0,0,0,0|3,0,0]=4 658 B13R1.12 CNCC(=O)c1cccc(c1F)Cl 34a_100102657272_200012351890 [0,1,0,0,0,0|3,0,0]=4 659 B13R1.12 CNCC(=O)c1cccc(c1F)Cl 7a_106832991635_200012351890 [0,1,0,0,0,0|3,0,0]=4 660 B13R1.12 CNNC(=O)c1cccc(c1Br)Br 22a_100016993582_100012360534 [0,1,0,0,0,0|3,0,0]=4 661 B13R1.12 CNNC(=O)c1cccc(c1Br)C 22a_100016993582_100000692419 [0,1,0,0,0,0|3,0,0]=4 662 B13R1.12 CNNC(=O)c1cccc(c1Br)Cl 22a_100016993582_100012339722 [0,1,0,0,0,0|3,0,0]=4 663 B13R1.12 CNNC(=O)c1cccc(c1Br)F 22a_100016993582_100011217547 [0,1,0,0,0,0|3,0,0]=4 664 B13R1.12 CNNC(=O)c1cccc(c1Br)I 22a_100016993582_100010232522 [0,1,0,0,0,0|3,0,0]=4 665 B13R1.12 CNNC(=O)c1cccc(c1Br)O 22a_100016993582_100010230362 [0,1,0,0,0,0|3,0,0]=4 666 B13R1.12 CNNC(=O)c1cccc(c1C)Br 22a_100016993582_100000760464 [0,1,0,0,0,0|3,0,0]=4 667 B13R1.12 CNNC(=O)c1cccc(c1C)C 22a_100016993582_100000183679 [0,1,0,0,0,0|3,0,0]=4 668 B13R1.12 CNNC(=O)c1cccc(c1C)Cl 22a_100016993582_100000690184 [0,1,0,0,0,0|3,0,0]=4 669 B13R1.12 CNNC(=O)c1cccc(c1C)F 22a_100016993582_100011218272 [0,1,0,0,0,0|3,0,0]=4 670 B13R1.12 CNNC(=O)c1cccc(c1C)I 22a_100016993582_100000751865 [0,1,0,0,0,0|3,0,0]=4 671 B13R1.12 CNNC(=O)c1cccc(c1C)O 22a_100016993582_100000766327 [0,1,0,0,0,0|3,0,0]=4 672 B13R1.12 CNNC(=O)c1cccc(c1Cl)Br 22a_100016993582_100000760540 [0,1,0,0,0,0|3,0,0]=4 673 B13R1.12 CNNC(=O)c1cccc(c1Cl)C 22a_100016993582_100000693142 [0,1,0,0,0,0|3,0,0]=4 674 B13R1.12 CNNC(=O)c1cccc(c1Cl)Cl 22a_100016993582_100000183631 [0,1,0,0,0,0|3,0,0]=4 675 B13R1.12 CNNC(=O)c1cccc(c1Cl)F 22a_100016993582_100000759904 [0,1,0,0,0,0|3,0,0]=4 676 B13R1.12 CNNC(=O)c1cccc(c1Cl)I 22a_100016993582_100010176783 [0,1,0,0,0,0|3,0,0]=4 677 B13R1.12 CNNC(=O)c1cccc(c1Cl)O 22a_100016993582_100000092362 [0,1,0,0,0,0|3,0,0]=4 678 B13R1.12 CNNC(=O)c1cccc(c1F)Br 22a_100016993582_100000756403 [0,1,0,0,0,0|3,0,0]=4 679 B13R1.12 CNNC(=O)c1cccc(c1F)C 22a_100016993582_100000766181 [0,1,0,0,0,0|3,0,0]=4 680 B13R1.12 CNNC(=O)c1cccc(c1F)Cl 22a_100016993582_100000688816 [0,1,0,0,0,0|3,0,0]=4 681 B13R1.12 CNNC(=O)c1cccc(c1F)F 22a_100016993582_100000748134 [0,1,0,0,0,0|3,0,0]=4 682 B13R1.12 CNNC(=O)c1cccc(c1F)I 22a_100016993582_100010185205 [0,1,0,0,0,0|3,0,0]=4 683 B13R1.12 CNNC(=O)c1cccc(c1F)O 22a_100016993582_100000037433 [0,1,0,0,0,0|3,0,0]=4 684 B13R1.12 CNNC(=O)c1cccc(c1I)Br 22a_100016993582_100000688019 [0,1,0,0,0,0|3,0,0]=4 685 B13R1.12 CNNC(=O)c1cccc(c1I)C 22a_100016993582_100000739377 [0,1,0,0,0,0|3,0,0]=4 686 B13R1.12 CNNC(=O)c1cccc(c1I)Cl 22a_100016993582_100010176784 [0,1,0,0,0,0|3,0,0]=4 687 B13R1.12 CNNC(=O)c1cccc(c1I)F 22a_100016993582_100000690930 [0,1,0,0,0,0|3,0,0]=4 688 B13R1.12 CNNC(=O)c1cccc(c1I)O 22a_100016993582_100010084636 [0,1,0,0,0,0|3,0,0]=4 689 B13R1.12 CNNC(=O)c1cccc(c1O)Br 22a_100016993582_100000752940 [0,1,0,0,0,0|2,0,0]=3 690 B13R1.12 CNNC(=O)c1cccc(c1O)C 22a_100016993582_100000183896 [0,1,0,0,0,0|2,0,0]=3 691 B13R1.12 CNNC(=O)c1cccc(c1O)Cl 22a_100016993582_100000742801 [0,1,0,0,0,0|2,0,0]=3 692 B13R1.12 CNNC(=O)c1cccc(c1O)F 22a_100016993582_100011217230 [0,1,0,0,0,0|2,0,0]=3 693 B13R1.12 CNNC(=O)c1cccc(c1O)O 22a_100016993582_100000690420 [0,1,0,0,0,0|2,0,0]=3 694 B13R1.12 COCC(=O)c1cccc(c1C)I 34a_100138415774_100160470822 [0,1,0,0,0,0|3,0,0]=4 695 B13R1.12 COCC(=O)c1cccc(c1F)Br 34a_100138415774_100012356374 [0,1,0,0,0,0|3,0,0]=4 696 B13R1.12 COCC(=O)c1cccc(c1F)Cl 34a_100138415774_200012351890 [0,1,0,0,0,0|3,0,0]=4 697 B13R1.12 CSCC(=O)c1cccc(c1C)I 62a_100160470822_200000210301 [0,1,0,0,0,0|3,0,0]=4 698 B13R1.12 CSCC(=O)c1cccc(c1C)I 62a_200000210301_100160470822 [0,1,0,0,0,0|3,0,0]=4 699 B13R1.12 CSCC(=O)c1cccc(c1F)Br 62a_100012356374_200000210301 [0,1,0,0,0,0|3,0,0]=4 700 B13R1.12 CSCC(=O)c1cccc(c1F)Br 62a_200000210301_100012356374 [0,1,0,0,0,0|3,0,0]=4 701 B13R1.12 CSCC(=O)c1cccc(c1F)Cl 62a_200000210301_200012351890 [0,1,0,0,0,0|3,0,0]=4 702 B13R1.12 CSCC(=O)c1cccc(c1F)Cl 62a_200012351890_200000210301 [0,1,0,0,0,0|3,0,0]=4 703 B13R1.12 Cc1c(cccc1C(=O)CCF)Br 1458a_100000760464_100011217306 [0,1,0,0,0,0|3,0,0]=4 704 B13R1.12 Cc1c(cccc1C(=O)CCF)Cl 1458a_100000690184_100011217306 [0,1,0,0,0,0|3,0,0]=4 705 B13R1.12 Cc1c(cccc1C(=O)CCF)F 1458a_100011218272_100011217306 [0,1,0,0,0,0|3,0,0]=4 706 B13R1.12 Cc1c(cccc1C(=O)CCF)I 1458a_100000751865_100011217306 [0,1,0,0,0,0|3,0,0]=4 707 B13R1.12 Cc1c(cccc1C(=O)CCF)O 1458a_100000766327_100011217306 [0,1,0,0,0,0|3,0,0]=4 708 B13R1.12 Cc1c(cccc1C(=O)CCO)Br 1458a_100000760464_100000211926 [0,1,0,0,0,0|3,0,0]=4 709 B13R1.12 Cc1c(cccc1C(=O)CCO)Cl 1458a_100000690184_100000211926 [0,1,0,0,0,0|3,0,0]=4 710 B13R1.12 Cc1c(cccc1C(=O)CCO)F 1458a_100011218272_100000211926 [0,1,0,0,0,0|3,0,0]=4 711 B13R1.12 Cc1c(cccc1C(=O)CCO)I 1458a_100000751865_100000211926 [0,1,0,0,0,0|3,0,0]=4 712 B13R1.12 Cc1c(cccc1C(=O)CCO)O 1458a_100000766327_100000211926 [0,1,0,0,0,0|3,0,0]=4 713 B13R1.12 Cc1c(cccc1C(=O)CS[13CH3])I 62a_100160470822_200025704644 [0,1,0,0,0,0|3,0,0]=4 714 B13R1.12 Cc1c(cccc1C(=O)CS[13CH3])I 62a_200025704644_100160470822 [0,1,0,0,0,0|3,0,0]=4 715 B13R1.12 Cc1cccc(c1Br)C(=O)CCF 1458a_100000692419_100011217306 [0,1,0,0,0,0|3,0,0]=4 716 B13R1.12 Cc1cccc(c1Br)C(=O)CCO 1458a_100000692419_100000211926 [0,1,0,0,0,0|3,0,0]=4 717 B13R1.12 Cc1cccc(c1C)C(=O)CCF 1458a_100000183679_100011217306 [0,1,0,0,0,0|3,0,0]=4 718 B13R1.12 Cc1cccc(c1C)C(=O)CCO 1458a_100000183679_100000211926 [0,1,0,0,0,0|3,0,0]=4 719 B13R1.12 Cc1cccc(c1Cl)C(=O)CCF 1458a_100000693142_100011217306 [0,1,0,0,0,0|3,0,0]=4 720 B13R1.12 Cc1cccc(c1Cl)C(=O)CCO 1458a_100000693142_100000211926 [0,1,0,0,0,0|3,0,0]=4 721 B13R1.12 Cc1cccc(c1F)C(=O)CCF 1458a_100000766181_100011217306 [0,1,0,0,0,0|3,0,0]=4 722 B13R1.12 Cc1cccc(c1F)C(=O)CCO 1458a_100000766181_100000211926 [0,1,0,0,0,0|3,0,0]=4 723 B13R1.12 Cc1cccc(c1I)C(=O)CCF 1458a_100000739377_100011217306 [0,1,0,0,0,0|3,0,0]=4 724 B13R1.12 Cc1cccc(c1I)C(=O)CCO 1458a_100000739377_100000211926 [0,1,0,0,0,0|3,0,0]=4 725 B13R1.12 Cc1cccc(c1O)C(=O)CC#N 1458a_100000183896_100011214920 [0,1,0,0,0,0|2,0,1]=4 726 B13R1.12 Cc1cccc(c1O)C(=O)CCF 1458a_100000183896_100011217306 [0,1,0,0,0,0|2,0,0]=3 727 B13R1.12 Cc1cccc(c1O)C(=O)CCO 1458a_100000183896_100000211926 [0,1,0,0,0,0|2,0,0]=3 728 B13R1.12 N#CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011214920 [0,1,0,0,0,0|2,0,1]=4 729 B13R1.12 N#CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011214920 [0,1,0,0,0,0|2,0,1]=4 730 B13R1.12 N#CCC(=O)c1cccc(c1O)F 1458a_100011217230_100011214920 [0,1,0,0,0,0|2,0,1]=4 731 B13R1.12 N#CCC(=O)c1cccc(c1O)O 1458a_100000690420_100011214920 [0,1,0,0,0,0|2,0,1]=4 732 B13R1.12 O=C(CCF)c1cccc(c1Br)Br 1458a_100012360534_100011217306 [0,1,0,0,0,0|3,0,0]=4 733 B13R1.12 O=C(CCF)c1cccc(c1Br)Cl 1458a_100012339722_100011217306 [0,1,0,0,0,0|3,0,0]=4 734 B13R1.12 O=C(CCF)c1cccc(c1Br)F 1458a_100011217547_100011217306 [0,1,0,0,0,0|3,0,0]=4 735 B13R1.12 O=C(CCF)c1cccc(c1Br)I 1458a_100010232522_100011217306 [0,1,0,0,0,0|3,0,0]=4 736 B13R1.12 O=C(CCF)c1cccc(c1Br)O 1458a_100010230362_100011217306 [0,1,0,0,0,0|3,0,0]=4 737 B13R1.12 O=C(CCF)c1cccc(c1Cl)Br 1458a_100000760540_100011217306 [0,1,0,0,0,0|3,0,0]=4 738 B13R1.12 O=C(CCF)c1cccc(c1Cl)Cl 1458a_100000183631_100011217306 [0,1,0,0,0,0|3,0,0]=4 739 B13R1.12 O=C(CCF)c1cccc(c1Cl)F 1458a_100000759904_100011217306 [0,1,0,0,0,0|3,0,0]=4 740 B13R1.12 O=C(CCF)c1cccc(c1Cl)I 1458a_100010176783_100011217306 [0,1,0,0,0,0|3,0,0]=4 741 B13R1.12 O=C(CCF)c1cccc(c1Cl)O 1458a_100000092362_100011217306 [0,1,0,0,0,0|3,0,0]=4 742 B13R1.12 O=C(CCF)c1cccc(c1F)Br 1458a_100000756403_100011217306 [0,1,0,0,0,0|3,0,0]=4 743 B13R1.12 O=C(CCF)c1cccc(c1F)Cl 1458a_100000688816_100011217306 [0,1,0,0,0,0|3,0,0]=4 744 B13R1.12 O=C(CCF)c1cccc(c1F)F 1458a_100000748134_100011217306 [0,1,0,0,0,0|3,0,0]=4 745 B13R1.12 O=C(CCF)c1cccc(c1F)I 1458a_100010185205_100011217306 [0,1,0,0,0,0|3,0,0]=4 746 B13R1.12 O=C(CCF)c1cccc(c1F)O 1458a_100000037433_100011217306 [0,1,0,0,0,0|3,0,0]=4 747 B13R1.12 O=C(CCF)c1cccc(c1I)Br 1458a_100000688019_100011217306 [0,1,0,0,0,0|3,0,0]=4 748 B13R1.12 O=C(CCF)c1cccc(c1I)Cl 1458a_100010176784_100011217306 [0,1,0,0,0,0|3,0,0]=4 749 B13R1.12 O=C(CCF)c1cccc(c1I)F 1458a_100000690930_100011217306 [0,1,0,0,0,0|3,0,0]=4 750 B13R1.12 O=C(CCF)c1cccc(c1I)O 1458a_100010084636_100011217306 [0,1,0,0,0,0|3,0,0]=4 751 B13R1.12 O=C(CCF)c1cccc(c1O)Br 1458a_100000752940_100011217306 [0,1,0,0,0,0|2,0,0]=3 752 B13R1.12 O=C(CCF)c1cccc(c1O)Cl 1458a_100000742801_100011217306 [0,1,0,0,0,0|2,0,0]=3 753 B13R1.12 O=C(CCF)c1cccc(c1O)F 1458a_100011217230_100011217306 [0,1,0,0,0,0|2,0,0]=3 754 B13R1.12 O=C(CCF)c1cccc(c1O)O 1458a_100000690420_100011217306 [0,1,0,0,0,0|2,0,0]=3 755 B13R1.12 O=C(CCO)c1cccc(c1Br)Br 1458a_100012360534_100000211926 [0,1,0,0,0,0|3,0,0]=4 756 B13R1.12 O=C(CCO)c1cccc(c1Br)Cl 1458a_100012339722_100000211926 [0,1,0,0,0,0|3,0,0]=4 757 B13R1.12 O=C(CCO)c1cccc(c1Br)F 1458a_100011217547_100000211926 [0,1,0,0,0,0|3,0,0]=4 758 B13R1.12 O=C(CCO)c1cccc(c1Br)I 1458a_100010232522_100000211926 [0,1,0,0,0,0|3,0,0]=4 759 B13R1.12 O=C(CCO)c1cccc(c1Br)O 1458a_100010230362_100000211926 [0,1,0,0,0,0|3,0,0]=4 760 B13R1.12 O=C(CCO)c1cccc(c1Cl)Br 1458a_100000760540_100000211926 [0,1,0,0,0,0|3,0,0]=4 761 B13R1.12 O=C(CCO)c1cccc(c1Cl)Cl 1458a_100000183631_100000211926 [0,1,0,0,0,0|3,0,0]=4 762 B13R1.12 O=C(CCO)c1cccc(c1Cl)F 1458a_100000759904_100000211926 [0,1,0,0,0,0|3,0,0]=4 763 B13R1.12 O=C(CCO)c1cccc(c1Cl)I 1458a_100010176783_100000211926 [0,1,0,0,0,0|3,0,0]=4 764 B13R1.12 O=C(CCO)c1cccc(c1Cl)O 1458a_100000092362_100000211926 [0,1,0,0,0,0|3,0,0]=4 765 B13R1.12 O=C(CCO)c1cccc(c1F)Br 1458a_100000756403_100000211926 [0,1,0,0,0,0|3,0,0]=4 766 B13R1.12 O=C(CCO)c1cccc(c1F)Cl 1458a_100000688816_100000211926 [0,1,0,0,0,0|3,0,0]=4 767 B13R1.12 O=C(CCO)c1cccc(c1F)F 1458a_100000748134_100000211926 [0,1,0,0,0,0|3,0,0]=4 768 B13R1.12 O=C(CCO)c1cccc(c1F)I 1458a_100010185205_100000211926 [0,1,0,0,0,0|3,0,0]=4 769 B13R1.12 O=C(CCO)c1cccc(c1F)O 1458a_100000037433_100000211926 [0,1,0,0,0,0|3,0,0]=4 770 B13R1.12 O=C(CCO)c1cccc(c1I)Br 1458a_100000688019_100000211926 [0,1,0,0,0,0|3,0,0]=4 771 B13R1.12 O=C(CCO)c1cccc(c1I)Cl 1458a_100010176784_100000211926 [0,1,0,0,0,0|3,0,0]=4 772 B13R1.12 O=C(CCO)c1cccc(c1I)F 1458a_100000690930_100000211926 [0,1,0,0,0,0|3,0,0]=4 773 B13R1.12 O=C(CCO)c1cccc(c1I)O 1458a_100010084636_100000211926 [0,1,0,0,0,0|3,0,0]=4 774 B13R1.12 O=C(CCO)c1cccc(c1O)Br 1458a_100000752940_100000211926 [0,1,0,0,0,0|2,0,0]=3 775 B13R1.12 O=C(CCO)c1cccc(c1O)Cl 1458a_100000742801_100000211926 [0,1,0,0,0,0|2,0,0]=3 776 B13R1.12 O=C(CCO)c1cccc(c1O)F 1458a_100011217230_100000211926 [0,1,0,0,0,0|2,0,0]=3 777 B13R1.12 O=C(CCO)c1cccc(c1O)O 1458a_100000690420_100000211926 [0,1,0,0,0,0|2,0,0]=3 778 B13R1.12 [13CH3]SCC(=O)c1cccc(c1F)Br 62a_100012356374_200025704644 [0,1,0,0,0,0|3,0,0]=4 779 B13R1.12 [13CH3]SCC(=O)c1cccc(c1F)Br 62a_200025704644_100012356374 [0,1,0,0,0,0|3,0,0]=4 780 B13R1.12 [13CH3]SCC(=O)c1cccc(c1F)Cl 62a_200012351890_200025704644 [0,1,0,0,0,0|3,0,0]=4 781 B13R1.12 [13CH3]SCC(=O)c1cccc(c1F)Cl 62a_200025704644_200012351890 [0,1,0,0,0,0|3,0,0]=4 782 B13R1.173 CCCN(CC)c1ccccc1O 269982a_103624766699_100000210303 [0,1,0,0,0,0|3,0,0]=4 783 B13R1.173 CCOC(C#N)c1ccccc1Cl 7a_200011294979_100000210202 [0,1,0,0,0,0|2,0,1]=4 784 B13R1.173 CCOC(CC)c1ccccc1F 34a_200011689290_100000210202 [0,1,0,0,0,0|2,0,1]=4 785 B13R1.173 CCOC(CC)c1ccccc1F 7a_200011689290_100000210202 [0,1,0,0,0,0|2,0,1]=4 786 B13R1.173 CCOC(CN)c1ccccc1Br 34a_100011236429_100000210202 [0,1,0,0,0,0|2,0,1]=4 787 B13R1.173 CCOC(CN)c1ccccc1Cl 34a_200000759403_100000210202 [0,1,0,0,0,0|2,0,1]=4 788 B13R1.201 C=C(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000748629 [0,1,0,0,0,0|2,0,1]=4 789 B13R1.201 C=C(C)CC(=O)c1ccccc1C 1458a_100000212026_100000748629 [0,1,0,0,0,0|2,0,1]=4 790 B13R1.201 C=C(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000748629 [0,1,0,0,0,0|2,0,1]=4 791 B13R1.201 C=C(C)CC(=O)c1ccccc1F 1458a_100000188656_100000748629 [0,1,0,0,0,0|2,0,1]=4 792 B13R1.201 C=C(C)CC(=O)c1ccccc1I 1458a_100000187884_100000748629 [0,1,0,0,0,0|2,0,1]=4 793 B13R1.201 C=C(C)CC(=O)c1ccccc1O 1458a_100015234032_100000748629 [0,1,0,0,0,0|1,0,1]=3 794 B13R1.201 C=C(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000748629 [0,1,0,0,0,0|1,0,2]=4 795 B13R1.201 C=C(F)CC(=O)c1ccccc1O 1458a_100015234032_100009893438 [0,1,0,0,0,0|1,0,2]=4 796 B13R1.201 CC(=O)CC(=O)c1ccccc1Br 1458a_100000070787_100000199116 [0,1,0,0,0,0|2,0,1]=4 797 B13R1.201 CC(=O)CC(=O)c1ccccc1C 1458a_100000070787_100000741374 [0,1,0,0,0,0|2,0,1]=4 798 B13R1.201 CC(=O)CC(=O)c1ccccc1Cl 1458a_100000070787_100000211432 [0,1,0,0,0,0|2,0,1]=4 799 B13R1.201 CC(=O)CC(=O)c1ccccc1F 1458a_100000070787_100000204681 [0,1,0,0,0,0|2,0,1]=4 800 B13R1.201 CC(=O)CC(=O)c1ccccc1O 1458a_100000070787_100000188908 [0,1,0,0,0,0|1,0,1]=3 801 B13R1.201 CC(=O)CC(=O)c1ccccc1O 271570a_203496583355_200011243946 [0,1,0,0,0,0|1,0,1]=3 802 B13R1.201 CC(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000210624 [0,1,0,0,0,0|2,0,0]=3 803 B13R1.201 CC(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000210624 [0,1,0,0,0,0|2,0,0]=3 804 B13R1.201 CC(C)CC(=O)c1ccccc1F 1458a_100000188656_100000210624 [0,1,0,0,0,0|2,0,0]=3 805 B13R1.201 CC(C)CC(=O)c1ccccc1I 1458a_100000187884_100000210624 [0,1,0,0,0,0|2,0,0]=3 806 B13R1.201 CC(C)CC(=O)c1ccccc1O 1458a_100015234032_100000210624 [0,1,0,0,0,0|1,0,0]=2 807 B13R1.201 CC(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000210624 [0,1,0,0,0,0|1,0,1]=3 808 B13R1.201 CC(C)CN(C)c1ccccc1O 269982a_100000033821_100000210624 [0,1,0,0,0,0|3,0,0]=4 809 B13R1.201 CC(C)C[C@H](N)c1ccccc1O 271570a_100015190218_100000739446 [0,1,0,0,0,0|2,0,1]=4 810 B13R1.201 CC(C)NC(=O)c1ccccc1Br 11a_100138425928_100000188424 [0,1,0,0,0,0|2,0,0]=3 811 B13R1.201 CC(C)NC(=O)c1ccccc1Br 1626a_100138425928_100000188424 [0,1,0,0,0,0|2,0,0]=3 812 B13R1.201 CC(C)NC(=O)c1ccccc1Br 240690a_100138425928_100000188424 [0,1,0,0,0,0|2,0,0]=3 813 B13R1.201 CC(C)NC(=O)c1ccccc1Br 527a_100138425928_100000188424 [0,1,0,0,0,0|2,0,0]=3 814 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 11a_100138425928_100000185844 [0,1,0,0,0,0|2,0,0]=3 815 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 1626a_100138425928_100000185844 [0,1,0,0,0,0|2,0,0]=3 816 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 240690a_100138425928_100000185844 [0,1,0,0,0,0|2,0,0]=3 817 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 527a_100138425928_100000185844 [0,1,0,0,0,0|2,0,0]=3 818 B13R1.201 CC(C)NC(=O)c1ccccc1F 11a_100138425928_100000188656 [0,1,0,0,0,0|2,0,0]=3 819 B13R1.201 CC(C)NC(=O)c1ccccc1F 1626a_100138425928_100000188656 [0,1,0,0,0,0|2,0,0]=3 820 B13R1.201 CC(C)NC(=O)c1ccccc1F 240690a_100138425928_100000188656 [0,1,0,0,0,0|2,0,0]=3 821 B13R1.201 CC(C)NC(=O)c1ccccc1F 527a_100138425928_100000188656 [0,1,0,0,0,0|2,0,0]=3 822 B13R1.201 CC(C)NC(=O)c1ccccc1I 11a_100138425928_100000187884 [0,1,0,0,0,0|2,0,0]=3 823 B13R1.201 CC(C)NC(=O)c1ccccc1I 1626a_100138425928_100000187884 [0,1,0,0,0,0|2,0,0]=3 824 B13R1.201 CC(C)NC(=O)c1ccccc1I 240690a_100138425928_100000187884 [0,1,0,0,0,0|2,0,0]=3 825 B13R1.201 CC(C)NC(=O)c1ccccc1I 527a_100138425928_100000187884 [0,1,0,0,0,0|2,0,0]=3 826 B13R1.201 CC(C)NC(=O)c1ccccc1O 240690a_100138425928_100015234032 [0,1,0,0,0,0|1,0,0]=2 827 B13R1.201 CC(C)NC(=O)c1ccccc1O 271570a_203496583355_200000152627 [0,1,0,0,0,0|1,0,0]=2 828 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 1626a_100138425928_100009911694 [0,1,0,0,0,0|1,0,1]=3 829 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 240690a_100138425928_100009911694 [0,1,0,0,0,0|1,0,1]=3 830 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 527a_100138425928_100009911694 [0,1,0,0,0,0|1,0,1]=3 831 B13R1.201 CC(C)N[C@H](C)c1ccccc1O 2230a_100025703389_100000210206 [0,1,0,0,0,0|2,0,1]=4 832 B13R1.201 CC(C)OC(=O)c1ccccc1O 271570a_203496583355_100000169877 [0,1,0,0,0,0|0,0,0]=1 833 B13R1.201 CC(C)OC(C)c1ccccc1Br 34a_100000702211_100000210206 [0,1,0,0,0,0|2,0,1]=4 834 B13R1.201 CC(C)OC(C)c1ccccc1Br 7a_100000702211_100000210206 [0,1,0,0,0,0|2,0,1]=4 835 B13R1.201 CC(C)OC(C)c1ccccc1Cl 34a_100000740796_100000210206 [0,1,0,0,0,0|2,0,1]=4 836 B13R1.201 CC(C)OC(C)c1ccccc1Cl 7a_100000740796_100000210206 [0,1,0,0,0,0|2,0,1]=4 837 B13R1.201 CC(C)OC(C)c1ccccc1F 34a_100000212225_200000741388 [0,1,0,0,0,0|2,0,1]=4 838 B13R1.201 CC(C)OC(C)c1ccccc1F 34a_100000697922_100000210206 [0,1,0,0,0,0|2,0,1]=4 839 B13R1.201 CC(C)OC(C)c1ccccc1F 7a_100000697922_100000210206 [0,1,0,0,0,0|2,0,1]=4 840 B13R1.201 CC(C)OC(C)c1ccccc1N 7a_100011405641_100000210206 [0,1,0,0,0,0|2,0,1]=4 841 B13R1.201 CC(O)CC(=O)c1ccccc1Br 1458a_100000188424_100011218427 [0,1,0,0,0,0|2,0,0]=3 842 B13R1.201 CC(O)CC(=O)c1ccccc1Cl 1458a_100000185844_100011218427 [0,1,0,0,0,0|2,0,0]=3 843 B13R1.201 CC(O)CC(=O)c1ccccc1F 1458a_100000188656_100011218427 [0,1,0,0,0,0|2,0,0]=3 844 B13R1.201 CC(O)CC(=O)c1ccccc1I 1458a_100000187884_100011218427 [0,1,0,0,0,0|2,0,0]=3 845 B13R1.201 CC(O)CC(=O)c1ccccc1O 1458a_100015234032_100011218427 [0,1,0,0,0,0|1,0,0]=2 846 B13R1.201 CC(O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100011218427 [0,1,0,0,0,0|1,0,1]=3 847 B13R1.201 CC(O)CN(C)c1ccccc1O 269982a_100000033821_100011218427 [0,1,0,0,0,0|3,0,0]=4 848 B13R1.201 CN(C)CC(=O)c1ccccc1Br 269982a_100102631434_100000199116 [0,1,0,0,0,0|3,0,0]=4 849 B13R1.201 CN(C)CC(=O)c1ccccc1Cl 269982a_100102631434_100000211432 [0,1,0,0,0,0|3,0,0]=4 850 B13R1.201 CN(C)CC(=O)c1ccccc1F 269982a_100102631434_100000204681 [0,1,0,0,0,0|3,0,0]=4 851 B13R1.201 CN(C)CC(=O)c1ccccc1O 269982a_100102631434_100000188908 [0,1,0,0,0,0|2,0,0]=3 852 B13R1.201 C[C@@H](O)CN(C)c1ccccc1O 269982a_100000033821_100009817552 [0,1,0,0,0,0|3,0,0]=4 853 B13R1.201 Cc1ccccc1C(=O)CC(C)C 1458a_100000212026_100000210624 [0,1,0,0,0,0|2,0,0]=3 854 B13R1.201 Cc1ccccc1C(=O)CC(C)O 1458a_100000212026_100011218427 [0,1,0,0,0,0|2,0,0]=3 855 B13R1.201 Cc1ccccc1C(=O)CC(F)F 1458a_100000212026_100011934356 [0,1,0,0,0,0|3,0,0]=4 856 B13R1.201 Cc1ccccc1C(=O)CN(C)C 2230a_100102631434_100000741374 [0,1,0,0,0,0|3,0,0]=4 857 B13R1.201 Cc1ccccc1C(=O)CN(C)C 269982a_100102631434_100000741374 [0,1,0,0,0,0|3,0,0]=4 858 B13R1.201 Cc1ccccc1C(=O)NC(C)C 11a_100138425928_100000212026 [0,1,0,0,0,0|2,0,0]=3 859 B13R1.201 Cc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000212026 [0,1,0,0,0,0|2,0,0]=3 860 B13R1.201 Cc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000212026 [0,1,0,0,0,0|2,0,0]=3 861 B13R1.201 Cc1ccccc1C(=O)NC(C)C 527a_100138425928_100000212026 [0,1,0,0,0,0|2,0,0]=3 862 B13R1.201 Cc1ccccc1C(C)OC(C)C 34a_100000742021_100000210206 [0,1,0,0,0,0|2,0,1]=4 863 B13R1.201 Cc1ccccc1C(C)OC(C)C 7a_100000742021_100000210206 [0,1,0,0,0,0|2,0,1]=4 864 B13R1.201 NC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000187820 [0,1,0,0,0,0|2,0,1]=4 865 B13R1.201 O=C(CC(F)F)c1ccccc1Br 1458a_100000188424_100011934356 [0,1,0,0,0,0|3,0,0]=4 866 B13R1.201 O=C(CC(F)F)c1ccccc1Cl 1458a_100000185844_100011934356 [0,1,0,0,0,0|3,0,0]=4 867 B13R1.201 O=C(CC(F)F)c1ccccc1F 1458a_100000188656_100011934356 [0,1,0,0,0,0|3,0,0]=4 868 B13R1.201 O=C(CC(F)F)c1ccccc1I 1458a_100000187884_100011934356 [0,1,0,0,0,0|3,0,0]=4 869 B13R1.201 O=C(CC(F)F)c1ccccc1O 1458a_100015234032_100011934356 [0,1,0,0,0,0|2,0,0]=3 870 B13R1.201 O=C(CC(F)F)c1ccccc1[O-] 1458a_100009911694_100011934356 [0,1,0,0,0,0|2,0,1]=4 871 B13R1.201 O=C(C[N+](=O)[O-])c1ccccc1O 1458a_100015234032_100000761209 [0,1,0,0,0,0|3,0,0]=4 872 B13R1.201 O=C([O-])CC(=O)c1ccccc1O 1458a_100015234032_100020667443 [0,1,0,0,0,0|2,0,1]=4 873 B13R1.446 C#CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000184674 [0,1,0,0,0,0|1,0,2]=4 874 B13R1.446 C#CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000184674 [0,1,0,0,0,0|1,0,2]=4 875 B13R1.446 C#CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000184674 [0,1,0,0,0,0|1,0,2]=4 876 B13R1.446 C#CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000184674 [0,1,0,0,0,0|1,0,2]=4 877 B13R1.446 C#CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000184674 [0,1,0,0,0,0|1,0,2]=4 878 B13R1.446 C#CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000184674 [0,1,0,0,0,0|1,0,2]=4 879 B13R1.446 C=CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210623 [0,1,0,0,0,0|1,0,2]=4 880 B13R1.446 C=CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210623 [0,1,0,0,0,0|1,0,2]=4 881 B13R1.446 C=CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210623 [0,1,0,0,0,0|1,0,2]=4 882 B13R1.446 C=CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210623 [0,1,0,0,0,0|1,0,2]=4 883 B13R1.446 C=CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210623 [0,1,0,0,0,0|1,0,2]=4 884 B13R1.446 C=CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210623 [0,1,0,0,0,0|1,0,2]=4 885 B13R1.446 CCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210303 [0,1,0,0,0,0|2,0,0]=3 886 B13R1.446 CCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210303 [0,1,0,0,0,0|2,0,0]=3 887 B13R1.446 CCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210303 [0,1,0,0,0,0|2,0,0]=3 888 B13R1.446 CCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210303 [0,1,0,0,0,0|2,0,0]=3 889 B13R1.446 CCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210303 [0,1,0,0,0,0|2,0,0]=3 890 B13R1.446 CCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210303 [0,1,0,0,0,0|2,0,0]=3 891 B13R1.446 CCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210303 [0,1,0,0,0,0|2,0,0]=3 892 B13R1.446 CCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210303 [0,1,0,0,0,0|2,0,0]=3 893 B13R1.446 CCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210303 [0,1,0,0,0,0|2,0,0]=3 894 B13R1.446 CCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210303 [0,1,0,0,0,0|2,0,0]=3 895 B13R1.446 CCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210303 [0,1,0,0,0,0|2,0,0]=3 896 B13R1.446 CCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210303 [0,1,0,0,0,0|2,0,0]=3 897 B13R1.446 CCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210303 [0,1,0,0,0,0|2,0,0]=3 898 B13R1.446 CCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210303 [0,1,0,0,0,0|2,0,0]=3 899 B13R1.446 CCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210303 [0,1,0,0,0,0|2,0,0]=3 900 B13R1.446 CCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210303 [0,1,0,0,0,0|2,0,0]=3 901 B13R1.446 CCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210303 [0,1,0,0,0,0|2,0,0]=3 902 B13R1.446 CCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210303 [0,1,0,0,0,0|2,0,0]=3 903 B13R1.446 CCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210303 [0,1,0,0,0,0|2,0,0]=3 904 B13R1.446 CCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210303 [0,1,0,0,0,0|2,0,0]=3 905 B13R1.446 CCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210303 [0,1,0,0,0,0|2,0,0]=3 906 B13R1.446 CCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210303 [0,1,0,0,0,0|2,0,0]=3 907 B13R1.446 CCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210303 [0,1,0,0,0,0|2,0,0]=3 908 B13R1.446 CCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210303 [0,1,0,0,0,0|2,0,0]=3 909 B13R1.446 CCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210303 [0,1,0,0,0,0|2,0,0]=3 910 B13R1.446 CCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210303 [0,1,0,0,0,0|2,0,0]=3 911 B13R1.446 CCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210303 [0,1,0,0,0,0|2,0,0]=3 912 B13R1.446 CCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210303 [0,1,0,0,0,0|2,0,0]=3 913 B13R1.446 CCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210303 [0,1,0,0,0,0|2,0,0]=3 914 B13R1.446 CCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210303 [0,1,0,0,0,0|2,0,0]=3 915 B13R1.446 CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210303 [0,1,0,0,0,0|1,0,0]=2 916 B13R1.446 CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210303 [0,1,0,0,0,0|1,0,0]=2 917 B13R1.446 CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210303 [0,1,0,0,0,0|1,0,0]=2 918 B13R1.446 CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210303 [0,1,0,0,0,0|1,0,0]=2 919 B13R1.446 CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210303 [0,1,0,0,0,0|1,0,0]=2 920 B13R1.446 CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210303 [0,1,0,0,0,0|1,0,0]=2 921 B13R1.446 CCNC(=O)c1cc(ccc1Br)Br 11a_100015525214_100000690610 [0,1,0,0,0,0|2,0,0]=3 922 B13R1.446 CCNC(=O)c1cc(ccc1Br)Br 240690a_100015525214_100000690610 [0,1,0,0,0,0|2,0,0]=3 923 B13R1.446 CCNC(=O)c1cc(ccc1Br)Br 527a_100015525214_100000690610 [0,1,0,0,0,0|2,0,0]=3 924 B13R1.446 CCNC(=O)c1cc(ccc1Br)C 11a_100015525214_100000689033 [0,1,0,0,0,0|2,0,0]=3 925 B13R1.446 CCNC(=O)c1cc(ccc1Br)C 240690a_100015525214_100000689033 [0,1,0,0,0,0|2,0,0]=3 926 B13R1.446 CCNC(=O)c1cc(ccc1Br)C 527a_100015525214_100000689033 [0,1,0,0,0,0|2,0,0]=3 927 B13R1.446 CCNC(=O)c1cc(ccc1Br)Cl 11a_100015525214_100000736951 [0,1,0,0,0,0|2,0,0]=3 928 B13R1.446 CCNC(=O)c1cc(ccc1Br)Cl 240690a_100015525214_100000736951 [0,1,0,0,0,0|2,0,0]=3 929 B13R1.446 CCNC(=O)c1cc(ccc1Br)Cl 527a_100015525214_100000736951 [0,1,0,0,0,0|2,0,0]=3 930 B13R1.446 CCNC(=O)c1cc(ccc1Br)F 11a_100015525214_100000212315 [0,1,0,0,0,0|2,0,0]=3 931 B13R1.446 CCNC(=O)c1cc(ccc1Br)F 240690a_100015525214_100000212315 [0,1,0,0,0,0|2,0,0]=3 932 B13R1.446 CCNC(=O)c1cc(ccc1Br)F 527a_100015525214_100000212315 [0,1,0,0,0,0|2,0,0]=3 933 B13R1.446 CCNC(=O)c1cc(ccc1Br)I 11a_100015525214_100000698340 [0,1,0,0,0,0|2,0,0]=3 934 B13R1.446 CCNC(=O)c1cc(ccc1Br)I 240690a_100015525214_100000698340 [0,1,0,0,0,0|2,0,0]=3 935 B13R1.446 CCNC(=O)c1cc(ccc1Br)I 527a_100015525214_100000698340 [0,1,0,0,0,0|2,0,0]=3 936 B13R1.446 CCNC(=O)c1cc(ccc1Br)O 240690a_100015525214_100012352043 [0,1,0,0,0,0|2,0,0]=3 937 B13R1.446 CCNC(=O)c1cc(ccc1Br)O 527a_100015525214_100012352043 [0,1,0,0,0,0|2,0,0]=3 938 B13R1.446 CCNC(=O)c1cc(ccc1C)Br 11a_100015525214_100000759961 [0,1,0,0,0,0|2,0,0]=3 939 B13R1.446 CCNC(=O)c1cc(ccc1C)Br 240690a_100015525214_100000759961 [0,1,0,0,0,0|2,0,0]=3 940 B13R1.446 CCNC(=O)c1cc(ccc1C)Br 527a_100015525214_100000759961 [0,1,0,0,0,0|2,0,0]=3 941 B13R1.446 CCNC(=O)c1cc(ccc1C)C 11a_100015525214_100000195421 [0,1,0,0,0,0|2,0,0]=3 942 B13R1.446 CCNC(=O)c1cc(ccc1C)C 240690a_100015525214_100000195421 [0,1,0,0,0,0|2,0,0]=3 943 B13R1.446 CCNC(=O)c1cc(ccc1C)C 527a_100015525214_100000195421 [0,1,0,0,0,0|2,0,0]=3 944 B13R1.446 CCNC(=O)c1cc(ccc1C)Cl 11a_100015525214_100000692595 [0,1,0,0,0,0|2,0,0]=3 945 B13R1.446 CCNC(=O)c1cc(ccc1C)Cl 240690a_100015525214_100000692595 [0,1,0,0,0,0|2,0,0]=3 946 B13R1.446 CCNC(=O)c1cc(ccc1C)Cl 527a_100015525214_100000692595 [0,1,0,0,0,0|2,0,0]=3 947 B13R1.446 CCNC(=O)c1cc(ccc1C)F 11a_100015525214_100000240043 [0,1,0,0,0,0|2,0,0]=3 948 B13R1.446 CCNC(=O)c1cc(ccc1C)F 240690a_100015525214_100000240043 [0,1,0,0,0,0|2,0,0]=3 949 B13R1.446 CCNC(=O)c1cc(ccc1C)F 527a_100015525214_100000240043 [0,1,0,0,0,0|2,0,0]=3 950 B13R1.446 CCNC(=O)c1cc(ccc1C)I 11a_100015525214_100000688012 [0,1,0,0,0,0|2,0,0]=3 951 B13R1.446 CCNC(=O)c1cc(ccc1C)I 240690a_100015525214_100000688012 [0,1,0,0,0,0|2,0,0]=3 952 B13R1.446 CCNC(=O)c1cc(ccc1C)I 527a_100015525214_100000688012 [0,1,0,0,0,0|2,0,0]=3 953 B13R1.446 CCNC(=O)c1cc(ccc1C)O 240690a_100015525214_100000687834 [0,1,0,0,0,0|2,0,0]=3 954 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Br 11a_100015525214_100000211212 [0,1,0,0,0,0|2,0,0]=3 955 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Br 240690a_100015525214_100000211212 [0,1,0,0,0,0|2,0,0]=3 956 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Br 527a_100015525214_100000211212 [0,1,0,0,0,0|2,0,0]=3 957 B13R1.446 CCNC(=O)c1cc(ccc1Cl)C 11a_100015525214_100011290873 [0,1,0,0,0,0|2,0,0]=3 958 B13R1.446 CCNC(=O)c1cc(ccc1Cl)C 240690a_100015525214_100011290873 [0,1,0,0,0,0|2,0,0]=3 959 B13R1.446 CCNC(=O)c1cc(ccc1Cl)C 527a_100015525214_100011290873 [0,1,0,0,0,0|2,0,0]=3 960 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Cl 11a_100015525214_100000210642 [0,1,0,0,0,0|2,0,0]=3 961 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Cl 240690a_100015525214_100000210642 [0,1,0,0,0,0|2,0,0]=3 962 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Cl 527a_100015525214_100000210642 [0,1,0,0,0,0|2,0,0]=3 963 B13R1.446 CCNC(=O)c1cc(ccc1Cl)F 11a_100015525214_100011219680 [0,1,0,0,0,0|2,0,0]=3 964 B13R1.446 CCNC(=O)c1cc(ccc1Cl)F 240690a_100015525214_100011219680 [0,1,0,0,0,0|2,0,0]=3 965 B13R1.446 CCNC(=O)c1cc(ccc1Cl)F 527a_100015525214_100011219680 [0,1,0,0,0,0|2,0,0]=3 966 B13R1.446 CCNC(=O)c1cc(ccc1Cl)I 11a_100015525214_100000688013 [0,1,0,0,0,0|2,0,0]=3 967 B13R1.446 CCNC(=O)c1cc(ccc1Cl)I 240690a_100015525214_100000688013 [0,1,0,0,0,0|2,0,0]=3 968 B13R1.446 CCNC(=O)c1cc(ccc1Cl)I 527a_100015525214_100000688013 [0,1,0,0,0,0|2,0,0]=3 969 B13R1.446 CCNC(=O)c1cc(ccc1Cl)O 240690a_100015525214_100000719527 [0,1,0,0,0,0|2,0,0]=3 970 B13R1.446 CCNC(=O)c1cc(ccc1Cl)O 527a_100015525214_100000719527 [0,1,0,0,0,0|2,0,0]=3 971 B13R1.446 CCNC(=O)c1cc(ccc1F)Br 11a_100015525214_100000212322 [0,1,0,0,0,0|2,0,0]=3 972 B13R1.446 CCNC(=O)c1cc(ccc1F)Br 240690a_100015525214_100000212322 [0,1,0,0,0,0|2,0,0]=3 973 B13R1.446 CCNC(=O)c1cc(ccc1F)Br 527a_100015525214_100000212322 [0,1,0,0,0,0|2,0,0]=3 974 B13R1.446 CCNC(=O)c1cc(ccc1F)C 11a_100015525214_100000749327 [0,1,0,0,0,0|2,0,0]=3 975 B13R1.446 CCNC(=O)c1cc(ccc1F)C 240690a_100015525214_100000749327 [0,1,0,0,0,0|2,0,0]=3 976 B13R1.446 CCNC(=O)c1cc(ccc1F)C 527a_100015525214_100000749327 [0,1,0,0,0,0|2,0,0]=3 977 B13R1.446 CCNC(=O)c1cc(ccc1F)Cl 11a_100015525214_100000214954 [0,1,0,0,0,0|2,0,0]=3 978 B13R1.446 CCNC(=O)c1cc(ccc1F)Cl 240690a_100015525214_100000214954 [0,1,0,0,0,0|2,0,0]=3 979 B13R1.446 CCNC(=O)c1cc(ccc1F)Cl 527a_100015525214_100000214954 [0,1,0,0,0,0|2,0,0]=3 980 B13R1.446 CCNC(=O)c1cc(ccc1F)F 11a_100015525214_100000198512 [0,1,0,0,0,0|2,0,0]=3 981 B13R1.446 CCNC(=O)c1cc(ccc1F)F 240690a_100015525214_100000198512 [0,1,0,0,0,0|2,0,0]=3 982 B13R1.446 CCNC(=O)c1cc(ccc1F)F 527a_100015525214_100000198512 [0,1,0,0,0,0|2,0,0]=3 983 B13R1.446 CCNC(=O)c1cc(ccc1F)I 11a_100015525214_100000688014 [0,1,0,0,0,0|2,0,0]=3 984 B13R1.446 CCNC(=O)c1cc(ccc1F)I 240690a_100015525214_100000688014 [0,1,0,0,0,0|2,0,0]=3 985 B13R1.446 CCNC(=O)c1cc(ccc1F)I 527a_100015525214_100000688014 [0,1,0,0,0,0|2,0,0]=3 986 B13R1.446 CCNC(=O)c1cc(ccc1F)O 240690a_100015525214_100000037260 [0,1,0,0,0,0|2,0,0]=3 987 B13R1.446 CCNC(=O)c1cc(ccc1F)O 271570a_203496583355_100000155167 [0,1,0,0,0,0|2,0,0]=3 988 B13R1.446 CCNC(=O)c1cc(ccc1F)O 527a_100015525214_100000037260 [0,1,0,0,0,0|2,0,0]=3 989 B13R1.446 CCNC(=O)c1cc(ccc1I)Br 11a_100015525214_100000183945 [0,1,0,0,0,0|2,0,0]=3 990 B13R1.446 CCNC(=O)c1cc(ccc1I)Br 240690a_100015525214_100000183945 [0,1,0,0,0,0|2,0,0]=3 991 B13R1.446 CCNC(=O)c1cc(ccc1I)C 11a_100015525214_100000057929 [0,1,0,0,0,0|2,0,0]=3 992 B13R1.446 CCNC(=O)c1cc(ccc1I)C 240690a_100015525214_100000057929 [0,1,0,0,0,0|2,0,0]=3 993 B13R1.446 CCNC(=O)c1cc(ccc1I)C 527a_100015525214_100000057929 [0,1,0,0,0,0|2,0,0]=3 994 B13R1.446 CCNC(=O)c1cc(ccc1I)Cl 11a_100015525214_100000739379 [0,1,0,0,0,0|2,0,0]=3 995 B13R1.446 CCNC(=O)c1cc(ccc1I)Cl 240690a_100015525214_100000739379 [0,1,0,0,0,0|2,0,0]=3 996 B13R1.446 CCNC(=O)c1cc(ccc1I)Cl 527a_100015525214_100000739379 [0,1,0,0,0,0|2,0,0]=3 997 B13R1.446 CCNC(=O)c1cc(ccc1I)F 11a_100015525214_100000748905 [0,1,0,0,0,0|2,0,0]=3 998 B13R1.446 CCNC(=O)c1cc(ccc1I)F 240690a_100015525214_100000748905 [0,1,0,0,0,0|2,0,0]=3 999 B13R1.446 CCNC(=O)c1cc(ccc1I)F 527a_100015525214_100000748905 [0,1,0,0,0,0|2,0,0]=3 1000 B13R1.446 CCNC(=O)c1cc(ccc1I)I 11a_100015525214_100000750460 [0,1,0,0,0,0|2,0,0]=3 1001 B13R1.446 CCNC(=O)c1cc(ccc1I)I 240690a_100015525214_100000750460 [0,1,0,0,0,0|2,0,0]=3 1002 B13R1.446 CCNC(=O)c1cc(ccc1I)I 527a_100015525214_100000750460 [0,1,0,0,0,0|2,0,0]=3 1003 B13R1.446 CCNC(=O)c1cc(ccc1I)O 240690a_100015525214_200009995701 [0,1,0,0,0,0|2,0,0]=3 1004 B13R1.446 CCNC(=O)c1cc(ccc1I)O 527a_100015525214_200009995701 [0,1,0,0,0,0|2,0,0]=3 1005 B13R1.446 CCNC(=O)c1cc(ccc1O)Br 240690a_100015525214_100000212140 [0,1,0,0,0,0|1,0,0]=2 1006 B13R1.446 CCNC(=O)c1cc(ccc1O)Br 527a_100015525214_100000212140 [0,1,0,0,0,0|1,0,0]=2 1007 B13R1.446 CCNC(=O)c1cc(ccc1O)C 240690a_100015525214_100000229998 [0,1,0,0,0,0|1,0,0]=2 1008 B13R1.446 CCNC(=O)c1cc(ccc1O)C 527a_100015525214_100000229998 [0,1,0,0,0,0|1,0,0]=2 1009 B13R1.446 CCNC(=O)c1cc(ccc1O)Cl 11a_100015525214_100000212143 [0,1,0,0,0,0|1,0,0]=2 1010 B13R1.446 CCNC(=O)c1cc(ccc1O)Cl 240690a_100015525214_100000212143 [0,1,0,0,0,0|1,0,0]=2 1011 B13R1.446 CCNC(=O)c1cc(ccc1O)Cl 527a_100015525214_100000212143 [0,1,0,0,0,0|1,0,0]=2 1012 B13R1.446 CCNC(=O)c1cc(ccc1O)F 240690a_100015525214_100000742286 [0,1,0,0,0,0|1,0,0]=2 1013 B13R1.446 CCNC(=O)c1cc(ccc1O)F 527a_100015525214_100000742286 [0,1,0,0,0,0|1,0,0]=2 1014 B13R1.446 CCNC(=O)c1cc(ccc1O)I 240690a_100015525214_100000212111 [0,1,0,0,0,0|1,0,0]=2 1015 B13R1.446 CCNC(=O)c1cc(ccc1O)I 527a_100015525214_100000212111 [0,1,0,0,0,0|1,0,0]=2 1016 B13R1.446 CCNC(C)c1cc(ccc1O)Br 269862a_100015525214_100000212127 [0,1,0,0,0,0|2,0,1]=4 1017 B13R1.446 CCNC(C)c1cc(ccc1O)C 269862a_100015525214_100000195442 [0,1,0,0,0,0|2,0,1]=4 1018 B13R1.446 CCNC(C)c1cc(ccc1O)Cl 269862a_100015525214_100000185566 [0,1,0,0,0,0|2,0,1]=4 1019 B13R1.446 CCNC(C)c1cc(ccc1O)F 269862a_100015525214_100000182812 [0,1,0,0,0,0|2,0,1]=4 1020 B13R1.446 CCNC(C)c1cc(ccc1O)I 269862a_100015525214_100010712555 [0,1,0,0,0,0|2,0,1]=4 1021 B13R1.446 CCN[C@@H](C)c1cc(ccc1O)F 2230a_100160469477_100000210202 [0,1,0,0,0,0|2,0,1]=4 1022 B13R1.446 CCN[C@@H](C)c1cc(ccc1O)F 34a_100160469477_100000210202 [0,1,0,0,0,0|2,0,1]=4 1023 B13R1.446 CCN[C@H](C)c1cc(ccc1O)Cl 2230a_100011853016_100000210202 [0,1,0,0,0,0|2,0,1]=4 1024 B13R1.446 CCN[C@H](C)c1cc(ccc1O)Cl 34a_100011853016_100000210202 [0,1,0,0,0,0|2,0,1]=4 1025 B13R1.446 CCOC(=O)c1cc(ccc1Br)O 271570a_203496583355_200012360513 [0,1,0,0,0,0|1,0,0]=2 1026 B13R1.446 CCOC(=O)c1cc(ccc1C)O 271570a_203496583355_100012360117 [0,1,0,0,0,0|1,0,0]=2 1027 B13R1.446 CCOC(=O)c1cc(ccc1Cl)O 271570a_203496583355_200012339456 [0,1,0,0,0,0|1,0,0]=2 1028 B13R1.446 CCOC(=O)c1cc(ccc1F)O 271570a_203496583355_100000716760 [0,1,0,0,0,0|1,0,0]=2 1029 B13R1.446 CCOC(=O)c1cc(ccc1N)O 271570a_203496583355_100000747833 [0,1,0,0,0,0|1,0,0]=2 1030 B13R1.446 CCOC(=O)c1cc(ccc1O)Br 271570a_203496583355_100000171027 [0,1,0,0,0,0|0,0,0]=1 1031 B13R1.446 CCOC(=O)c1cc(ccc1O)C 271570a_203496583355_200012353901 [0,1,0,0,0,0|0,0,0]=1 1032 B13R1.446 CCOC(=O)c1cc(ccc1O)Cl 271570a_203496583355_100011294803 [0,1,0,0,0,0|0,0,0]=1 1033 B13R1.446 CCOC(=O)c1cc(ccc1O)F 271570a_203496583355_100011206316 [0,1,0,0,0,0|0,0,0]=1 1034 B13R1.446 CCOC(=O)c1cc(ccc1O)O 271570a_203496583355_200000174078 [0,1,0,0,0,0|0,0,0]=1 1035 B13R1.446 CCOC(=O)c1cc(cnc1C)O 271570a_203496583355_100012232392 [0,1,0,0,0,0|2,0,0]=3 1036 B13R1.446 CCOC(=O)c1cc(cnc1F)O 271570a_203496583355_200010189675 [0,1,0,0,0,0|2,0,0]=3 1037 B13R1.446 CCOC(=O)c1cc(cnc1N)O 271570a_203496583355_100009816981 [0,1,0,0,0,0|2,0,0]=3 1038 B13R1.446 CCOC(=O)c1cc(cnc1O)C 271570a_203496583355_100009868943 [0,1,0,0,0,0|1,0,0]=2 1039 B13R1.446 CCOC(=O)c1cc(cnc1O)F 271570a_203496583355_100012350521 [0,1,0,0,0,0|1,0,0]=2 1040 B13R1.446 CCOC(=O)c1cc(cnc1O)N 271570a_203496583355_200012352213 [0,1,0,0,0,0|1,0,0]=2 1041 B13R1.446 CCOC(=O)c1cc(cnc1O)O 271570a_203496583355_100010189763 [0,1,0,0,0,0|1,0,0]=2 1042 B13R1.446 CCOC(=O)c1cc(n[nH]c1=O)O 271570a_203496583355_100015715099 [0,1,0,0,0,0|2,0,1]=4 1043 B13R1.446 CCOC(=O)c1cc(ncc1C)O 271570a_203496583355_100000083727 [0,1,0,0,0,0|2,0,0]=3 1044 B13R1.446 CCOC(=O)c1cc(ncc1F)O 271570a_203496583355_100010189748 [0,1,0,0,0,0|2,0,0]=3 1045 B13R1.446 CCOC(=O)c1cc(ncc1N)O 271570a_203496583355_100010759034 [0,1,0,0,0,0|2,0,0]=3 1046 B13R1.446 CCOC(=O)c1cc(nnc1N)O 271570a_203496583355_100010587492 [0,1,0,0,0,0|3,0,0]=4 1047 B13R1.446 CCOC(=O)c1nc(ccc1C)O 271570a_203496583355_100009888570 [0,1,0,0,0,0|2,0,0]=3 1048 B13R1.446 CCOC(=O)c1nc(ccc1F)O 271570a_203496583355_100010189790 [0,1,0,0,0,0|2,0,0]=3 1049 B13R1.446 CCOC(=O)c1nc(ccc1N)O 271570a_203496583355_100010243813 [0,1,0,0,0,0|2,0,0]=3 1050 B13R1.446 CCOC(=O)c1nc(ccc1O)N 271570a_203496583355_100010172133 [0,1,0,0,0,0|1,0,0]=2 1051 B13R1.446 CCOC(=O)c1nc(ccc1O)O 271570a_203496583355_200010189762 [0,1,0,0,0,0|1,0,0]=2 1052 B13R1.446 CCOC(C)c1cc(ccc1C)C 34a_200000246511_100000210202 [0,1,0,0,0,0|2,0,1]=4 1053 B13R1.446 CCOC(C)c1cc(ccc1C)C 7a_200000246511_100000210202 [0,1,0,0,0,0|2,0,1]=4 1054 B13R1.446 CCOC(C)c1cc(ccc1C)Cl 34a_100012002745_100000210202 [0,1,0,0,0,0|2,0,1]=4 1055 B13R1.446 CCOC(C)c1cc(ccc1C)Cl 7a_100012002745_100000210202 [0,1,0,0,0,0|2,0,1]=4 1056 B13R1.446 CCOC(C)c1cc(ccc1Cl)Cl 34a_100000742519_100000210202 [0,1,0,0,0,0|2,0,1]=4 1057 B13R1.446 CCOC(C)c1cc(ccc1Cl)Cl 7a_100000742519_100000210202 [0,1,0,0,0,0|2,0,1]=4 1058 B13R1.446 CCOC(C)c1cc(ccc1F)Br 34a_100011943926_100000210202 [0,1,0,0,0,0|2,0,1]=4 1059 B13R1.446 CCOC(C)c1cc(ccc1F)Br 7a_100011943926_100000210202 [0,1,0,0,0,0|2,0,1]=4 1060 B13R1.446 CCOC(C)c1cc(ccc1F)F 34a_100000246540_100000210202 [0,1,0,0,0,0|2,0,1]=4 1061 B13R1.446 CCOC(C)c1cc(ccc1F)F 7a_100000246540_100000210202 [0,1,0,0,0,0|2,0,1]=4 1062 B13R1.446 CCO[C@@H](C)c1cc(ccc1I)F 34a_100134768474_100000210202 [0,1,0,0,0,0|2,0,1]=4 1063 B13R1.446 CCO[C@@H](C)c1cc(ccc1I)F 7a_100134768474_100000210202 [0,1,0,0,0,0|2,0,1]=4 1064 B13R1.446 CNCC(=O)c1cc(ccc1Br)Cl 2230a_106832991635_100012361344 [0,1,0,0,0,0|3,0,0]=4 1065 B13R1.446 CNCC(=O)c1cc(ccc1Br)Cl 34a_100102657272_100012361344 [0,1,0,0,0,0|3,0,0]=4 1066 B13R1.446 CNCC(=O)c1cc(ccc1C)C 2230a_106832991635_100000183774 [0,1,0,0,0,0|3,0,0]=4 1067 B13R1.446 CNCC(=O)c1cc(ccc1C)C 34a_100102657272_100000183774 [0,1,0,0,0,0|3,0,0]=4 1068 B13R1.446 CNCC(=O)c1cc(ccc1C)C 7a_106832991635_100000183774 [0,1,0,0,0,0|3,0,0]=4 1069 B13R1.446 CNCC(=O)c1cc(ccc1Cl)Cl 2230a_106832991635_100000183120 [0,1,0,0,0,0|3,0,0]=4 1070 B13R1.446 CNCC(=O)c1cc(ccc1Cl)F 34a_100102657272_200010187420 [0,1,0,0,0,0|3,0,0]=4 1071 B13R1.446 CNCC(=O)c1cc(ccc1F)F 34a_100102657272_100000211571 [0,1,0,0,0,0|3,0,0]=4 1072 B13R1.446 CNCC(=O)c1cc(ccc1F)F 7a_106832991635_100000211571 [0,1,0,0,0,0|3,0,0]=4 1073 B13R1.446 CNCC(=O)c1cc(ccc1O)Br 34a_100102657272_200009828000 [0,1,0,0,0,0|2,0,0]=3 1074 B13R1.446 CNCC(=O)c1cc(ccc1O)Br 7a_106832991635_200009828000 [0,1,0,0,0,0|2,0,0]=3 1075 B13R1.446 CNCC(=O)c1cc(ccc1O)F 34a_100102657272_100009814381 [0,1,0,0,0,0|2,0,0]=3 1076 B13R1.446 CNCC(=O)c1cc(ccc1O)F 7a_106832991635_100000047744 [0,1,0,0,0,0|2,0,0]=3 1077 B13R1.446 CNCC(=O)c1cc(ccc1O)O 34a_100102657272_100009814097 [0,1,0,0,0,0|2,0,0]=3 1078 B13R1.446 CNCC(=O)c1cc(ccc1O)O 7a_106832991635_100009814097 [0,1,0,0,0,0|2,0,0]=3 1079 B13R1.446 CNNC(=O)c1cc(ccc1Br)Br 22a_100016993582_100000690610 [0,1,0,0,0,0|3,0,0]=4 1080 B13R1.446 CNNC(=O)c1cc(ccc1Br)C 22a_100016993582_100000689033 [0,1,0,0,0,0|3,0,0]=4 1081 B13R1.446 CNNC(=O)c1cc(ccc1Br)Cl 22a_100016993582_100000736951 [0,1,0,0,0,0|3,0,0]=4 1082 B13R1.446 CNNC(=O)c1cc(ccc1Br)F 22a_100016993582_100000212315 [0,1,0,0,0,0|3,0,0]=4 1083 B13R1.446 CNNC(=O)c1cc(ccc1Br)I 22a_100016993582_100000698340 [0,1,0,0,0,0|3,0,0]=4 1084 B13R1.446 CNNC(=O)c1cc(ccc1Br)O 22a_100016993582_100012352043 [0,1,0,0,0,0|3,0,0]=4 1085 B13R1.446 CNNC(=O)c1cc(ccc1C)Br 22a_100016993582_100000759961 [0,1,0,0,0,0|3,0,0]=4 1086 B13R1.446 CNNC(=O)c1cc(ccc1C)C 22a_100016993582_100000195421 [0,1,0,0,0,0|3,0,0]=4 1087 B13R1.446 CNNC(=O)c1cc(ccc1C)Cl 22a_100016993582_100000692595 [0,1,0,0,0,0|3,0,0]=4 1088 B13R1.446 CNNC(=O)c1cc(ccc1C)F 22a_100016993582_100000240043 [0,1,0,0,0,0|3,0,0]=4 1089 B13R1.446 CNNC(=O)c1cc(ccc1C)I 22a_100016993582_100000688012 [0,1,0,0,0,0|3,0,0]=4 1090 B13R1.446 CNNC(=O)c1cc(ccc1C)O 22a_100016993582_100000687834 [0,1,0,0,0,0|3,0,0]=4 1091 B13R1.446 CNNC(=O)c1cc(ccc1Cl)Br 22a_100016993582_100000211212 [0,1,0,0,0,0|3,0,0]=4 1092 B13R1.446 CNNC(=O)c1cc(ccc1Cl)C 22a_100016993582_100011290873 [0,1,0,0,0,0|3,0,0]=4 1093 B13R1.446 CNNC(=O)c1cc(ccc1Cl)Cl 22a_100016993582_100000210642 [0,1,0,0,0,0|3,0,0]=4 1094 B13R1.446 CNNC(=O)c1cc(ccc1Cl)F 22a_100016993582_100011219680 [0,1,0,0,0,0|3,0,0]=4 1095 B13R1.446 CNNC(=O)c1cc(ccc1Cl)I 22a_100016993582_100000688013 [0,1,0,0,0,0|3,0,0]=4 1096 B13R1.446 CNNC(=O)c1cc(ccc1Cl)O 22a_100016993582_100000719527 [0,1,0,0,0,0|3,0,0]=4 1097 B13R1.446 CNNC(=O)c1cc(ccc1F)Br 22a_100016993582_100000212322 [0,1,0,0,0,0|3,0,0]=4 1098 B13R1.446 CNNC(=O)c1cc(ccc1F)C 22a_100016993582_100000749327 [0,1,0,0,0,0|3,0,0]=4 1099 B13R1.446 CNNC(=O)c1cc(ccc1F)Cl 22a_100016993582_100000214954 [0,1,0,0,0,0|3,0,0]=4 1100 B13R1.446 CNNC(=O)c1cc(ccc1F)F 22a_100016993582_100000198512 [0,1,0,0,0,0|3,0,0]=4 1101 B13R1.446 CNNC(=O)c1cc(ccc1F)I 22a_100016993582_100000688014 [0,1,0,0,0,0|3,0,0]=4 1102 B13R1.446 CNNC(=O)c1cc(ccc1F)O 22a_100016993582_100000037260 [0,1,0,0,0,0|3,0,0]=4 1103 B13R1.446 CNNC(=O)c1cc(ccc1I)Br 22a_100016993582_100000183945 [0,1,0,0,0,0|3,0,0]=4 1104 B13R1.446 CNNC(=O)c1cc(ccc1I)C 22a_100016993582_100000057929 [0,1,0,0,0,0|3,0,0]=4 1105 B13R1.446 CNNC(=O)c1cc(ccc1I)Cl 22a_100016993582_100000739379 [0,1,0,0,0,0|3,0,0]=4 1106 B13R1.446 CNNC(=O)c1cc(ccc1I)F 22a_100016993582_100000748905 [0,1,0,0,0,0|3,0,0]=4 1107 B13R1.446 CNNC(=O)c1cc(ccc1I)I 22a_100016993582_100000750460 [0,1,0,0,0,0|3,0,0]=4 1108 B13R1.446 CNNC(=O)c1cc(ccc1I)O 22a_100016993582_200009995701 [0,1,0,0,0,0|3,0,0]=4 1109 B13R1.446 CNNC(=O)c1cc(ccc1O)Br 22a_100016993582_100000212140 [0,1,0,0,0,0|2,0,0]=3 1110 B13R1.446 CNNC(=O)c1cc(ccc1O)C 22a_100016993582_100000229998 [0,1,0,0,0,0|2,0,0]=3 1111 B13R1.446 CNNC(=O)c1cc(ccc1O)Cl 22a_100016993582_100000212143 [0,1,0,0,0,0|2,0,0]=3 1112 B13R1.446 CNNC(=O)c1cc(ccc1O)F 22a_100016993582_100000742286 [0,1,0,0,0,0|2,0,0]=3 1113 B13R1.446 CNNC(=O)c1cc(ccc1O)I 22a_100016993582_100000212111 [0,1,0,0,0,0|2,0,0]=3 1114 B13R1.446 COCC(=O)c1cc(ccc1Br)Cl 34a_100138415774_100012361344 [0,1,0,0,0,0|3,0,0]=4 1115 B13R1.446 COCC(=O)c1cc(ccc1C)C 34a_100138415774_100000183774 [0,1,0,0,0,0|3,0,0]=4 1116 B13R1.446 COCC(=O)c1cc(ccc1Cl)F 34a_100138415774_200010187420 [0,1,0,0,0,0|3,0,0]=4 1117 B13R1.446 COCC(=O)c1cc(ccc1F)F 34a_100138415774_100000211571 [0,1,0,0,0,0|3,0,0]=4 1118 B13R1.446 COCC(=O)c1cc(ccc1O)Br 34a_100138415774_200009828000 [0,1,0,0,0,0|2,0,0]=3 1119 B13R1.446 COCC(=O)c1cc(ccc1O)F 34a_100138415774_100009814381 [0,1,0,0,0,0|2,0,0]=3 1120 B13R1.446 COCC(=O)c1cc(ccc1O)O 34a_100138415774_100009814097 [0,1,0,0,0,0|2,0,0]=3 1121 B13R1.446 CSCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_200000210301 [0,1,0,0,0,0|3,0,0]=4 1122 B13R1.446 CSCC(=O)c1cc(ccc1C)C 62a_100000183774_200000210301 [0,1,0,0,0,0|3,0,0]=4 1123 B13R1.446 CSCC(=O)c1cc(ccc1C)C 62a_200000210301_100000183774 [0,1,0,0,0,0|3,0,0]=4 1124 B13R1.446 CSCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_200000210301 [0,1,0,0,0,0|3,0,0]=4 1125 B13R1.446 CSCC(=O)c1cc(ccc1Cl)F 62a_200000210301_200010187420 [0,1,0,0,0,0|3,0,0]=4 1126 B13R1.446 CSCC(=O)c1cc(ccc1Cl)F 62a_200010187420_200000210301 [0,1,0,0,0,0|3,0,0]=4 1127 B13R1.446 CSCC(=O)c1cc(ccc1F)F 62a_100000211571_200000210301 [0,1,0,0,0,0|3,0,0]=4 1128 B13R1.446 CSCC(=O)c1cc(ccc1F)F 62a_200000210301_100000211571 [0,1,0,0,0,0|3,0,0]=4 1129 B13R1.446 CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_200000210301 [0,1,0,0,0,0|2,0,0]=3 1130 B13R1.446 CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_200000210301 [0,1,0,0,0,0|2,0,0]=3 1131 B13R1.446 CSCC(=O)c1cc(ccc1O)F 62a_100009814381_200000210301 [0,1,0,0,0,0|2,0,0]=3 1132 B13R1.446 CSCC(=O)c1cc(ccc1O)F 62a_200000210301_100009814381 [0,1,0,0,0,0|2,0,0]=3 1133 B13R1.446 CSCC(=O)c1cc(ccc1O)O 62a_100009814097_200000210301 [0,1,0,0,0,0|2,0,0]=3 1134 B13R1.446 CSCC(=O)c1cc(ccc1O)O 62a_200000210301_100009814097 [0,1,0,0,0,0|2,0,0]=3 1135 B13R1.446 Cc1ccc(c(c1)C(=O)CC#N)O 1458a_100000229998_100011214920 [0,1,0,0,0,0|2,0,1]=4 1136 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)Br 1458a_100000689033_100011217306 [0,1,0,0,0,0|3,0,0]=4 1137 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)C 1458a_100000195421_100011217306 [0,1,0,0,0,0|3,0,0]=4 1138 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)Cl 1458a_100011290873_100011217306 [0,1,0,0,0,0|3,0,0]=4 1139 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)F 1458a_100000749327_100011217306 [0,1,0,0,0,0|3,0,0]=4 1140 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)I 1458a_100000057929_100011217306 [0,1,0,0,0,0|3,0,0]=4 1141 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)O 1458a_100000229998_100011217306 [0,1,0,0,0,0|2,0,0]=3 1142 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)Br 1458a_100000689033_100000211926 [0,1,0,0,0,0|3,0,0]=4 1143 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)C 1458a_100000195421_100000211926 [0,1,0,0,0,0|3,0,0]=4 1144 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)Cl 1458a_100011290873_100000211926 [0,1,0,0,0,0|3,0,0]=4 1145 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)F 1458a_100000749327_100000211926 [0,1,0,0,0,0|3,0,0]=4 1146 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)I 1458a_100000057929_100000211926 [0,1,0,0,0,0|3,0,0]=4 1147 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)O 1458a_100000229998_100000211926 [0,1,0,0,0,0|2,0,0]=3 1148 B13R1.446 Cc1ccc(c(c1)C(=O)CS[13CH3])C 62a_100000183774_200025704644 [0,1,0,0,0,0|3,0,0]=4 1149 B13R1.446 Cc1ccc(c(c1)C(=O)CS[13CH3])C 62a_200025704644_100000183774 [0,1,0,0,0,0|3,0,0]=4 1150 B13R1.446 Cc1ccc(cc1C(=O)CCF)Br 1458a_100000759961_100011217306 [0,1,0,0,0,0|3,0,0]=4 1151 B13R1.446 Cc1ccc(cc1C(=O)CCF)Cl 1458a_100000692595_100011217306 [0,1,0,0,0,0|3,0,0]=4 1152 B13R1.446 Cc1ccc(cc1C(=O)CCF)F 1458a_100000240043_100011217306 [0,1,0,0,0,0|3,0,0]=4 1153 B13R1.446 Cc1ccc(cc1C(=O)CCF)I 1458a_100000688012_100011217306 [0,1,0,0,0,0|3,0,0]=4 1154 B13R1.446 Cc1ccc(cc1C(=O)CCF)O 1458a_100000687834_100011217306 [0,1,0,0,0,0|3,0,0]=4 1155 B13R1.446 Cc1ccc(cc1C(=O)CCO)Br 1458a_100000759961_100000211926 [0,1,0,0,0,0|3,0,0]=4 1156 B13R1.446 Cc1ccc(cc1C(=O)CCO)Cl 1458a_100000692595_100000211926 [0,1,0,0,0,0|3,0,0]=4 1157 B13R1.446 Cc1ccc(cc1C(=O)CCO)F 1458a_100000240043_100000211926 [0,1,0,0,0,0|3,0,0]=4 1158 B13R1.446 Cc1ccc(cc1C(=O)CCO)I 1458a_100000688012_100000211926 [0,1,0,0,0,0|3,0,0]=4 1159 B13R1.446 Cc1ccc(cc1C(=O)CCO)O 1458a_100000687834_100000211926 [0,1,0,0,0,0|3,0,0]=4 1160 B13R1.446 N#CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011214920 [0,1,0,0,0,0|2,0,1]=4 1161 B13R1.446 N#CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011214920 [0,1,0,0,0,0|2,0,1]=4 1162 B13R1.446 N#CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011214920 [0,1,0,0,0,0|2,0,1]=4 1163 B13R1.446 N#CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011214920 [0,1,0,0,0,0|2,0,1]=4 1164 B13R1.446 N#CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011214920 [0,1,0,0,0,0|2,0,1]=4 1165 B13R1.446 O=C(CCF)c1cc(ccc1Br)Br 1458a_100000690610_100011217306 [0,1,0,0,0,0|3,0,0]=4 1166 B13R1.446 O=C(CCF)c1cc(ccc1Br)Cl 1458a_100000736951_100011217306 [0,1,0,0,0,0|3,0,0]=4 1167 B13R1.446 O=C(CCF)c1cc(ccc1Br)F 1458a_100000212315_100011217306 [0,1,0,0,0,0|3,0,0]=4 1168 B13R1.446 O=C(CCF)c1cc(ccc1Br)I 1458a_100000698340_100011217306 [0,1,0,0,0,0|3,0,0]=4 1169 B13R1.446 O=C(CCF)c1cc(ccc1Br)O 1458a_100012352043_100011217306 [0,1,0,0,0,0|3,0,0]=4 1170 B13R1.446 O=C(CCF)c1cc(ccc1Cl)Br 1458a_100000211212_100011217306 [0,1,0,0,0,0|3,0,0]=4 1171 B13R1.446 O=C(CCF)c1cc(ccc1Cl)Cl 1458a_100000210642_100011217306 [0,1,0,0,0,0|3,0,0]=4 1172 B13R1.446 O=C(CCF)c1cc(ccc1Cl)F 1458a_100011219680_100011217306 [0,1,0,0,0,0|3,0,0]=4 1173 B13R1.446 O=C(CCF)c1cc(ccc1Cl)I 1458a_100000688013_100011217306 [0,1,0,0,0,0|3,0,0]=4 1174 B13R1.446 O=C(CCF)c1cc(ccc1Cl)O 1458a_100000719527_100011217306 [0,1,0,0,0,0|3,0,0]=4 1175 B13R1.446 O=C(CCF)c1cc(ccc1F)Br 1458a_100000212322_100011217306 [0,1,0,0,0,0|3,0,0]=4 1176 B13R1.446 O=C(CCF)c1cc(ccc1F)Cl 1458a_100000214954_100011217306 [0,1,0,0,0,0|3,0,0]=4 1177 B13R1.446 O=C(CCF)c1cc(ccc1F)F 1458a_100000198512_100011217306 [0,1,0,0,0,0|3,0,0]=4 1178 B13R1.446 O=C(CCF)c1cc(ccc1F)I 1458a_100000688014_100011217306 [0,1,0,0,0,0|3,0,0]=4 1179 B13R1.446 O=C(CCF)c1cc(ccc1F)O 1458a_100000037260_100011217306 [0,1,0,0,0,0|3,0,0]=4 1180 B13R1.446 O=C(CCF)c1cc(ccc1I)Br 1458a_100000183945_100011217306 [0,1,0,0,0,0|3,0,0]=4 1181 B13R1.446 O=C(CCF)c1cc(ccc1I)Cl 1458a_100000739379_100011217306 [0,1,0,0,0,0|3,0,0]=4 1182 B13R1.446 O=C(CCF)c1cc(ccc1I)F 1458a_100000748905_100011217306 [0,1,0,0,0,0|3,0,0]=4 1183 B13R1.446 O=C(CCF)c1cc(ccc1I)I 1458a_100000750460_100011217306 [0,1,0,0,0,0|3,0,0]=4 1184 B13R1.446 O=C(CCF)c1cc(ccc1I)O 1458a_200009995701_100011217306 [0,1,0,0,0,0|3,0,0]=4 1185 B13R1.446 O=C(CCF)c1cc(ccc1O)Br 1458a_100000212140_100011217306 [0,1,0,0,0,0|2,0,0]=3 1186 B13R1.446 O=C(CCF)c1cc(ccc1O)Cl 1458a_100000212143_100011217306 [0,1,0,0,0,0|2,0,0]=3 1187 B13R1.446 O=C(CCF)c1cc(ccc1O)F 1458a_100000742286_100011217306 [0,1,0,0,0,0|2,0,0]=3 1188 B13R1.446 O=C(CCF)c1cc(ccc1O)I 1458a_100000212111_100011217306 [0,1,0,0,0,0|2,0,0]=3 1189 B13R1.446 O=C(CCF)c1cc(ccc1O)O 1458a_100000758025_100011217306 [0,1,0,0,0,0|2,0,0]=3 1190 B13R1.446 O=C(CCO)c1cc(ccc1Br)Br 1458a_100000690610_100000211926 [0,1,0,0,0,0|3,0,0]=4 1191 B13R1.446 O=C(CCO)c1cc(ccc1Br)Cl 1458a_100000736951_100000211926 [0,1,0,0,0,0|3,0,0]=4 1192 B13R1.446 O=C(CCO)c1cc(ccc1Br)F 1458a_100000212315_100000211926 [0,1,0,0,0,0|3,0,0]=4 1193 B13R1.446 O=C(CCO)c1cc(ccc1Br)I 1458a_100000698340_100000211926 [0,1,0,0,0,0|3,0,0]=4 1194 B13R1.446 O=C(CCO)c1cc(ccc1Br)O 1458a_100012352043_100000211926 [0,1,0,0,0,0|3,0,0]=4 1195 B13R1.446 O=C(CCO)c1cc(ccc1Cl)Br 1458a_100000211212_100000211926 [0,1,0,0,0,0|3,0,0]=4 1196 B13R1.446 O=C(CCO)c1cc(ccc1Cl)Cl 1458a_100000210642_100000211926 [0,1,0,0,0,0|3,0,0]=4 1197 B13R1.446 O=C(CCO)c1cc(ccc1Cl)F 1458a_100011219680_100000211926 [0,1,0,0,0,0|3,0,0]=4 1198 B13R1.446 O=C(CCO)c1cc(ccc1Cl)I 1458a_100000688013_100000211926 [0,1,0,0,0,0|3,0,0]=4 1199 B13R1.446 O=C(CCO)c1cc(ccc1Cl)O 1458a_100000719527_100000211926 [0,1,0,0,0,0|3,0,0]=4 1200 B13R1.446 O=C(CCO)c1cc(ccc1F)Br 1458a_100000212322_100000211926 [0,1,0,0,0,0|3,0,0]=4 1201 B13R1.446 O=C(CCO)c1cc(ccc1F)Cl 1458a_100000214954_100000211926 [0,1,0,0,0,0|3,0,0]=4 1202 B13R1.446 O=C(CCO)c1cc(ccc1F)F 1458a_100000198512_100000211926 [0,1,0,0,0,0|3,0,0]=4 1203 B13R1.446 O=C(CCO)c1cc(ccc1F)I 1458a_100000688014_100000211926 [0,1,0,0,0,0|3,0,0]=4 1204 B13R1.446 O=C(CCO)c1cc(ccc1F)O 1458a_100000037260_100000211926 [0,1,0,0,0,0|3,0,0]=4 1205 B13R1.446 O=C(CCO)c1cc(ccc1I)Br 1458a_100000183945_100000211926 [0,1,0,0,0,0|3,0,0]=4 1206 B13R1.446 O=C(CCO)c1cc(ccc1I)Cl 1458a_100000739379_100000211926 [0,1,0,0,0,0|3,0,0]=4 1207 B13R1.446 O=C(CCO)c1cc(ccc1I)F 1458a_100000748905_100000211926 [0,1,0,0,0,0|3,0,0]=4 1208 B13R1.446 O=C(CCO)c1cc(ccc1I)I 1458a_100000750460_100000211926 [0,1,0,0,0,0|3,0,0]=4 1209 B13R1.446 O=C(CCO)c1cc(ccc1I)O 1458a_200009995701_100000211926 [0,1,0,0,0,0|3,0,0]=4 1210 B13R1.446 O=C(CCO)c1cc(ccc1O)Br 1458a_100000212140_100000211926 [0,1,0,0,0,0|2,0,0]=3 1211 B13R1.446 O=C(CCO)c1cc(ccc1O)Cl 1458a_100000212143_100000211926 [0,1,0,0,0,0|2,0,0]=3 1212 B13R1.446 O=C(CCO)c1cc(ccc1O)F 1458a_100000742286_100000211926 [0,1,0,0,0,0|2,0,0]=3 1213 B13R1.446 O=C(CCO)c1cc(ccc1O)I 1458a_100000212111_100000211926 [0,1,0,0,0,0|2,0,0]=3 1214 B13R1.446 O=C(CCO)c1cc(ccc1O)O 1458a_100000758025_100000211926 [0,1,0,0,0,0|2,0,0]=3 1215 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_200025704644 [0,1,0,0,0,0|3,0,0]=4 1216 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_200025704644 [0,1,0,0,0,0|3,0,0]=4 1217 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Cl)F 62a_200010187420_200025704644 [0,1,0,0,0,0|3,0,0]=4 1218 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Cl)F 62a_200025704644_200010187420 [0,1,0,0,0,0|3,0,0]=4 1219 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1F)F 62a_100000211571_200025704644 [0,1,0,0,0,0|3,0,0]=4 1220 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1F)F 62a_200025704644_100000211571 [0,1,0,0,0,0|3,0,0]=4 1221 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)Br 62a_200009828000_200025704644 [0,1,0,0,0,0|2,0,0]=3 1222 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)Cl 62a_200009816716_200025704644 [0,1,0,0,0,0|2,0,0]=3 1223 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)F 62a_100009814381_200025704644 [0,1,0,0,0,0|2,0,0]=3 1224 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)F 62a_200025704644_100009814381 [0,1,0,0,0,0|2,0,0]=3 1225 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)O 62a_100009814097_200025704644 [0,1,0,0,0,0|2,0,0]=3 1226 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)O 62a_200025704644_100009814097 [0,1,0,0,0,0|2,0,0]=3 1227 B13R1.464 C#CCC(=O)c1ccccc1CO 1458a_100011301526_100000184674 [0,1,0,0,0,0|1,0,2]=4 1228 B13R1.464 C#CCC(=O)c1ccccc1OC 1458a_100000185835_100000184674 [0,1,0,0,0,0|1,0,2]=4 1229 B13R1.464 C#Cc1ccccc1C(=O)CCC 1458a_100011243808_100000210303 [0,1,0,0,0,0|2,0,0]=3 1230 B13R1.464 C#Cc1ccccc1C(=O)CCF 1458a_100011243808_100011217306 [0,1,0,0,0,0|3,0,0]=4 1231 B13R1.464 C#Cc1ccccc1C(=O)CCO 1458a_100011243808_100000211926 [0,1,0,0,0,0|3,0,0]=4 1232 B13R1.464 C#Cc1ccccc1C(=O)NCC 527a_100015525214_100011243808 [0,1,0,0,0,0|2,0,0]=3 1233 B13R1.464 C#Cc1ccccc1C(=O)NNC 22a_100016993582_100011243808 [0,1,0,0,0,0|3,0,0]=4 1234 B13R1.464 C=CCC(=O)c1ccccc1CO 1458a_100011301526_100000210623 [0,1,0,0,0,0|1,0,2]=4 1235 B13R1.464 C=CCC(=O)c1ccccc1OC 1458a_100000185835_100000210623 [0,1,0,0,0,0|1,0,2]=4 1236 B13R1.464 C=COC(=O)c1ccccc1SC 62a_200000036168_200000210301 [0,1,0,0,0,0|0,1,2]=4 1237 B13R1.464 C=COC(=O)c1ccccc1SC 62a_200000210301_200000036168 [0,1,0,0,0,0|0,1,2]=4 1238 B13R1.464 C=COC(=O)c1ccccc1S[13CH3] 62a_200000036168_200025704644 [0,1,0,0,0,0|0,1,2]=4 1239 B13R1.464 C=COC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000036168 [0,1,0,0,0,0|0,1,2]=4 1240 B13R1.464 C=Cc1ccccc1C(=O)CCC 1458a_100011830265_100000210303 [0,1,0,0,0,0|2,0,0]=3 1241 B13R1.464 C=Cc1ccccc1C(=O)CCF 1458a_100011830265_100011217306 [0,1,0,0,0,0|3,0,0]=4 1242 B13R1.464 C=Cc1ccccc1C(=O)CCO 1458a_100011830265_100000211926 [0,1,0,0,0,0|3,0,0]=4 1243 B13R1.464 C=Cc1ccccc1C(=O)NCC 271570a_100011290941_200000155173 [0,1,0,0,0,0|2,0,0]=3 1244 B13R1.464 C=Cc1ccccc1C(=O)NNC 22a_100016993582_100011830265 [0,1,0,0,0,0|3,0,0]=4 1245 B13R1.464 C=Cc1ccccc1C(=O)OCC 271570a_100011290941_100000169879 [0,1,0,0,0,0|1,0,0]=2 1246 B13R1.464 C=Cc1cccnc1C(=O)OCC 271570a_100011290941_100012351660 [0,1,0,0,0,0|2,0,0]=3 1247 B13R1.464 C=Cc1ccncc1C(=O)OCC 271570a_100011290941_100016987518 [0,1,0,0,0,0|2,0,0]=3 1248 B13R1.464 C=Cc1cnccc1C(=O)OCC 271570a_100011290941_100010238393 [0,1,0,0,0,0|2,0,0]=3 1249 B13R1.464 C=Cc1cncnc1C(=O)OCC 271570a_100011290941_100012344254 [0,1,0,0,0,0|3,0,0]=4 1250 B13R1.464 C=Cc1ncccc1C(=O)NCC 271570a_100011290941_100000160120 [0,1,0,0,0,0|3,0,0]=4 1251 B13R1.464 C=Cc1ncccc1C(=O)OCC 271570a_100011290941_100000170124 [0,1,0,0,0,0|2,0,0]=3 1252 B13R1.464 C=Cc1ncncc1C(=O)OCC 271570a_100011290941_100011998183 [0,1,0,0,0,0|3,0,0]=4 1253 B13R1.464 CCCC(=O)c1ccccc1C#N 1458a_100000742908_100000210303 [0,1,0,0,0,0|2,0,0]=3 1254 B13R1.464 CCCC(=O)c1ccccc1CC 1458a_100000689120_100000210303 [0,1,0,0,0,0|2,0,0]=3 1255 B13R1.464 CCCC(=O)c1ccccc1CO 1458a_100011301526_100000210303 [0,1,0,0,0,0|1,0,0]=2 1256 B13R1.464 CCCC(=O)c1ccccc1I=O 1458a_100000032414_100000210303 [0,1,0,0,0,0|1,0,1]=3 1257 B13R1.464 CCCC(=O)c1ccccc1OC 1458a_100000185835_100000210303 [0,1,0,0,0,0|1,0,0]=2 1258 B13R1.464 CCCC(=O)c1ccccc1OC 34a_200000073644_200000210301 [0,1,0,0,0,0|1,0,0]=2 1259 B13R1.464 CCCC(=O)c1ccccc1OC 7a_200000073644_200000210301 [0,1,0,0,0,0|1,0,0]=2 1260 B13R1.464 CCCC(=O)c1ccccc1O[13CH3] 34a_200000073644_200025704644 [0,1,0,0,0,0|1,0,0]=2 1261 B13R1.464 CCCC(=O)c1ccccc1O[13CH3] 7a_200000073644_200025704644 [0,1,0,0,0,0|1,0,0]=2 1262 B13R1.464 CCCC(=O)c1ccccc1SC 1458a_100000183967_100000210303 [0,1,0,0,0,0|1,1,0]=3 1263 B13R1.464 CCCN(C)c1ccccc1OC 2230a_100000219746_100000210303 [0,1,0,0,0,0|3,0,0]=4 1264 B13R1.464 CCCN(C)c1ccccc1OC 269982a_100000219746_100000210303 [0,1,0,0,0,0|3,0,0]=4 1265 B13R1.464 CCCN(C)c1ccccc1OC 34a_100000219746_100000210303 [0,1,0,0,0,0|3,0,0]=4 1266 B13R1.464 CCNC(=O)c1ccccc1C#N 11a_100015525214_100000742908 [0,1,0,0,0,0|2,0,0]=3 1267 B13R1.464 CCNC(=O)c1ccccc1C#N 527a_100015525214_100000742908 [0,1,0,0,0,0|2,0,0]=3 1268 B13R1.464 CCNC(=O)c1ccccc1CC 11a_100015525214_100000689120 [0,1,0,0,0,0|2,0,0]=3 1269 B13R1.464 CCNC(=O)c1ccccc1CC 240690a_100015525214_100000689120 [0,1,0,0,0,0|2,0,0]=3 1270 B13R1.464 CCNC(=O)c1ccccc1CC 527a_100015525214_100000689120 [0,1,0,0,0,0|2,0,0]=3 1271 B13R1.464 CCNC(=O)c1ccccc1I=O 240690a_100015525214_100000032414 [0,1,0,0,0,0|1,0,1]=3 1272 B13R1.464 CCNC(=O)c1ccccc1I=O 527a_100015525214_100000032414 [0,1,0,0,0,0|1,0,1]=3 1273 B13R1.464 CCNC(=O)c1ccccc1NC 27a_100102657272_200000155173 [0,1,0,0,0,0|2,0,0]=3 1274 B13R1.464 CCNC(=O)c1ccccc1NC 34a_100000205978_200000210301 [0,1,0,0,0,0|2,0,0]=3 1275 B13R1.464 CCNC(=O)c1ccccc1N[13CH3] 34a_100000205978_200025704644 [0,1,0,0,0,0|2,0,0]=3 1276 B13R1.464 CCNC(=O)c1ccccc1OC 11a_100015525214_100000185835 [0,1,0,0,0,0|1,0,0]=2 1277 B13R1.464 CCNC(=O)c1ccccc1OC 240690a_100015525214_100000185835 [0,1,0,0,0,0|1,0,0]=2 1278 B13R1.464 CCNC(=O)c1ccccc1OC 34a_100000192205_200000210301 [0,1,0,0,0,0|1,0,0]=2 1279 B13R1.464 CCNC(=O)c1ccccc1OC 527a_100015525214_100000185835 [0,1,0,0,0,0|1,0,0]=2 1280 B13R1.464 CCNC(=O)c1ccccc1OC 7a_100000192205_200000210301 [0,1,0,0,0,0|1,0,0]=2 1281 B13R1.464 CCNC(=O)c1ccccc1O[13CH3] 34a_100000192205_200025704644 [0,1,0,0,0,0|1,0,0]=2 1282 B13R1.464 CCNC(=O)c1ccccc1O[13CH3] 7a_100000192205_200025704644 [0,1,0,0,0,0|1,0,0]=2 1283 B13R1.464 CCNC(=O)c1ccccc1SC 11a_100015525214_100000183967 [0,1,0,0,0,0|1,1,0]=3 1284 B13R1.464 CCNC(=O)c1ccccc1SC 240690a_100015525214_100000183967 [0,1,0,0,0,0|1,1,0]=3 1285 B13R1.464 CCNC(=O)c1ccccc1SC 527a_100015525214_100000183967 [0,1,0,0,0,0|1,1,0]=3 1286 B13R1.464 CCNC(=O)c1ccccc1SC 62a_200000155173_200000210301 [0,1,0,0,0,0|1,1,0]=3 1287 B13R1.464 CCNC(=O)c1ccccc1SC 62a_200000210301_200000155173 [0,1,0,0,0,0|1,1,0]=3 1288 B13R1.464 CCNC(=O)c1ccccc1S[13CH3] 62a_200000155173_200025704644 [0,1,0,0,0,0|1,1,0]=3 1289 B13R1.464 CCNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000155173 [0,1,0,0,0,0|1,1,0]=3 1290 B13R1.464 CCNC(=O)c1cccnc1NC 27a_100102657272_100000160120 [0,1,0,0,0,0|3,0,0]=4 1291 B13R1.464 CCNC(=O)c1cccnc1SC 62a_200000210301_100000160120 [0,1,0,0,0,0|2,1,0]=4 1292 B13R1.464 CCNC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000160120 [0,1,0,0,0,0|2,1,0]=4 1293 B13R1.464 CCNC(C)c1ccccc1OC 2230a_100000185323_100000210202 [0,1,0,0,0,0|2,0,1]=4 1294 B13R1.464 CCNC(C)c1ccccc1OC 269862a_100015525214_100000173324 [0,1,0,0,0,0|2,0,1]=4 1295 B13R1.464 CCOC(=O)c1ccccc1OC 7a_100000169922_200000210301 [0,1,0,0,0,0|0,0,0]=1 1296 B13R1.464 CCOC(=O)c1ccccc1O[13CH3] 7a_100000169922_200025704644 [0,1,0,0,0,0|0,0,0]=1 1297 B13R1.464 CCOC(=O)c1ccccc1SC 62a_100000169876_200000210301 [0,1,0,0,0,0|0,1,0]=2 1298 B13R1.464 CCOC(=O)c1ccccc1SC 62a_200000210301_100000169879 [0,1,0,0,0,0|0,1,0]=2 1299 B13R1.464 CCOC(=O)c1ccccc1S[13CH3] 62a_100000169876_200025704644 [0,1,0,0,0,0|0,1,0]=2 1300 B13R1.464 CCOC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000169879 [0,1,0,0,0,0|0,1,0]=2 1301 B13R1.464 CCOC(=O)c1cccnc1NC 27a_100102657272_100000170124 [0,1,0,0,0,0|2,0,0]=3 1302 B13R1.464 CCOC(=O)c1cccnc1SC 62a_100011291640_200000210301 [0,1,0,0,0,0|1,1,0]=3 1303 B13R1.464 CCOC(=O)c1cccnc1SC 62a_200000210301_100000170124 [0,1,0,0,0,0|1,1,0]=3 1304 B13R1.464 CCOC(=O)c1cccnc1S[13CH3] 62a_100011291640_200025704644 [0,1,0,0,0,0|1,1,0]=3 1305 B13R1.464 CCOC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000170124 [0,1,0,0,0,0|1,1,0]=3 1306 B13R1.464 CCOC(=O)c1ccncc1SC 62a_100010238393_200000210301 [0,1,0,0,0,0|1,1,0]=3 1307 B13R1.464 CCOC(=O)c1ccncc1SC 62a_200000210301_100010238393 [0,1,0,0,0,0|1,1,0]=3 1308 B13R1.464 CCOC(=O)c1ccncc1S[13CH3] 62a_100010238393_200025704644 [0,1,0,0,0,0|1,1,0]=3 1309 B13R1.464 CCOC(=O)c1ccncc1S[13CH3] 62a_200025704644_100010238393 [0,1,0,0,0,0|1,1,0]=3 1310 B13R1.464 CCOC(=O)c1cnccc1NC 27a_100102657272_100016987518 [0,1,0,0,0,0|2,0,0]=3 1311 B13R1.464 CCOC(=O)c1cnccc1SC 62a_200000210301_100016987518 [0,1,0,0,0,0|1,1,0]=3 1312 B13R1.464 CCOC(=O)c1cnccc1S[13CH3] 62a_200025704644_100016987518 [0,1,0,0,0,0|1,1,0]=3 1313 B13R1.464 CCOC(=O)c1cncnc1NC 27a_100102657272_100011998183 [0,1,0,0,0,0|3,0,0]=4 1314 B13R1.464 CCOC(=O)c1cncnc1SC 62a_200000210301_100011998183 [0,1,0,0,0,0|2,1,0]=4 1315 B13R1.464 CCOC(=O)c1cncnc1S[13CH3] 62a_200025704644_100011998183 [0,1,0,0,0,0|2,1,0]=4 1316 B13R1.464 CCOC(=O)c1ncccc1OC 7a_200011376064_200000210301 [0,1,0,0,0,0|1,0,0]=2 1317 B13R1.464 CCOC(=O)c1ncccc1O[13CH3] 7a_200011376064_200025704644 [0,1,0,0,0,0|1,0,0]=2 1318 B13R1.464 CCOC(=O)c1ncccc1SC 62a_100012351660_200000210301 [0,1,0,0,0,0|1,1,0]=3 1319 B13R1.464 CCOC(=O)c1ncccc1SC 62a_200000210301_100012351660 [0,1,0,0,0,0|1,1,0]=3 1320 B13R1.464 CCOC(=O)c1ncccc1S[13CH3] 62a_100012351660_200025704644 [0,1,0,0,0,0|1,1,0]=3 1321 B13R1.464 CCOC(=O)c1ncccc1S[13CH3] 62a_200025704644_100012351660 [0,1,0,0,0,0|1,1,0]=3 1322 B13R1.464 CCOC(=O)c1nccnc1NC 27a_100102657272_100000085455 [0,1,0,0,0,0|3,0,0]=4 1323 B13R1.464 CCOC(=O)c1nccnc1SC 62a_200000210301_100000085455 [0,1,0,0,0,0|2,1,0]=4 1324 B13R1.464 CCOC(=O)c1nccnc1S[13CH3] 62a_200025704644_100000085455 [0,1,0,0,0,0|2,1,0]=4 1325 B13R1.464 CCOC(=O)c1ncncc1NC 27a_100102657272_100012344254 [0,1,0,0,0,0|3,0,0]=4 1326 B13R1.464 CCOC(=O)c1ncncc1SC 62a_100012344254_200000210301 [0,1,0,0,0,0|2,1,0]=4 1327 B13R1.464 CCOC(=O)c1ncncc1SC 62a_200000210301_100012344254 [0,1,0,0,0,0|2,1,0]=4 1328 B13R1.464 CCOC(=O)c1ncncc1S[13CH3] 62a_100012344254_200025704644 [0,1,0,0,0,0|2,1,0]=4 1329 B13R1.464 CCOC(=O)c1ncncc1S[13CH3] 62a_200025704644_100012344254 [0,1,0,0,0,0|2,1,0]=4 1330 B13R1.464 CCOC(C)c1ccccc1OC 7a_100000742714_100000210202 [0,1,0,0,0,0|1,0,1]=3 1331 B13R1.464 CCc1ccccc1C(=O)CCF 1458a_100000689120_100011217306 [0,1,0,0,0,0|3,0,0]=4 1332 B13R1.464 CCc1ccccc1C(=O)CCO 1458a_100000689120_100000211926 [0,1,0,0,0,0|3,0,0]=4 1333 B13R1.464 CCc1ccccc1C(=O)NNC 22a_100016993582_100000689120 [0,1,0,0,0,0|3,0,0]=4 1334 B13R1.464 CNCC(=O)c1ccccc1OC 34a_100102657272_100000195505 [0,1,0,0,0,0|2,0,0]=3 1335 B13R1.464 CNCC(=O)c1ccccc1OC 7a_106832991635_100000195505 [0,1,0,0,0,0|2,0,0]=3 1336 B13R1.464 CNNC(=O)c1ccccc1C#N 22a_100016993582_100000742908 [0,1,0,0,0,0|3,0,0]=4 1337 B13R1.464 CNNC(=O)c1ccccc1I=O 22a_100016993582_100000032414 [0,1,0,0,0,0|2,0,1]=4 1338 B13R1.464 CNNC(=O)c1ccccc1OC 22a_100016993582_100000185835 [0,1,0,0,0,0|2,0,0]=3 1339 B13R1.464 CNNC(=O)c1ccccc1SC 22a_100016993582_100000183967 [0,1,0,0,0,0|2,1,0]=4 1340 B13R1.464 CNc1ccccc1C(=O)NOC 34a_100011599994_200000210301 [0,1,0,0,0,0|3,0,0]=4 1341 B13R1.464 COCC(=O)c1ccccc1OC 34a_100138415774_100000195505 [0,1,0,0,0,0|2,0,0]=3 1342 B13R1.464 CONC(=O)c1ccccc1N[13CH3] 34a_100011599994_200025704644 [0,1,0,0,0,0|3,0,0]=4 1343 B13R1.464 COc1ccccc1C(=O)CC#N 1458a_100000185835_100011214920 [0,1,0,0,0,0|2,0,1]=4 1344 B13R1.464 COc1ccccc1C(=O)CC#N 7a_200009873261_200000210301 [0,1,0,0,0,0|2,0,1]=4 1345 B13R1.464 COc1ccccc1C(=O)CCCl 7a_100009873196_200000210301 [0,1,0,0,0,0|2,0,0]=3 1346 B13R1.464 COc1ccccc1C(=O)CCF 1458a_100000185835_100011217306 [0,1,0,0,0,0|2,0,0]=3 1347 B13R1.464 COc1ccccc1C(=O)CCO 1458a_100000185835_100000211926 [0,1,0,0,0,0|2,0,0]=3 1348 B13R1.464 COc1ccccc1C(=O)CSC 62a_100000195505_200000210301 [0,1,0,0,0,0|2,0,0]=3 1349 B13R1.464 COc1ccccc1C(=O)CS[13CH3] 62a_100000195505_200025704644 [0,1,0,0,0,0|2,0,0]=3 1350 B13R1.464 COc1ccccc1C(C)OCF 7a_100000742714_100015361967 [0,1,0,0,0,0|2,0,1]=4 1351 B13R1.464 CSc1ccccc1C(=O)CCF 1458a_100000183967_100011217306 [0,1,0,0,0,0|2,1,0]=4 1352 B13R1.464 CSc1ccccc1C(=O)CCO 1458a_100000183967_100000211926 [0,1,0,0,0,0|2,1,0]=4 1353 B13R1.464 N#CCC(=O)c1ccccc1CO 1458a_100011301526_100011214920 [0,1,0,0,0,0|2,0,1]=4 1354 B13R1.464 N#Cc1ccccc1C(=O)CCF 1458a_100000742908_100011217306 [0,1,0,0,0,0|3,0,0]=4 1355 B13R1.464 N#Cc1ccccc1C(=O)CCO 1458a_100000742908_100000211926 [0,1,0,0,0,0|3,0,0]=4 1356 B13R1.464 O=C(CCF)c1ccccc1CO 1458a_100011301526_100011217306 [0,1,0,0,0,0|2,0,0]=3 1357 B13R1.464 O=C(CCO)c1ccccc1CO 1458a_100011301526_100000211926 [0,1,0,0,0,0|2,0,0]=3 1358 B13R1.464 O=Ic1ccccc1C(=O)CCF 1458a_100000032414_100011217306 [0,1,0,0,0,0|2,0,1]=4 1359 B13R1.464 O=Ic1ccccc1C(=O)CCO 1458a_100000032414_100000211926 [0,1,0,0,0,0|2,0,1]=4 1360 B13R1.464 [13CH3]Oc1ccccc1C(=O)CC#N 7a_200009873261_200025704644 [0,1,0,0,0,0|2,0,1]=4 1361 B13R1.464 [13CH3]Oc1ccccc1C(=O)CCCl 7a_100009873196_200025704644 [0,1,0,0,0,0|2,0,0]=3 1362 B13R1.674 C#CCCC(=O)c1ccccc1Br 1458a_100000188424_100000753159 [0,1,0,0,0,0|2,0,1]=4 1363 B13R1.674 C#CCCC(=O)c1ccccc1C 1458a_100000212026_100000753159 [0,1,0,0,0,0|2,0,1]=4 1364 B13R1.674 C#CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000753159 [0,1,0,0,0,0|2,0,1]=4 1365 B13R1.674 C#CCCC(=O)c1ccccc1F 1458a_100000188656_100000753159 [0,1,0,0,0,0|2,0,1]=4 1366 B13R1.674 C#CCCC(=O)c1ccccc1I 1458a_100000187884_100000753159 [0,1,0,0,0,0|2,0,1]=4 1367 B13R1.674 C#CCCC(=O)c1ccccc1O 1458a_100015234032_100000753159 [0,1,0,0,0,0|1,0,1]=3 1368 B13R1.674 C#CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000753159 [0,1,0,0,0,0|1,0,2]=4 1369 B13R1.674 C#CCNC(=O)c1ccccc1Br 11a_100000212058_100000188424 [0,1,0,0,0,0|2,0,1]=4 1370 B13R1.674 C#CCNC(=O)c1ccccc1Br 1626a_100000212058_100000188424 [0,1,0,0,0,0|2,0,1]=4 1371 B13R1.674 C#CCNC(=O)c1ccccc1Br 240690a_100000212058_100000188424 [0,1,0,0,0,0|2,0,1]=4 1372 B13R1.674 C#CCNC(=O)c1ccccc1Br 527a_100000212058_100000188424 [0,1,0,0,0,0|2,0,1]=4 1373 B13R1.674 C#CCNC(=O)c1ccccc1C 11a_100000212058_100000212026 [0,1,0,0,0,0|2,0,1]=4 1374 B13R1.674 C#CCNC(=O)c1ccccc1C 1626a_100000212058_100000212026 [0,1,0,0,0,0|2,0,1]=4 1375 B13R1.674 C#CCNC(=O)c1ccccc1C 240690a_100000212058_100000212026 [0,1,0,0,0,0|2,0,1]=4 1376 B13R1.674 C#CCNC(=O)c1ccccc1C 527a_100000212058_100000212026 [0,1,0,0,0,0|2,0,1]=4 1377 B13R1.674 C#CCNC(=O)c1ccccc1Cl 11a_100000212058_100000185844 [0,1,0,0,0,0|2,0,1]=4 1378 B13R1.674 C#CCNC(=O)c1ccccc1Cl 1626a_100000212058_100000185844 [0,1,0,0,0,0|2,0,1]=4 1379 B13R1.674 C#CCNC(=O)c1ccccc1Cl 240690a_100000212058_100000185844 [0,1,0,0,0,0|2,0,1]=4 1380 B13R1.674 C#CCNC(=O)c1ccccc1Cl 527a_100000212058_100000185844 [0,1,0,0,0,0|2,0,1]=4 1381 B13R1.674 C#CCNC(=O)c1ccccc1F 11a_100000212058_100000188656 [0,1,0,0,0,0|2,0,1]=4 1382 B13R1.674 C#CCNC(=O)c1ccccc1F 1626a_100000212058_100000188656 [0,1,0,0,0,0|2,0,1]=4 1383 B13R1.674 C#CCNC(=O)c1ccccc1F 240690a_100000212058_100000188656 [0,1,0,0,0,0|2,0,1]=4 1384 B13R1.674 C#CCNC(=O)c1ccccc1F 527a_100000212058_100000188656 [0,1,0,0,0,0|2,0,1]=4 1385 B13R1.674 C#CCNC(=O)c1ccccc1I 11a_100000212058_100000187884 [0,1,0,0,0,0|2,0,1]=4 1386 B13R1.674 C#CCNC(=O)c1ccccc1I 1626a_100000212058_100000187884 [0,1,0,0,0,0|2,0,1]=4 1387 B13R1.674 C#CCNC(=O)c1ccccc1I 240690a_100000212058_100000187884 [0,1,0,0,0,0|2,0,1]=4 1388 B13R1.674 C#CCNC(=O)c1ccccc1I 527a_100000212058_100000187884 [0,1,0,0,0,0|2,0,1]=4 1389 B13R1.674 C#CCNC(=O)c1ccccc1O 240690a_100000212058_100015234032 [0,1,0,0,0,0|1,0,1]=3 1390 B13R1.674 C#CCNC(=O)c1ccccc1[O-] 1626a_100000212058_100009911694 [0,1,0,0,0,0|1,0,2]=4 1391 B13R1.674 C#CCNC(=O)c1ccccc1[O-] 240690a_100000212058_100009911694 [0,1,0,0,0,0|1,0,2]=4 1392 B13R1.674 C#CCNC(=O)c1ccccc1[O-] 527a_100000212058_100009911694 [0,1,0,0,0,0|1,0,2]=4 1393 B13R1.674 C/C=C/CC(=O)c1ccccc1Br 1458a_100000188424_100102629194 [0,1,0,0,0,0|2,0,1]=4 1394 B13R1.674 C/C=C/CC(=O)c1ccccc1C 1458a_100000212026_100102629194 [0,1,0,0,0,0|2,0,1]=4 1395 B13R1.674 C/C=C/CC(=O)c1ccccc1Cl 1458a_100000185844_100102629194 [0,1,0,0,0,0|2,0,1]=4 1396 B13R1.674 C/C=C/CC(=O)c1ccccc1F 1458a_100000188656_100102629194 [0,1,0,0,0,0|2,0,1]=4 1397 B13R1.674 C/C=C/CC(=O)c1ccccc1I 1458a_100000187884_100102629194 [0,1,0,0,0,0|2,0,1]=4 1398 B13R1.674 C/C=C/CC(=O)c1ccccc1O 1458a_100015234032_100102629194 [0,1,0,0,0,0|1,0,1]=3 1399 B13R1.674 C/C=C/CC(=O)c1ccccc1[O-] 1458a_100009911694_100102629194 [0,1,0,0,0,0|1,0,2]=4 1400 B13R1.674 C=CCCC(=O)c1ccccc1Br 1458a_100000188424_100000754431 [0,1,0,0,0,0|2,0,1]=4 1401 B13R1.674 C=CCCC(=O)c1ccccc1C 1458a_100000212026_100000754431 [0,1,0,0,0,0|2,0,1]=4 1402 B13R1.674 C=CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000754431 [0,1,0,0,0,0|2,0,1]=4 1403 B13R1.674 C=CCCC(=O)c1ccccc1F 1458a_100000188656_100000754431 [0,1,0,0,0,0|2,0,1]=4 1404 B13R1.674 C=CCCC(=O)c1ccccc1I 1458a_100000187884_100000754431 [0,1,0,0,0,0|2,0,1]=4 1405 B13R1.674 C=CCCC(=O)c1ccccc1O 1458a_100015234032_100000754431 [0,1,0,0,0,0|1,0,1]=3 1406 B13R1.674 C=CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000754431 [0,1,0,0,0,0|1,0,2]=4 1407 B13R1.674 C=CCNC(=O)c1ccccc1Br 1626a_100020586998_100000188424 [0,1,0,0,0,0|2,0,1]=4 1408 B13R1.674 C=CCNC(=O)c1ccccc1Br 240690a_100020586998_100000188424 [0,1,0,0,0,0|2,0,1]=4 1409 B13R1.674 C=CCNC(=O)c1ccccc1Br 527a_100020586998_100000188424 [0,1,0,0,0,0|2,0,1]=4 1410 B13R1.674 C=CCNC(=O)c1ccccc1C 1626a_100020586998_100000212026 [0,1,0,0,0,0|2,0,1]=4 1411 B13R1.674 C=CCNC(=O)c1ccccc1C 240690a_100020586998_100000212026 [0,1,0,0,0,0|2,0,1]=4 1412 B13R1.674 C=CCNC(=O)c1ccccc1C 527a_100020586998_100000212026 [0,1,0,0,0,0|2,0,1]=4 1413 B13R1.674 C=CCNC(=O)c1ccccc1Cl 1626a_100020586998_100000185844 [0,1,0,0,0,0|2,0,1]=4 1414 B13R1.674 C=CCNC(=O)c1ccccc1Cl 240690a_100020586998_100000185844 [0,1,0,0,0,0|2,0,1]=4 1415 B13R1.674 C=CCNC(=O)c1ccccc1Cl 527a_100020586998_100000185844 [0,1,0,0,0,0|2,0,1]=4 1416 B13R1.674 C=CCNC(=O)c1ccccc1F 1626a_100020586998_100000188656 [0,1,0,0,0,0|2,0,1]=4 1417 B13R1.674 C=CCNC(=O)c1ccccc1F 240690a_100020586998_100000188656 [0,1,0,0,0,0|2,0,1]=4 1418 B13R1.674 C=CCNC(=O)c1ccccc1F 527a_100020586998_100000188656 [0,1,0,0,0,0|2,0,1]=4 1419 B13R1.674 C=CCNC(=O)c1ccccc1I 1626a_100020586998_100000187884 [0,1,0,0,0,0|2,0,1]=4 1420 B13R1.674 C=CCNC(=O)c1ccccc1I 240690a_100020586998_100000187884 [0,1,0,0,0,0|2,0,1]=4 1421 B13R1.674 C=CCNC(=O)c1ccccc1I 527a_100020586998_100000187884 [0,1,0,0,0,0|2,0,1]=4 1422 B13R1.674 C=CCNC(=O)c1ccccc1O 240690a_100020586998_100015234032 [0,1,0,0,0,0|1,0,1]=3 1423 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 1626a_100020586998_100009911694 [0,1,0,0,0,0|1,0,2]=4 1424 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 240690a_100020586998_100009911694 [0,1,0,0,0,0|1,0,2]=4 1425 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 527a_100020586998_100009911694 [0,1,0,0,0,0|1,0,2]=4 1426 B13R1.674 CC#CCC(=O)c1ccccc1Br 1458a_100000188424_100000748600 [0,1,0,0,0,0|2,0,1]=4 1427 B13R1.674 CC#CCC(=O)c1ccccc1C 1458a_100000212026_100000748600 [0,1,0,0,0,0|2,0,1]=4 1428 B13R1.674 CC#CCC(=O)c1ccccc1Cl 1458a_100000185844_100000748600 [0,1,0,0,0,0|2,0,1]=4 1429 B13R1.674 CC#CCC(=O)c1ccccc1F 1458a_100000188656_100000748600 [0,1,0,0,0,0|2,0,1]=4 1430 B13R1.674 CC#CCC(=O)c1ccccc1I 1458a_100000187884_100000748600 [0,1,0,0,0,0|2,0,1]=4 1431 B13R1.674 CC#CCC(=O)c1ccccc1O 1458a_100015234032_100000748600 [0,1,0,0,0,0|1,0,1]=3 1432 B13R1.674 CC#CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000748600 [0,1,0,0,0,0|1,0,2]=4 1433 B13R1.674 CC(OCCBr)c1ccccc1F 34a_100000211926_200000741388 [0,1,0,0,0,0|2,0,1]=4 1434 B13R1.674 CC(OCCF)c1ccccc1Br 34a_100000702211_100011217306 [0,1,0,0,0,0|2,0,1]=4 1435 B13R1.674 CC(OCCF)c1ccccc1Br 7a_100000702211_100011217306 [0,1,0,0,0,0|2,0,1]=4 1436 B13R1.674 CC(OCCF)c1ccccc1Cl 34a_100000740796_100011217306 [0,1,0,0,0,0|2,0,1]=4 1437 B13R1.674 CC(OCCF)c1ccccc1Cl 7a_100000740796_100011217306 [0,1,0,0,0,0|2,0,1]=4 1438 B13R1.674 CC(OCCF)c1ccccc1F 34a_100000697922_100011217306 [0,1,0,0,0,0|2,0,1]=4 1439 B13R1.674 CC(OCCF)c1ccccc1F 7a_100000697922_100011217306 [0,1,0,0,0,0|2,0,1]=4 1440 B13R1.674 CC(OCCF)c1ccccc1N 7a_100011405641_100011217306 [0,1,0,0,0,0|2,0,1]=4 1441 B13R1.674 CC(OCCN)c1ccccc1F 34a_100000210304_200000741388 [0,1,0,0,0,0|2,0,1]=4 1442 B13R1.674 CC(OCCO)c1ccccc1Br 34a_100000702211_100000211926 [0,1,0,0,0,0|2,0,1]=4 1443 B13R1.674 CC(OCCO)c1ccccc1Br 7a_100000702211_100000211926 [0,1,0,0,0,0|2,0,1]=4 1444 B13R1.674 CC(OCCO)c1ccccc1Cl 34a_100000740796_100000211926 [0,1,0,0,0,0|2,0,1]=4 1445 B13R1.674 CC(OCCO)c1ccccc1Cl 7a_100000740796_100000211926 [0,1,0,0,0,0|2,0,1]=4 1446 B13R1.674 CC(OCCO)c1ccccc1F 34a_100000697922_100000211926 [0,1,0,0,0,0|2,0,1]=4 1447 B13R1.674 CC(OCCO)c1ccccc1F 7a_100000697922_100000211926 [0,1,0,0,0,0|2,0,1]=4 1448 B13R1.674 CC(OCCO)c1ccccc1N 7a_100011405641_100000211926 [0,1,0,0,0,0|2,0,1]=4 1449 B13R1.674 CC=CCC(=O)c1ccccc1Br 1458a_100000188424_100000070051 [0,1,0,0,0,0|2,0,1]=4 1450 B13R1.674 CC=CCC(=O)c1ccccc1C 1458a_100000212026_100000070051 [0,1,0,0,0,0|2,0,1]=4 1451 B13R1.674 CC=CCC(=O)c1ccccc1Cl 1458a_100000185844_100000070051 [0,1,0,0,0,0|2,0,1]=4 1452 B13R1.674 CC=CCC(=O)c1ccccc1F 1458a_100000188656_100000070051 [0,1,0,0,0,0|2,0,1]=4 1453 B13R1.674 CC=CCC(=O)c1ccccc1I 1458a_100000187884_100000070051 [0,1,0,0,0,0|2,0,1]=4 1454 B13R1.674 CC=CCC(=O)c1ccccc1O 1458a_100015234032_100000070051 [0,1,0,0,0,0|1,0,1]=3 1455 B13R1.674 CC=CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000070051 [0,1,0,0,0,0|1,0,2]=4 1456 B13R1.674 CC=NNC(=O)c1ccccc1Br 4a_100000183644_200000210099 [0,1,0,0,0,0|2,0,1]=4 1457 B13R1.674 CC=NNC(=O)c1ccccc1C 4a_100000181371_200000210099 [0,1,0,0,0,0|2,0,1]=4 1458 B13R1.674 CC=NNC(=O)c1ccccc1Cl 4a_100000186534_200000210099 [0,1,0,0,0,0|2,0,1]=4 1459 B13R1.674 CC=NNC(=O)c1ccccc1F 4a_100000183521_200000210099 [0,1,0,0,0,0|2,0,1]=4 1460 B13R1.674 CC=NNC(=O)c1ccccc1I 4a_100000190081_200000210099 [0,1,0,0,0,0|2,0,1]=4 1461 B13R1.674 CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210211 [0,1,0,0,0,0|2,0,0]=3 1462 B13R1.674 CCCCC(=O)c1ccccc1C 1458a_100000212026_100000210211 [0,1,0,0,0,0|2,0,0]=3 1463 B13R1.674 CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210211 [0,1,0,0,0,0|2,0,0]=3 1464 B13R1.674 CCCCC(=O)c1ccccc1F 1458a_100000188656_100000210211 [0,1,0,0,0,0|2,0,0]=3 1465 B13R1.674 CCCCC(=O)c1ccccc1I 1458a_100000187884_100000210211 [0,1,0,0,0,0|2,0,0]=3 1466 B13R1.674 CCCCC(=O)c1ccccc1O 1458a_100015234032_100000210211 [0,1,0,0,0,0|1,0,0]=2 1467 B13R1.674 CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210211 [0,1,0,0,0,0|1,0,1]=3 1468 B13R1.674 CCCCN(C)c1ccccc1O 269982a_100000033821_100000210211 [0,1,0,0,0,0|3,0,0]=4 1469 B13R1.674 CCCNC(=O)c1ccccc1Br 11a_100020643023_100000188424 [0,1,0,0,0,0|2,0,0]=3 1470 B13R1.674 CCCNC(=O)c1ccccc1Br 1626a_100020643023_100000188424 [0,1,0,0,0,0|2,0,0]=3 1471 B13R1.674 CCCNC(=O)c1ccccc1Br 240690a_100020643023_100000188424 [0,1,0,0,0,0|2,0,0]=3 1472 B13R1.674 CCCNC(=O)c1ccccc1Br 527a_100020643023_100000188424 [0,1,0,0,0,0|2,0,0]=3 1473 B13R1.674 CCCNC(=O)c1ccccc1C 11a_100020643023_100000212026 [0,1,0,0,0,0|2,0,0]=3 1474 B13R1.674 CCCNC(=O)c1ccccc1C 1626a_100020643023_100000212026 [0,1,0,0,0,0|2,0,0]=3 1475 B13R1.674 CCCNC(=O)c1ccccc1C 240690a_100020643023_100000212026 [0,1,0,0,0,0|2,0,0]=3 1476 B13R1.674 CCCNC(=O)c1ccccc1C 527a_100020643023_100000212026 [0,1,0,0,0,0|2,0,0]=3 1477 B13R1.674 CCCNC(=O)c1ccccc1Cl 11a_100020643023_100000185844 [0,1,0,0,0,0|2,0,0]=3 1478 B13R1.674 CCCNC(=O)c1ccccc1Cl 1626a_100020643023_100000185844 [0,1,0,0,0,0|2,0,0]=3 1479 B13R1.674 CCCNC(=O)c1ccccc1Cl 240690a_100020643023_100000185844 [0,1,0,0,0,0|2,0,0]=3 1480 B13R1.674 CCCNC(=O)c1ccccc1Cl 527a_100020643023_100000185844 [0,1,0,0,0,0|2,0,0]=3 1481 B13R1.674 CCCNC(=O)c1ccccc1F 11a_100020643023_100000188656 [0,1,0,0,0,0|2,0,0]=3 1482 B13R1.674 CCCNC(=O)c1ccccc1F 1626a_100020643023_100000188656 [0,1,0,0,0,0|2,0,0]=3 1483 B13R1.674 CCCNC(=O)c1ccccc1F 240690a_100020643023_100000188656 [0,1,0,0,0,0|2,0,0]=3 1484 B13R1.674 CCCNC(=O)c1ccccc1F 527a_100020643023_100000188656 [0,1,0,0,0,0|2,0,0]=3 1485 B13R1.674 CCCNC(=O)c1ccccc1I 11a_100020643023_100000187884 [0,1,0,0,0,0|2,0,0]=3 1486 B13R1.674 CCCNC(=O)c1ccccc1I 1626a_100020643023_100000187884 [0,1,0,0,0,0|2,0,0]=3 1487 B13R1.674 CCCNC(=O)c1ccccc1I 240690a_100020643023_100000187884 [0,1,0,0,0,0|2,0,0]=3 1488 B13R1.674 CCCNC(=O)c1ccccc1I 527a_100020643023_100000187884 [0,1,0,0,0,0|2,0,0]=3 1489 B13R1.674 CCCNC(=O)c1ccccc1O 240690a_100020643023_100015234032 [0,1,0,0,0,0|1,0,0]=2 1490 B13R1.674 CCCNC(=O)c1ccccc1O 271570a_203496583355_200000152266 [0,1,0,0,0,0|1,0,0]=2 1491 B13R1.674 CCCNC(=O)c1ccccc1[O-] 1626a_100020643023_100009911694 [0,1,0,0,0,0|1,0,1]=3 1492 B13R1.674 CCCNC(=O)c1ccccc1[O-] 240690a_100020643023_100009911694 [0,1,0,0,0,0|1,0,1]=3 1493 B13R1.674 CCCNC(=O)c1ccccc1[O-] 527a_100020643023_100009911694 [0,1,0,0,0,0|1,0,1]=3 1494 B13R1.674 CCCNC(=O)c1cccnc1O 271570a_203496583355_100000161721 [0,1,0,0,0,0|2,0,0]=3 1495 B13R1.674 CCCNC(C)c1ccccc1O 271570a_203496583355_100000741022 [0,1,0,0,0,0|2,0,1]=4 1496 B13R1.674 CCCN[C@H](C)c1ccccc1O 2230a_100025703389_100000210303 [0,1,0,0,0,0|2,0,1]=4 1497 B13R1.674 CCCOC(C)c1ccccc1Br 34a_100000702211_100000210303 [0,1,0,0,0,0|2,0,1]=4 1498 B13R1.674 CCCOC(C)c1ccccc1Br 7a_100000702211_100000210303 [0,1,0,0,0,0|2,0,1]=4 1499 B13R1.674 CCCOC(C)c1ccccc1C 34a_100000742021_100000210303 [0,1,0,0,0,0|2,0,1]=4 1500 B13R1.674 CCCOC(C)c1ccccc1C 7a_100000742021_100000210303 [0,1,0,0,0,0|2,0,1]=4 1501 B13R1.674 CCCOC(C)c1ccccc1Cl 34a_100000740796_100000210303 [0,1,0,0,0,0|2,0,1]=4 1502 B13R1.674 CCCOC(C)c1ccccc1Cl 7a_100000740796_100000210303 [0,1,0,0,0,0|2,0,1]=4 1503 B13R1.674 CCCOC(C)c1ccccc1F 34a_100000210258_200000741388 [0,1,0,0,0,0|2,0,1]=4 1504 B13R1.674 CCCOC(C)c1ccccc1F 34a_100000697922_100000210303 [0,1,0,0,0,0|2,0,1]=4 1505 B13R1.674 CCCOC(C)c1ccccc1F 7a_100000697922_100000210303 [0,1,0,0,0,0|2,0,1]=4 1506 B13R1.674 CCCOC(C)c1ccccc1N 7a_100011405641_100000210303 [0,1,0,0,0,0|2,0,1]=4 1507 B13R1.674 CCNCC(=O)c1ccccc1C 2230a_100015525214_100000741374 [0,1,0,0,0,0|2,0,0]=3 1508 B13R1.674 CCNN=C(C)c1ccccc1Br 4a_100000756455_100000187085 [0,1,0,0,0,0|3,0,0]=4 1509 B13R1.674 CCNN=C(C)c1ccccc1C 4a_100000756455_100000211656 [0,1,0,0,0,0|3,0,0]=4 1510 B13R1.674 CCNN=C(C)c1ccccc1Cl 4a_100000756455_100000210134 [0,1,0,0,0,0|3,0,0]=4 1511 B13R1.674 CCNN=C(C)c1ccccc1F 4a_100000756455_100000210632 [0,1,0,0,0,0|3,0,0]=4 1512 B13R1.674 CCNN=C(C)c1ccccc1I 4a_100000756455_100000751169 [0,1,0,0,0,0|3,0,0]=4 1513 B13R1.674 CCNN=C(C)c1ccccc1O 4a_100000756455_100000188907 [0,1,0,0,0,0|2,0,0]=3 1514 B13R1.674 CCNN=C(C)c1cccnc1O 4a_100000756455_100012024847 [0,1,0,0,0,0|3,0,0]=4 1515 B13R1.674 CCNN=C(C)c1ccncc1O 4a_100000756455_100009872882 [0,1,0,0,0,0|3,0,0]=4 1516 B13R1.674 CCNN=C(C)c1ncccc1O 4a_100000756455_100000087166 [0,1,0,0,0,0|3,0,0]=4 1517 B13R1.674 CCNNC(=O)c1ccccc1Br 22a_100000756455_100000188424 [0,1,0,0,0,0|2,0,0]=3 1518 B13R1.674 CCNNC(=O)c1ccccc1C 22a_100000756455_100000212026 [0,1,0,0,0,0|2,0,0]=3 1519 B13R1.674 CCNNC(=O)c1ccccc1Cl 22a_100000756455_100000185844 [0,1,0,0,0,0|2,0,0]=3 1520 B13R1.674 CCNNC(=O)c1ccccc1F 22a_100000756455_100000188656 [0,1,0,0,0,0|2,0,0]=3 1521 B13R1.674 CCNNC(=O)c1ccccc1I 22a_100000756455_100000187884 [0,1,0,0,0,0|2,0,0]=3 1522 B13R1.674 CCNNC(=O)c1ccccc1O 22a_100000756455_100015234032 [0,1,0,0,0,0|1,0,0]=2 1523 B13R1.674 CCNNC(=O)c1ccccc1[O-] 22a_100000756455_100009911694 [0,1,0,0,0,0|1,0,1]=3 1524 B13R1.674 CCOCC(=O)c1ccccc1Br 34a_100121572206_100000199116 [0,1,0,0,0,0|1,0,0]=2 1525 B13R1.674 CCOCC(=O)c1ccccc1C 34a_100121572206_100000741374 [0,1,0,0,0,0|1,0,0]=2 1526 B13R1.674 CCOCC(=O)c1ccccc1Cl 34a_100121572206_100000211432 [0,1,0,0,0,0|1,0,0]=2 1527 B13R1.674 CCOCC(=O)c1ccccc1F 34a_100121572206_100000204681 [0,1,0,0,0,0|1,0,0]=2 1528 B13R1.674 CCOCC(N)c1ccccc1Cl 34a_100138412506_100000210202 [0,1,0,0,0,0|2,0,1]=4 1529 B13R1.674 CCOCN(C)c1ccccc1Br 269982a_100020606079_100000739092 [0,1,0,0,0,0|3,0,0]=4 1530 B13R1.674 CCOCN(C)c1ccccc1C 269982a_100000219699_100000739092 [0,1,0,0,0,0|3,0,0]=4 1531 B13R1.674 CCOCN(C)c1ccccc1Cl 269982a_100000219374_100000739092 [0,1,0,0,0,0|3,0,0]=4 1532 B13R1.674 CCOCN(C)c1ccccc1F 269982a_100000220357_100000739092 [0,1,0,0,0,0|3,0,0]=4 1533 B13R1.674 CCOCN(C)c1ccccc1O 269982a_100000033821_100000739092 [0,1,0,0,0,0|2,0,0]=3 1534 B13R1.674 CCOC[C@@H](N)c1ccccc1Br 34a_100161155918_100000210202 [0,1,0,0,0,0|2,0,1]=4 1535 B13R1.674 CCOC[C@H](N)c1ccccc1F 34a_100009818778_100000210202 [0,1,0,0,0,0|2,0,1]=4 1536 B13R1.674 CCSCC(=O)c1ccccc1Br 62a_100000199116_100000210202 [0,1,0,0,0,0|1,1,0]=3 1537 B13R1.674 CCSCC(=O)c1ccccc1C 62a_100000210202_100000741374 [0,1,0,0,0,0|1,1,0]=3 1538 B13R1.674 CCSCC(=O)c1ccccc1C 62a_100000741374_100000210202 [0,1,0,0,0,0|1,1,0]=3 1539 B13R1.674 CCSCC(=O)c1ccccc1Cl 62a_100000210202_100000211432 [0,1,0,0,0,0|1,1,0]=3 1540 B13R1.674 CCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210202 [0,1,0,0,0,0|1,1,0]=3 1541 B13R1.674 CCSCC(=O)c1ccccc1F 62a_100000204681_100000210202 [0,1,0,0,0,0|1,1,0]=3 1542 B13R1.674 CCSCC(=O)c1ccccc1F 62a_100000210202_100000204681 [0,1,0,0,0,0|1,1,0]=3 1543 B13R1.674 CCSCC(=O)c1ccccc1O 62a_100000188908_100000210202 [0,1,0,0,0,0|0,1,0]=2 1544 B13R1.674 CCSCC(=O)c1ccccc1O 62a_100000210202_100000188908 [0,1,0,0,0,0|0,1,0]=2 1545 B13R1.674 CN(CCCF)c1ccccc1O 269982a_100000033821_100011934791 [0,1,0,0,0,0|3,0,0]=4 1546 B13R1.674 CN(CCCO)c1ccccc1O 269982a_100000033821_100011215043 [0,1,0,0,0,0|3,0,0]=4 1547 B13R1.674 CNCCC(=O)c1ccccc1F 2230a_106832991635_100000086012 [0,1,0,0,0,0|2,0,0]=3 1548 B13R1.674 CNCCC(=O)c1ccccc1F 7a_106832991635_100000086012 [0,1,0,0,0,0|2,0,0]=3 1549 B13R1.674 CNCCC(=O)c1ccccc1O 7a_106832991635_100009873196 [0,1,0,0,0,0|1,0,0]=2 1550 B13R1.674 COCCC(=O)c1ccccc1Br 1458a_100000188424_100000233755 [0,1,0,0,0,0|2,0,0]=3 1551 B13R1.674 COCCC(=O)c1ccccc1C 1458a_100000212026_100000233755 [0,1,0,0,0,0|2,0,0]=3 1552 B13R1.674 COCCC(=O)c1ccccc1Cl 1458a_100000185844_100000233755 [0,1,0,0,0,0|2,0,0]=3 1553 B13R1.674 COCCC(=O)c1ccccc1F 1458a_100000188656_100000233755 [0,1,0,0,0,0|2,0,0]=3 1554 B13R1.674 COCCC(=O)c1ccccc1I 1458a_100000187884_100000233755 [0,1,0,0,0,0|2,0,0]=3 1555 B13R1.674 COCCC(=O)c1ccccc1O 1458a_100015234032_100000233755 [0,1,0,0,0,0|1,0,0]=2 1556 B13R1.674 COCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000233755 [0,1,0,0,0,0|1,0,1]=3 1557 B13R1.674 COCCN(C)c1ccccc1O 269982a_100000033821_100000233755 [0,1,0,0,0,0|3,0,0]=4 1558 B13R1.674 COCN[C@H](C)c1ccccc1O 2230a_100025703389_100000766300 [0,1,0,0,0,0|2,0,1]=4 1559 B13R1.674 CSCCC(=O)c1ccccc1Br 1458a_100000188424_100000751147 [0,1,0,0,0,0|2,0,0]=3 1560 B13R1.674 CSCCC(=O)c1ccccc1C 1458a_100000212026_100000751147 [0,1,0,0,0,0|2,0,0]=3 1561 B13R1.674 CSCCC(=O)c1ccccc1Cl 1458a_100000185844_100000751147 [0,1,0,0,0,0|2,0,0]=3 1562 B13R1.674 CSCCC(=O)c1ccccc1F 1458a_100000188656_100000751147 [0,1,0,0,0,0|2,0,0]=3 1563 B13R1.674 CSCCC(=O)c1ccccc1F 62a_100000086012_200000210301 [0,1,0,0,0,0|2,0,0]=3 1564 B13R1.674 CSCCC(=O)c1ccccc1F 62a_200000210301_100000086012 [0,1,0,0,0,0|2,0,0]=3 1565 B13R1.674 CSCCC(=O)c1ccccc1I 1458a_100000187884_100000751147 [0,1,0,0,0,0|2,0,0]=3 1566 B13R1.674 CSCCC(=O)c1ccccc1O 1458a_100015234032_100000751147 [0,1,0,0,0,0|1,0,0]=2 1567 B13R1.674 CSCCC(=O)c1ccccc1O 62a_200000210301_100009873196 [0,1,0,0,0,0|1,0,0]=2 1568 B13R1.674 CSCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000751147 [0,1,0,0,0,0|1,0,1]=3 1569 B13R1.674 CSCCN(C)c1ccccc1O 269982a_100000033821_100000212216 [0,1,0,0,0,0|3,0,0]=4 1570 B13R1.674 CSCN[C@H](C)c1ccccc1O 2230a_100025703389_100011218213 [0,1,0,0,0,0|2,0,1]=4 1571 B13R1.674 CSCOC(C)c1ccccc1Br 34a_100000702211_100011218213 [0,1,0,0,0,0|2,0,1]=4 1572 B13R1.674 CSCOC(C)c1ccccc1C 34a_100000742021_100011218213 [0,1,0,0,0,0|2,0,1]=4 1573 B13R1.674 CSCOC(C)c1ccccc1Cl 34a_100000740796_100011218213 [0,1,0,0,0,0|2,0,1]=4 1574 B13R1.674 CSCOC(C)c1ccccc1F 34a_100000697922_100011218213 [0,1,0,0,0,0|2,0,1]=4 1575 B13R1.674 C[C@@H](NCCF)c1ccccc1O 2230a_100025703389_100011217306 [0,1,0,0,0,0|2,0,1]=4 1576 B13R1.674 C[C@@H](NCCO)c1ccccc1O 2230a_100025703389_100000211926 [0,1,0,0,0,0|2,0,1]=4 1577 B13R1.674 Cc1ccccc1C(=O)CCC#N 1458a_100000212026_100011215226 [0,1,0,0,0,0|2,0,1]=4 1578 B13R1.674 Cc1ccccc1C(=O)CCCF 1458a_100000212026_100011934791 [0,1,0,0,0,0|2,0,0]=3 1579 B13R1.674 Cc1ccccc1C(=O)CCCO 1458a_100000212026_100011215043 [0,1,0,0,0,0|2,0,0]=3 1580 B13R1.674 Cc1ccccc1C(=O)CSCF 62a_100000741374_100015361967 [0,1,0,0,0,0|2,1,0]=4 1581 B13R1.674 Cc1ccccc1C(=O)CSCF 62a_100015361967_100000741374 [0,1,0,0,0,0|2,1,0]=4 1582 B13R1.674 Cc1ccccc1C(=O)NCC#N 1626a_100000734998_100000212026 [0,1,0,0,0,0|2,0,1]=4 1583 B13R1.674 Cc1ccccc1C(=O)NCC#N 527a_100000734998_100000212026 [0,1,0,0,0,0|2,0,1]=4 1584 B13R1.674 Cc1ccccc1C(=O)NCCF 11a_100000724931_100000212026 [0,1,0,0,0,0|2,0,0]=3 1585 B13R1.674 Cc1ccccc1C(=O)NCCF 1626a_100000724931_100000212026 [0,1,0,0,0,0|2,0,0]=3 1586 B13R1.674 Cc1ccccc1C(=O)NCCF 240690a_100000724931_100000212026 [0,1,0,0,0,0|2,0,0]=3 1587 B13R1.674 Cc1ccccc1C(=O)NCCF 527a_100000724931_100000212026 [0,1,0,0,0,0|2,0,0]=3 1588 B13R1.674 Cc1ccccc1C(=O)NCCO 240690a_100000210304_100000212026 [0,1,0,0,0,0|2,0,0]=3 1589 B13R1.674 Cc1ccccc1C(=O)NCCO 527a_100000210304_100000212026 [0,1,0,0,0,0|2,0,0]=3 1590 B13R1.674 Cc1ccccc1C(C)OCCF 34a_100000742021_100011217306 [0,1,0,0,0,0|2,0,1]=4 1591 B13R1.674 Cc1ccccc1C(C)OCCF 7a_100000742021_100011217306 [0,1,0,0,0,0|2,0,1]=4 1592 B13R1.674 Cc1ccccc1C(C)OCCO 34a_100000742021_100000211926 [0,1,0,0,0,0|2,0,1]=4 1593 B13R1.674 Cc1ccccc1C(C)OCCO 7a_100000742021_100000211926 [0,1,0,0,0,0|2,0,1]=4 1594 B13R1.674 N#CCCC(=O)c1ccccc1Br 1458a_100000188424_100011215226 [0,1,0,0,0,0|2,0,1]=4 1595 B13R1.674 N#CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215226 [0,1,0,0,0,0|2,0,1]=4 1596 B13R1.674 N#CCCC(=O)c1ccccc1F 1458a_100000188656_100011215226 [0,1,0,0,0,0|2,0,1]=4 1597 B13R1.674 N#CCCC(=O)c1ccccc1I 1458a_100000187884_100011215226 [0,1,0,0,0,0|2,0,1]=4 1598 B13R1.674 N#CCCC(=O)c1ccccc1O 1458a_100015234032_100011215226 [0,1,0,0,0,0|1,0,1]=3 1599 B13R1.674 N#CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215226 [0,1,0,0,0,0|1,0,2]=4 1600 B13R1.674 N#CCNC(=O)c1ccccc1Br 1626a_100000734998_100000188424 [0,1,0,0,0,0|2,0,1]=4 1601 B13R1.674 N#CCNC(=O)c1ccccc1Br 527a_100000734998_100000188424 [0,1,0,0,0,0|2,0,1]=4 1602 B13R1.674 N#CCNC(=O)c1ccccc1Cl 1626a_100000734998_100000185844 [0,1,0,0,0,0|2,0,1]=4 1603 B13R1.674 N#CCNC(=O)c1ccccc1Cl 527a_100000734998_100000185844 [0,1,0,0,0,0|2,0,1]=4 1604 B13R1.674 N#CCNC(=O)c1ccccc1F 1626a_100000734998_100000188656 [0,1,0,0,0,0|2,0,1]=4 1605 B13R1.674 N#CCNC(=O)c1ccccc1F 527a_100000734998_100000188656 [0,1,0,0,0,0|2,0,1]=4 1606 B13R1.674 N#CCNC(=O)c1ccccc1I 1626a_100000734998_100000187884 [0,1,0,0,0,0|2,0,1]=4 1607 B13R1.674 N#CCNC(=O)c1ccccc1I 527a_100000734998_100000187884 [0,1,0,0,0,0|2,0,1]=4 1608 B13R1.674 N#CCNC(=O)c1ccccc1[O-] 1626a_100000734998_100009911694 [0,1,0,0,0,0|1,0,2]=4 1609 B13R1.674 N#CCNC(=O)c1ccccc1[O-] 527a_100000734998_100009911694 [0,1,0,0,0,0|1,0,2]=4 1610 B13R1.674 O=C(CCCF)c1ccccc1Br 1458a_100000188424_100011934791 [0,1,0,0,0,0|2,0,0]=3 1611 B13R1.674 O=C(CCCF)c1ccccc1Cl 1458a_100000185844_100011934791 [0,1,0,0,0,0|2,0,0]=3 1612 B13R1.674 O=C(CCCF)c1ccccc1F 1458a_100000188656_100011934791 [0,1,0,0,0,0|2,0,0]=3 1613 B13R1.674 O=C(CCCF)c1ccccc1I 1458a_100000187884_100011934791 [0,1,0,0,0,0|2,0,0]=3 1614 B13R1.674 O=C(CCCF)c1ccccc1O 1458a_100015234032_100011934791 [0,1,0,0,0,0|1,0,0]=2 1615 B13R1.674 O=C(CCCF)c1ccccc1[O-] 1458a_100009911694_100011934791 [0,1,0,0,0,0|1,0,1]=3 1616 B13R1.674 O=C(CCCO)c1ccccc1Br 1458a_100000188424_100011215043 [0,1,0,0,0,0|2,0,0]=3 1617 B13R1.674 O=C(CCCO)c1ccccc1Cl 1458a_100000185844_100011215043 [0,1,0,0,0,0|2,0,0]=3 1618 B13R1.674 O=C(CCCO)c1ccccc1F 1458a_100000188656_100011215043 [0,1,0,0,0,0|2,0,0]=3 1619 B13R1.674 O=C(CCCO)c1ccccc1I 1458a_100000187884_100011215043 [0,1,0,0,0,0|2,0,0]=3 1620 B13R1.674 O=C(CCCO)c1ccccc1O 1458a_100015234032_100011215043 [0,1,0,0,0,0|1,0,0]=2 1621 B13R1.674 O=C(CCCO)c1ccccc1[O-] 1458a_100009911694_100011215043 [0,1,0,0,0,0|1,0,1]=3 1622 B13R1.674 O=C(CSCF)c1ccccc1Br 62a_100000199116_100015361967 [0,1,0,0,0,0|2,1,0]=4 1623 B13R1.674 O=C(CSCF)c1ccccc1Cl 62a_100000211432_100015361967 [0,1,0,0,0,0|2,1,0]=4 1624 B13R1.674 O=C(CSCF)c1ccccc1Cl 62a_100015361967_100000211432 [0,1,0,0,0,0|2,1,0]=4 1625 B13R1.674 O=C(CSCF)c1ccccc1F 62a_100000204681_100015361967 [0,1,0,0,0,0|2,1,0]=4 1626 B13R1.674 O=C(CSCF)c1ccccc1F 62a_100015361967_100000204681 [0,1,0,0,0,0|2,1,0]=4 1627 B13R1.674 O=C(CSCF)c1ccccc1O 62a_100000188908_100015361967 [0,1,0,0,0,0|1,1,0]=3 1628 B13R1.674 O=C(CSCF)c1ccccc1O 62a_100015361967_100000188908 [0,1,0,0,0,0|1,1,0]=3 1629 B13R1.674 O=C(NCCF)c1ccccc1Br 11a_100000724931_100000188424 [0,1,0,0,0,0|2,0,0]=3 1630 B13R1.674 O=C(NCCF)c1ccccc1Br 1626a_100000724931_100000188424 [0,1,0,0,0,0|2,0,0]=3 1631 B13R1.674 O=C(NCCF)c1ccccc1Br 240690a_100000724931_100000188424 [0,1,0,0,0,0|2,0,0]=3 1632 B13R1.674 O=C(NCCF)c1ccccc1Br 527a_100000724931_100000188424 [0,1,0,0,0,0|2,0,0]=3 1633 B13R1.674 O=C(NCCF)c1ccccc1Cl 11a_100000724931_100000185844 [0,1,0,0,0,0|2,0,0]=3 1634 B13R1.674 O=C(NCCF)c1ccccc1Cl 1626a_100000724931_100000185844 [0,1,0,0,0,0|2,0,0]=3 1635 B13R1.674 O=C(NCCF)c1ccccc1Cl 240690a_100000724931_100000185844 [0,1,0,0,0,0|2,0,0]=3 1636 B13R1.674 O=C(NCCF)c1ccccc1Cl 527a_100000724931_100000185844 [0,1,0,0,0,0|2,0,0]=3 1637 B13R1.674 O=C(NCCF)c1ccccc1F 11a_100000724931_100000188656 [0,1,0,0,0,0|2,0,0]=3 1638 B13R1.674 O=C(NCCF)c1ccccc1F 1626a_100000724931_100000188656 [0,1,0,0,0,0|2,0,0]=3 1639 B13R1.674 O=C(NCCF)c1ccccc1F 240690a_100000724931_100000188656 [0,1,0,0,0,0|2,0,0]=3 1640 B13R1.674 O=C(NCCF)c1ccccc1F 527a_100000724931_100000188656 [0,1,0,0,0,0|2,0,0]=3 1641 B13R1.674 O=C(NCCF)c1ccccc1I 11a_100000724931_100000187884 [0,1,0,0,0,0|2,0,0]=3 1642 B13R1.674 O=C(NCCF)c1ccccc1I 1626a_100000724931_100000187884 [0,1,0,0,0,0|2,0,0]=3 1643 B13R1.674 O=C(NCCF)c1ccccc1I 240690a_100000724931_100000187884 [0,1,0,0,0,0|2,0,0]=3 1644 B13R1.674 O=C(NCCF)c1ccccc1I 527a_100000724931_100000187884 [0,1,0,0,0,0|2,0,0]=3 1645 B13R1.674 O=C(NCCF)c1ccccc1O 240690a_100000724931_100015234032 [0,1,0,0,0,0|1,0,0]=2 1646 B13R1.674 O=C(NCCF)c1ccccc1[O-] 1626a_100000724931_100009911694 [0,1,0,0,0,0|1,0,1]=3 1647 B13R1.674 O=C(NCCF)c1ccccc1[O-] 240690a_100000724931_100009911694 [0,1,0,0,0,0|1,0,1]=3 1648 B13R1.674 O=C(NCCF)c1ccccc1[O-] 527a_100000724931_100009911694 [0,1,0,0,0,0|1,0,1]=3 1649 B13R1.674 O=C(NCCO)c1ccccc1Br 240690a_100000210304_100000188424 [0,1,0,0,0,0|2,0,0]=3 1650 B13R1.674 O=C(NCCO)c1ccccc1Br 527a_100000210304_100000188424 [0,1,0,0,0,0|2,0,0]=3 1651 B13R1.674 O=C(NCCO)c1ccccc1Cl 240690a_100000210304_100000185844 [0,1,0,0,0,0|2,0,0]=3 1652 B13R1.674 O=C(NCCO)c1ccccc1Cl 527a_100000210304_100000185844 [0,1,0,0,0,0|2,0,0]=3 1653 B13R1.674 O=C(NCCO)c1ccccc1F 240690a_100000210304_100000188656 [0,1,0,0,0,0|2,0,0]=3 1654 B13R1.674 O=C(NCCO)c1ccccc1F 527a_100000210304_100000188656 [0,1,0,0,0,0|2,0,0]=3 1655 B13R1.674 O=C(NCCO)c1ccccc1I 240690a_100000210304_100000187884 [0,1,0,0,0,0|2,0,0]=3 1656 B13R1.674 O=C(NCCO)c1ccccc1I 527a_100000210304_100000187884 [0,1,0,0,0,0|2,0,0]=3 1657 B13R1.674 O=C(NCCO)c1ccccc1O 240690a_100000210304_100015234032 [0,1,0,0,0,0|1,0,0]=2 1658 B13R1.674 O=C(NCCO)c1ccccc1O 271570a_203496583355_200000158863 [0,1,0,0,0,0|1,0,0]=2 1659 B13R1.674 O=C(NCCO)c1ccccc1[O-] 240690a_100000210304_100009911694 [0,1,0,0,0,0|1,0,1]=3 1660 B13R1.674 O=C(NCCO)c1ccccc1[O-] 527a_100000210304_100009911694 [0,1,0,0,0,0|1,0,1]=3 1661 B13R1.674 [13CH3]SCCC(=O)c1ccccc1F 62a_100000086012_200025704644 [0,1,0,0,0,0|2,0,0]=3 1662 B13R1.674 [13CH3]SCCC(=O)c1ccccc1F 62a_200025704644_100000086012 [0,1,0,0,0,0|2,0,0]=3 1663 B13R1.674 [13CH3]SCCC(=O)c1ccccc1O 62a_200025704644_100009873196 [0,1,0,0,0,0|1,0,0]=2 1664 B13R1.696 C#CC(C)C(=O)c1ccccc1O 1458a_100015234032_200000035995 [0,1,0,0,0,0|1,0,2]=4 1665 B13R1.696 CC(C#N)C(=O)c1ccccc1O 1458a_100015234032_100000703298 [0,1,0,0,0,0|2,0,1]=4 1666 B13R1.696 CC(S[13CH3])C(=O)c1ccccc1Cl 62a_100010255250_200025704644 [0,1,0,0,0,0|3,0,0]=4 1667 B13R1.696 CC(S[13CH3])C(=O)c1ccccc1Cl 62a_200025704644_100010255250 [0,1,0,0,0,0|3,0,0]=4 1668 B13R1.696 CCC(=O)N(C)c1ccccc1O 22a_100000033821_100000210414 [0,1,0,0,0,0|3,0,0]=4 1669 B13R1.696 CCC(=O)N(C)c1ccccc1O 527a_100000033821_100000210414 [0,1,0,0,0,0|3,0,0]=4 1670 B13R1.696 CCC(C)C(=O)c1ccccc1Br 1458a_100000188424_100000758301 [0,1,0,0,0,0|2,0,0]=3 1671 B13R1.696 CCC(C)C(=O)c1ccccc1C 1458a_100000212026_100000758301 [0,1,0,0,0,0|2,0,0]=3 1672 B13R1.696 CCC(C)C(=O)c1ccccc1Cl 1458a_100000185844_100000758301 [0,1,0,0,0,0|2,0,0]=3 1673 B13R1.696 CCC(C)C(=O)c1ccccc1F 1458a_100000188656_100000758301 [0,1,0,0,0,0|2,0,0]=3 1674 B13R1.696 CCC(C)C(=O)c1ccccc1I 1458a_100000187884_100000758301 [0,1,0,0,0,0|2,0,0]=3 1675 B13R1.696 CCC(C)C(=O)c1ccccc1O 1458a_100015234032_100000758301 [0,1,0,0,0,0|1,0,0]=2 1676 B13R1.696 CCC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100000758301 [0,1,0,0,0,0|1,0,1]=3 1677 B13R1.696 CCC(C)N(C)c1ccccc1O 269982a_100000033821_100000758301 [0,1,0,0,0,0|3,0,0]=4 1678 B13R1.696 CCN(C)C(=O)c1ccccc1Br 11a_100000225621_100000188424 [0,1,0,0,0,0|2,0,0]=3 1679 B13R1.696 CCN(C)C(=O)c1ccccc1Br 1626a_100000225621_100000188424 [0,1,0,0,0,0|2,0,0]=3 1680 B13R1.696 CCN(C)C(=O)c1ccccc1Br 240690a_100000225621_100000188424 [0,1,0,0,0,0|2,0,0]=3 1681 B13R1.696 CCN(C)C(=O)c1ccccc1Br 527a_100000225621_100000188424 [0,1,0,0,0,0|2,0,0]=3 1682 B13R1.696 CCN(C)C(=O)c1ccccc1C 11a_100000225621_100000212026 [0,1,0,0,0,0|2,0,0]=3 1683 B13R1.696 CCN(C)C(=O)c1ccccc1C 1626a_100000225621_100000212026 [0,1,0,0,0,0|2,0,0]=3 1684 B13R1.696 CCN(C)C(=O)c1ccccc1C 240690a_100000225621_100000212026 [0,1,0,0,0,0|2,0,0]=3 1685 B13R1.696 CCN(C)C(=O)c1ccccc1C 527a_100000225621_100000212026 [0,1,0,0,0,0|2,0,0]=3 1686 B13R1.696 CCN(C)C(=O)c1ccccc1Cl 11a_100000225621_100000185844 [0,1,0,0,0,0|2,0,0]=3 1687 B13R1.696 CCN(C)C(=O)c1ccccc1Cl 1626a_100000225621_100000185844 [0,1,0,0,0,0|2,0,0]=3 1688 B13R1.696 CCN(C)C(=O)c1ccccc1Cl 240690a_100000225621_100000185844 [0,1,0,0,0,0|2,0,0]=3 1689 B13R1.696 CCN(C)C(=O)c1ccccc1Cl 527a_100000225621_100000185844 [0,1,0,0,0,0|2,0,0]=3 1690 B13R1.696 CCN(C)C(=O)c1ccccc1F 11a_100000225621_100000188656 [0,1,0,0,0,0|2,0,0]=3 1691 B13R1.696 CCN(C)C(=O)c1ccccc1F 1626a_100000225621_100000188656 [0,1,0,0,0,0|2,0,0]=3 1692 B13R1.696 CCN(C)C(=O)c1ccccc1F 240690a_100000225621_100000188656 [0,1,0,0,0,0|2,0,0]=3 1693 B13R1.696 CCN(C)C(=O)c1ccccc1F 527a_100000225621_100000188656 [0,1,0,0,0,0|2,0,0]=3 1694 B13R1.696 CCN(C)C(=O)c1ccccc1I 11a_100000225621_100000187884 [0,1,0,0,0,0|2,0,0]=3 1695 B13R1.696 CCN(C)C(=O)c1ccccc1I 1626a_100000225621_100000187884 [0,1,0,0,0,0|2,0,0]=3 1696 B13R1.696 CCN(C)C(=O)c1ccccc1I 240690a_100000225621_100000187884 [0,1,0,0,0,0|2,0,0]=3 1697 B13R1.696 CCN(C)C(=O)c1ccccc1I 527a_100000225621_100000187884 [0,1,0,0,0,0|2,0,0]=3 1698 B13R1.696 CCN(C)C(=O)c1ccccc1O 240690a_100000225621_100015234032 [0,1,0,0,0,0|1,0,0]=2 1699 B13R1.696 CCN(C)C(=O)c1ccccc1[O-] 1626a_100000225621_100009911694 [0,1,0,0,0,0|1,0,1]=3 1700 B13R1.696 CCN(C)C(=O)c1ccccc1[O-] 240690a_100000225621_100009911694 [0,1,0,0,0,0|1,0,1]=3 1701 B13R1.696 CCN(C)C(=O)c1ccccc1[O-] 527a_100000225621_100009911694 [0,1,0,0,0,0|1,0,1]=3 1702 B13R1.696 CCN(C)C(=O)c1cccnc1O 271570a_203496583355_200011239097 [0,1,0,0,0,0|2,0,0]=3 1703 B13R1.696 CNC(C)C(=O)c1ccccc1Cl 2230a_106832991635_100010255250 [0,1,0,0,0,0|3,0,0]=4 1704 B13R1.696 CNC(C)C(=O)c1ccccc1Cl 7a_106832991635_100010255250 [0,1,0,0,0,0|3,0,0]=4 1705 B13R1.696 COC(=O)C(=O)c1ccccc1O 271570a_203496583355_200010133017 [0,1,0,0,0,0|2,0,0]=3 1706 B13R1.696 CON(C)C(=O)c1ccccc1O 271570a_203496583355_100000153843 [0,1,0,0,0,0|2,0,0]=3 1707 B13R1.696 CON(C)C(=O)c1cccnc1O 271570a_203496583355_200000174241 [0,1,0,0,0,0|3,0,0]=4 1708 B13R1.696 CSC(C)C(=O)c1ccccc1Cl 62a_100010255250_200000210301 [0,1,0,0,0,0|3,0,0]=4 1709 B13R1.696 CSC(C)C(=O)c1ccccc1Cl 62a_200000210301_100010255250 [0,1,0,0,0,0|3,0,0]=4 1710 B13R1.1511 C#CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000184674 [0,1,0,0,0,0|1,0,2]=4 1711 B13R1.1511 C#CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000184674 [0,1,0,0,0,0|1,0,2]=4 1712 B13R1.1511 C#CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000184674 [0,1,0,0,0,0|1,0,2]=4 1713 B13R1.1511 C#CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000184674 [0,1,0,0,0,0|1,0,2]=4 1714 B13R1.1511 C#CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000184674 [0,1,0,0,0,0|1,0,2]=4 1715 B13R1.1511 C#CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000184674 [0,1,0,0,0,0|1,0,2]=4 1716 B13R1.1511 C=CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210623 [0,1,0,0,0,0|1,0,2]=4 1717 B13R1.1511 C=CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210623 [0,1,0,0,0,0|1,0,2]=4 1718 B13R1.1511 C=CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210623 [0,1,0,0,0,0|1,0,2]=4 1719 B13R1.1511 C=CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210623 [0,1,0,0,0,0|1,0,2]=4 1720 B13R1.1511 C=CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210623 [0,1,0,0,0,0|1,0,2]=4 1721 B13R1.1511 C=CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210623 [0,1,0,0,0,0|1,0,2]=4 1722 B13R1.1511 CCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210303 [0,1,0,0,0,0|2,0,0]=3 1723 B13R1.1511 CCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210303 [0,1,0,0,0,0|2,0,0]=3 1724 B13R1.1511 CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210303 [0,1,0,0,0,0|2,0,0]=3 1725 B13R1.1511 CCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210303 [0,1,0,0,0,0|2,0,0]=3 1726 B13R1.1511 CCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210303 [0,1,0,0,0,0|2,0,0]=3 1727 B13R1.1511 CCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210303 [0,1,0,0,0,0|2,0,0]=3 1728 B13R1.1511 CCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210303 [0,1,0,0,0,0|2,0,0]=3 1729 B13R1.1511 CCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210303 [0,1,0,0,0,0|2,0,0]=3 1730 B13R1.1511 CCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210303 [0,1,0,0,0,0|2,0,0]=3 1731 B13R1.1511 CCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210303 [0,1,0,0,0,0|2,0,0]=3 1732 B13R1.1511 CCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210303 [0,1,0,0,0,0|2,0,0]=3 1733 B13R1.1511 CCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210303 [0,1,0,0,0,0|2,0,0]=3 1734 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210303 [0,1,0,0,0,0|2,0,0]=3 1735 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210303 [0,1,0,0,0,0|2,0,0]=3 1736 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210303 [0,1,0,0,0,0|2,0,0]=3 1737 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210303 [0,1,0,0,0,0|2,0,0]=3 1738 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210303 [0,1,0,0,0,0|2,0,0]=3 1739 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210303 [0,1,0,0,0,0|2,0,0]=3 1740 B13R1.1511 CCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210303 [0,1,0,0,0,0|2,0,0]=3 1741 B13R1.1511 CCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210303 [0,1,0,0,0,0|2,0,0]=3 1742 B13R1.1511 CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210303 [0,1,0,0,0,0|2,0,0]=3 1743 B13R1.1511 CCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210303 [0,1,0,0,0,0|2,0,0]=3 1744 B13R1.1511 CCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210303 [0,1,0,0,0,0|2,0,0]=3 1745 B13R1.1511 CCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210303 [0,1,0,0,0,0|2,0,0]=3 1746 B13R1.1511 CCCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012345046 [0,1,0,0,0,0|2,0,0]=3 1747 B13R1.1511 CCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210303 [0,1,0,0,0,0|2,0,0]=3 1748 B13R1.1511 CCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210303 [0,1,0,0,0,0|2,0,0]=3 1749 B13R1.1511 CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210303 [0,1,0,0,0,0|2,0,0]=3 1750 B13R1.1511 CCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210303 [0,1,0,0,0,0|2,0,0]=3 1751 B13R1.1511 CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210303 [0,1,0,0,0,0|1,0,0]=2 1752 B13R1.1511 CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210303 [0,1,0,0,0,0|1,0,0]=2 1753 B13R1.1511 CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210303 [0,1,0,0,0,0|1,0,0]=2 1754 B13R1.1511 CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210303 [0,1,0,0,0,0|1,0,0]=2 1755 B13R1.1511 CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210303 [0,1,0,0,0,0|1,0,0]=2 1756 B13R1.1511 CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210303 [0,1,0,0,0,0|1,0,0]=2 1757 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 11a_100015525214_100000762965 [0,1,0,0,0,0|2,0,0]=3 1758 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 240690a_100015525214_100000762965 [0,1,0,0,0,0|2,0,0]=3 1759 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 527a_100015525214_100000762965 [0,1,0,0,0,0|2,0,0]=3 1760 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 11a_100015525214_100000685072 [0,1,0,0,0,0|2,0,0]=3 1761 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 240690a_100015525214_100000685072 [0,1,0,0,0,0|2,0,0]=3 1762 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 527a_100015525214_100000685072 [0,1,0,0,0,0|2,0,0]=3 1763 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 11a_100015525214_100000766353 [0,1,0,0,0,0|2,0,0]=3 1764 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 240690a_100015525214_100000766353 [0,1,0,0,0,0|2,0,0]=3 1765 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 527a_100015525214_100000766353 [0,1,0,0,0,0|2,0,0]=3 1766 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 11a_100015525214_100000212304 [0,1,0,0,0,0|2,0,0]=3 1767 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 240690a_100015525214_100000212304 [0,1,0,0,0,0|2,0,0]=3 1768 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 527a_100015525214_100000212304 [0,1,0,0,0,0|2,0,0]=3 1769 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 11a_100015525214_100012360512 [0,1,0,0,0,0|2,0,0]=3 1770 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 240690a_100015525214_100012360512 [0,1,0,0,0,0|2,0,0]=3 1771 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 527a_100015525214_100012360512 [0,1,0,0,0,0|2,0,0]=3 1772 B13R1.1511 CCNC(=O)c1ccc(cc1Br)O 240690a_100015525214_100012344906 [0,1,0,0,0,0|2,0,0]=3 1773 B13R1.1511 CCNC(=O)c1ccc(cc1Br)O 527a_100015525214_100012344906 [0,1,0,0,0,0|2,0,0]=3 1774 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 11a_100015525214_100000741311 [0,1,0,0,0,0|2,0,0]=3 1775 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 240690a_100015525214_100000741311 [0,1,0,0,0,0|2,0,0]=3 1776 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 527a_100015525214_100000741311 [0,1,0,0,0,0|2,0,0]=3 1777 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 11a_100015525214_100000211164 [0,1,0,0,0,0|2,0,0]=3 1778 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 240690a_100015525214_100000211164 [0,1,0,0,0,0|2,0,0]=3 1779 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 527a_100015525214_100000211164 [0,1,0,0,0,0|2,0,0]=3 1780 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 11a_100015525214_100000688705 [0,1,0,0,0,0|2,0,0]=3 1781 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 240690a_100015525214_100000688705 [0,1,0,0,0,0|2,0,0]=3 1782 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 527a_100015525214_100000688705 [0,1,0,0,0,0|2,0,0]=3 1783 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 11a_100015525214_100000686989 [0,1,0,0,0,0|2,0,0]=3 1784 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 240690a_100015525214_100000686989 [0,1,0,0,0,0|2,0,0]=3 1785 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 527a_100015525214_100000686989 [0,1,0,0,0,0|2,0,0]=3 1786 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 11a_100015525214_100010189873 [0,1,0,0,0,0|2,0,0]=3 1787 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 240690a_100015525214_100010189873 [0,1,0,0,0,0|2,0,0]=3 1788 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 527a_100015525214_100010189873 [0,1,0,0,0,0|2,0,0]=3 1789 B13R1.1511 CCNC(=O)c1ccc(cc1C)O 240690a_100015525214_100000692822 [0,1,0,0,0,0|2,0,0]=3 1790 B13R1.1511 CCNC(=O)c1ccc(cc1C)O 527a_100015525214_100000692822 [0,1,0,0,0,0|2,0,0]=3 1791 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 11a_100015525214_100000741628 [0,1,0,0,0,0|2,0,0]=3 1792 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 240690a_100015525214_100000741628 [0,1,0,0,0,0|2,0,0]=3 1793 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 527a_100015525214_100000741628 [0,1,0,0,0,0|2,0,0]=3 1794 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 11a_100015525214_100000766932 [0,1,0,0,0,0|2,0,0]=3 1795 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 240690a_100015525214_100000766932 [0,1,0,0,0,0|2,0,0]=3 1796 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 527a_100015525214_100000766932 [0,1,0,0,0,0|2,0,0]=3 1797 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 11a_100015525214_100000185840 [0,1,0,0,0,0|2,0,0]=3 1798 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 240690a_100015525214_100000185840 [0,1,0,0,0,0|2,0,0]=3 1799 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 527a_100015525214_100000185840 [0,1,0,0,0,0|2,0,0]=3 1800 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 11a_100015525214_100000211397 [0,1,0,0,0,0|2,0,0]=3 1801 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 240690a_100015525214_100000211397 [0,1,0,0,0,0|2,0,0]=3 1802 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 527a_100015525214_100000211397 [0,1,0,0,0,0|2,0,0]=3 1803 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 11a_100015525214_100000751301 [0,1,0,0,0,0|2,0,0]=3 1804 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 240690a_100015525214_100000751301 [0,1,0,0,0,0|2,0,0]=3 1805 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 527a_100015525214_100000751301 [0,1,0,0,0,0|2,0,0]=3 1806 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)O 240690a_100015525214_100000702456 [0,1,0,0,0,0|2,0,0]=3 1807 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)O 527a_100015525214_100000702456 [0,1,0,0,0,0|2,0,0]=3 1808 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 11a_100015525214_100000214689 [0,1,0,0,0,0|2,0,0]=3 1809 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 240690a_100015525214_100000214689 [0,1,0,0,0,0|2,0,0]=3 1810 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 527a_100015525214_100000214689 [0,1,0,0,0,0|2,0,0]=3 1811 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 11a_100015525214_100000766033 [0,1,0,0,0,0|2,0,0]=3 1812 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 240690a_100015525214_100000766033 [0,1,0,0,0,0|2,0,0]=3 1813 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 527a_100015525214_100000766033 [0,1,0,0,0,0|2,0,0]=3 1814 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 11a_100015525214_100000212326 [0,1,0,0,0,0|2,0,0]=3 1815 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 240690a_100015525214_100000212326 [0,1,0,0,0,0|2,0,0]=3 1816 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 527a_100015525214_100000212326 [0,1,0,0,0,0|2,0,0]=3 1817 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 11a_100015525214_100000211022 [0,1,0,0,0,0|2,0,0]=3 1818 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 240690a_100015525214_100000211022 [0,1,0,0,0,0|2,0,0]=3 1819 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 527a_100015525214_100000211022 [0,1,0,0,0,0|2,0,0]=3 1820 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 11a_100015525214_100000037189 [0,1,0,0,0,0|2,0,0]=3 1821 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 240690a_100015525214_100000037189 [0,1,0,0,0,0|2,0,0]=3 1822 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 527a_100015525214_100000037189 [0,1,0,0,0,0|2,0,0]=3 1823 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 240690a_100015525214_100000689029 [0,1,0,0,0,0|2,0,0]=3 1824 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 271570a_203496583355_200000215476 [0,1,0,0,0,0|2,0,0]=3 1825 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 527a_100015525214_100000689029 [0,1,0,0,0,0|2,0,0]=3 1826 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 11a_100015525214_100000751167 [0,1,0,0,0,0|2,0,0]=3 1827 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 240690a_100015525214_100000751167 [0,1,0,0,0,0|2,0,0]=3 1828 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 527a_100015525214_100000751167 [0,1,0,0,0,0|2,0,0]=3 1829 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 11a_100015525214_100009999607 [0,1,0,0,0,0|2,0,0]=3 1830 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 240690a_100015525214_100009999607 [0,1,0,0,0,0|2,0,0]=3 1831 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 527a_100015525214_100009999607 [0,1,0,0,0,0|2,0,0]=3 1832 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 11a_100015525214_100000739380 [0,1,0,0,0,0|2,0,0]=3 1833 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 240690a_100015525214_100000739380 [0,1,0,0,0,0|2,0,0]=3 1834 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 527a_100015525214_100000739380 [0,1,0,0,0,0|2,0,0]=3 1835 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 11a_100015525214_100000739341 [0,1,0,0,0,0|2,0,0]=3 1836 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 240690a_100015525214_100000739341 [0,1,0,0,0,0|2,0,0]=3 1837 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 527a_100015525214_100000739341 [0,1,0,0,0,0|2,0,0]=3 1838 B13R1.1511 CCNC(=O)c1ccc(cc1O)Br 240690a_100015525214_100000744433 [0,1,0,0,0,0|1,0,0]=2 1839 B13R1.1511 CCNC(=O)c1ccc(cc1O)Br 527a_100015525214_100000744433 [0,1,0,0,0,0|1,0,0]=2 1840 B13R1.1511 CCNC(=O)c1ccc(cc1O)C 240690a_100015525214_100000212137 [0,1,0,0,0,0|1,0,0]=2 1841 B13R1.1511 CCNC(=O)c1ccc(cc1O)C 527a_100015525214_100000212137 [0,1,0,0,0,0|1,0,0]=2 1842 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 11a_100015525214_100000188622 [0,1,0,0,0,0|1,0,0]=2 1843 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 240690a_100015525214_100000188622 [0,1,0,0,0,0|1,0,0]=2 1844 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 527a_100015525214_100000188622 [0,1,0,0,0,0|1,0,0]=2 1845 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 240690a_100015525214_100000746061 [0,1,0,0,0,0|1,0,0]=2 1846 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 271570a_203496583355_100000203945 [0,1,0,0,0,0|1,0,0]=2 1847 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 527a_100015525214_100000746061 [0,1,0,0,0,0|1,0,0]=2 1848 B13R1.1511 CCNC(=O)c1ccc(cc1O)I 240690a_100015525214_100000091984 [0,1,0,0,0,0|1,0,0]=2 1849 B13R1.1511 CCNC(=O)c1ccc(cc1O)I 527a_100015525214_100000091984 [0,1,0,0,0,0|1,0,0]=2 1850 B13R1.1511 CCNC(C)c1ccc(cc1O)Br 269862a_100015525214_100000188348 [0,1,0,0,0,0|2,0,1]=4 1851 B13R1.1511 CCNC(C)c1ccc(cc1O)C 269862a_100015525214_100000234885 [0,1,0,0,0,0|2,0,1]=4 1852 B13R1.1511 CCNC(C)c1ccc(cc1O)Cl 269862a_100015525214_100000061402 [0,1,0,0,0,0|2,0,1]=4 1853 B13R1.1511 CCNC(C)c1ccc(cc1O)F 269862a_100015525214_100011215782 [0,1,0,0,0,0|2,0,1]=4 1854 B13R1.1511 CCOC(=O)c1ccc(cc1C)O 271570a_203496583355_100011327926 [0,1,0,0,0,0|1,0,0]=2 1855 B13R1.1511 CCOC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060723 [0,1,0,0,0,0|1,0,0]=2 1856 B13R1.1511 CCOC(=O)c1ccc(cc1F)O 271570a_203496583355_100010244673 [0,1,0,0,0,0|1,0,0]=2 1857 B13R1.1511 CCOC(=O)c1ccc(cc1O)C 271570a_203496583355_200012185120 [0,1,0,0,0,0|0,0,0]=1 1858 B13R1.1511 CCOC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047509 [0,1,0,0,0,0|0,0,0]=1 1859 B13R1.1511 CCOC(=O)c1ccc(cc1O)F 271570a_203496583355_100011206307 [0,1,0,0,0,0|0,0,0]=1 1860 B13R1.1511 CCOC(=O)c1ccc(nc1C)O 271570a_203496583355_100000106303 [0,1,0,0,0,0|2,0,0]=3 1861 B13R1.1511 CCOC(=O)c1cnc(nc1C)O 271570a_203496583355_100000693866 [0,1,0,0,0,0|3,0,0]=4 1862 B13R1.1511 CCOC(=O)c1cnc(nc1O)C 271570a_203496583355_100011240830 [0,1,0,0,0,0|2,0,0]=3 1863 B13R1.1511 CCOC(=O)c1cnc(nc1O)N 271570a_203496583355_100010080570 [0,1,0,0,0,0|2,0,0]=3 1864 B13R1.1511 CCOC(=O)c1ncc(cc1C)O 271570a_203496583355_100010201522 [0,1,0,0,0,0|2,0,0]=3 1865 B13R1.1511 CCOC(=O)c1ncc(cc1N)O 271570a_203496583355_100010230144 [0,1,0,0,0,0|2,0,0]=3 1866 B13R1.1511 CCOC(=O)c1ncc(cc1O)O 271570a_203496583355_100016103240 [0,1,0,0,0,0|1,0,0]=2 1867 B13R1.1511 CCOC(C)c1ccc(cc1C)C 34a_100000246504_100000210202 [0,1,0,0,0,0|2,0,1]=4 1868 B13R1.1511 CCOC(C)c1ccc(cc1C)C 7a_100000246504_100000210202 [0,1,0,0,0,0|2,0,1]=4 1869 B13R1.1511 CCOC(C)c1ccc(cc1Cl)Cl 34a_100000743050_100000210202 [0,1,0,0,0,0|2,0,1]=4 1870 B13R1.1511 CCOC(C)c1ccc(cc1Cl)Cl 7a_100000743050_100000210202 [0,1,0,0,0,0|2,0,1]=4 1871 B13R1.1511 CCOC(C)c1ccc(cc1Cl)F 34a_200011245020_100000210202 [0,1,0,0,0,0|2,0,1]=4 1872 B13R1.1511 CCOC(C)c1ccc(cc1Cl)F 7a_200011245020_100000210202 [0,1,0,0,0,0|2,0,1]=4 1873 B13R1.1511 CCOC(C)c1ccc(cc1F)Cl 34a_200011805215_100000210202 [0,1,0,0,0,0|2,0,1]=4 1874 B13R1.1511 CCOC(C)c1ccc(cc1F)Cl 7a_200011805215_100000210202 [0,1,0,0,0,0|2,0,1]=4 1875 B13R1.1511 CCOC(C)c1ccc(cc1F)F 34a_200000246518_100000210202 [0,1,0,0,0,0|2,0,1]=4 1876 B13R1.1511 CCOC(C)c1ccc(cc1F)F 7a_200000246518_100000210202 [0,1,0,0,0,0|2,0,1]=4 1877 B13R1.1511 CNCC(=O)c1ccc(cc1Br)F 34a_100102657272_100012361341 [0,1,0,0,0,0|3,0,0]=4 1878 B13R1.1511 CNCC(=O)c1ccc(cc1Br)F 7a_106832991635_100012361341 [0,1,0,0,0,0|3,0,0]=4 1879 B13R1.1511 CNCC(=O)c1ccc(cc1C)C 2230a_106832991635_100000229959 [0,1,0,0,0,0|3,0,0]=4 1880 B13R1.1511 CNCC(=O)c1ccc(cc1C)C 34a_100102657272_100000229959 [0,1,0,0,0,0|3,0,0]=4 1881 B13R1.1511 CNCC(=O)c1ccc(cc1C)C 7a_106832991635_100000229959 [0,1,0,0,0,0|3,0,0]=4 1882 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)Cl 2230a_106832991635_100011218845 [0,1,0,0,0,0|3,0,0]=4 1883 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)F 2230a_106832991635_100012056422 [0,1,0,0,0,0|3,0,0]=4 1884 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)F 34a_100102657272_100012056422 [0,1,0,0,0,0|3,0,0]=4 1885 B13R1.1511 CNCC(=O)c1ccc(cc1F)Br 34a_100102657272_200012361339 [0,1,0,0,0,0|3,0,0]=4 1886 B13R1.1511 CNCC(=O)c1ccc(cc1F)Br 7a_106832991635_200012361339 [0,1,0,0,0,0|3,0,0]=4 1887 B13R1.1511 CNCC(=O)c1ccc(cc1F)Cl 34a_100102657272_100012351891 [0,1,0,0,0,0|3,0,0]=4 1888 B13R1.1511 CNCC(=O)c1ccc(cc1F)Cl 7a_106832991635_100012351891 [0,1,0,0,0,0|3,0,0]=4 1889 B13R1.1511 CNCC(=O)c1ccc(cc1F)F 34a_100102657272_100000229962 [0,1,0,0,0,0|3,0,0]=4 1890 B13R1.1511 CNCC(=O)c1ccc(cc1F)F 7a_106832991635_100000229962 [0,1,0,0,0,0|3,0,0]=4 1891 B13R1.1511 CNCC(=O)c1ccc(cc1O)F 34a_100102657272_100009817053 [0,1,0,0,0,0|2,0,0]=3 1892 B13R1.1511 CNCC(=O)c1ccc(cc1O)O 34a_100102657272_100009814262 [0,1,0,0,0,0|2,0,0]=3 1893 B13R1.1511 CNCC(=O)c1ccc(cc1O)O 7a_106832991635_100009814262 [0,1,0,0,0,0|2,0,0]=3 1894 B13R1.1511 CNNC(=O)c1ccc(cc1Br)Br 22a_100016993582_100000762965 [0,1,0,0,0,0|3,0,0]=4 1895 B13R1.1511 CNNC(=O)c1ccc(cc1Br)C 22a_100016993582_100000685072 [0,1,0,0,0,0|3,0,0]=4 1896 B13R1.1511 CNNC(=O)c1ccc(cc1Br)Cl 22a_100016993582_100000766353 [0,1,0,0,0,0|3,0,0]=4 1897 B13R1.1511 CNNC(=O)c1ccc(cc1Br)F 22a_100016993582_100000212304 [0,1,0,0,0,0|3,0,0]=4 1898 B13R1.1511 CNNC(=O)c1ccc(cc1Br)I 22a_100016993582_100012360512 [0,1,0,0,0,0|3,0,0]=4 1899 B13R1.1511 CNNC(=O)c1ccc(cc1Br)O 22a_100016993582_100012344906 [0,1,0,0,0,0|3,0,0]=4 1900 B13R1.1511 CNNC(=O)c1ccc(cc1C)Br 22a_100016993582_100000741311 [0,1,0,0,0,0|3,0,0]=4 1901 B13R1.1511 CNNC(=O)c1ccc(cc1C)C 22a_100016993582_100000211164 [0,1,0,0,0,0|3,0,0]=4 1902 B13R1.1511 CNNC(=O)c1ccc(cc1C)Cl 22a_100016993582_100000688705 [0,1,0,0,0,0|3,0,0]=4 1903 B13R1.1511 CNNC(=O)c1ccc(cc1C)F 22a_100016993582_100000686989 [0,1,0,0,0,0|3,0,0]=4 1904 B13R1.1511 CNNC(=O)c1ccc(cc1C)I 22a_100016993582_100010189873 [0,1,0,0,0,0|3,0,0]=4 1905 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)Br 22a_100016993582_100000741628 [0,1,0,0,0,0|3,0,0]=4 1906 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)C 22a_100016993582_100000766932 [0,1,0,0,0,0|3,0,0]=4 1907 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)Cl 22a_100016993582_100000185840 [0,1,0,0,0,0|3,0,0]=4 1908 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)F 22a_100016993582_100000211397 [0,1,0,0,0,0|3,0,0]=4 1909 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)I 22a_100016993582_100000751301 [0,1,0,0,0,0|3,0,0]=4 1910 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)O 22a_100016993582_100000702456 [0,1,0,0,0,0|3,0,0]=4 1911 B13R1.1511 CNNC(=O)c1ccc(cc1F)Br 22a_100016993582_100000214689 [0,1,0,0,0,0|3,0,0]=4 1912 B13R1.1511 CNNC(=O)c1ccc(cc1F)C 22a_100016993582_100000766033 [0,1,0,0,0,0|3,0,0]=4 1913 B13R1.1511 CNNC(=O)c1ccc(cc1F)Cl 22a_100016993582_100000212326 [0,1,0,0,0,0|3,0,0]=4 1914 B13R1.1511 CNNC(=O)c1ccc(cc1F)F 22a_100016993582_100000211022 [0,1,0,0,0,0|3,0,0]=4 1915 B13R1.1511 CNNC(=O)c1ccc(cc1F)I 22a_100016993582_100000037189 [0,1,0,0,0,0|3,0,0]=4 1916 B13R1.1511 CNNC(=O)c1ccc(cc1F)O 22a_100016993582_100000689029 [0,1,0,0,0,0|3,0,0]=4 1917 B13R1.1511 CNNC(=O)c1ccc(cc1I)Br 22a_100016993582_100000751167 [0,1,0,0,0,0|3,0,0]=4 1918 B13R1.1511 CNNC(=O)c1ccc(cc1I)C 22a_100016993582_100009999607 [0,1,0,0,0,0|3,0,0]=4 1919 B13R1.1511 CNNC(=O)c1ccc(cc1I)Cl 22a_100016993582_100000739380 [0,1,0,0,0,0|3,0,0]=4 1920 B13R1.1511 CNNC(=O)c1ccc(cc1I)F 22a_100016993582_100000739341 [0,1,0,0,0,0|3,0,0]=4 1921 B13R1.1511 CNNC(=O)c1ccc(cc1O)Br 22a_100016993582_100000744433 [0,1,0,0,0,0|2,0,0]=3 1922 B13R1.1511 CNNC(=O)c1ccc(cc1O)C 22a_100016993582_100000212137 [0,1,0,0,0,0|2,0,0]=3 1923 B13R1.1511 CNNC(=O)c1ccc(cc1O)Cl 22a_100016993582_100000188622 [0,1,0,0,0,0|2,0,0]=3 1924 B13R1.1511 CNNC(=O)c1ccc(cc1O)F 22a_100016993582_100000746061 [0,1,0,0,0,0|2,0,0]=3 1925 B13R1.1511 CNNC(=O)c1ccc(cc1O)I 22a_100016993582_100000091984 [0,1,0,0,0,0|2,0,0]=3 1926 B13R1.1511 CNNC(=O)c1ccc(cc1O)O 22a_100016993582_100000212172 [0,1,0,0,0,0|2,0,0]=3 1927 B13R1.1511 COCC(=O)c1ccc(cc1Br)F 34a_100138415774_100012361341 [0,1,0,0,0,0|3,0,0]=4 1928 B13R1.1511 COCC(=O)c1ccc(cc1C)C 34a_100138415774_100000229959 [0,1,0,0,0,0|3,0,0]=4 1929 B13R1.1511 COCC(=O)c1ccc(cc1Cl)F 34a_100138415774_100012056422 [0,1,0,0,0,0|3,0,0]=4 1930 B13R1.1511 COCC(=O)c1ccc(cc1F)Br 34a_100138415774_200012361339 [0,1,0,0,0,0|3,0,0]=4 1931 B13R1.1511 COCC(=O)c1ccc(cc1F)Cl 34a_100138415774_100012351891 [0,1,0,0,0,0|3,0,0]=4 1932 B13R1.1511 COCC(=O)c1ccc(cc1F)F 34a_100138415774_100000229962 [0,1,0,0,0,0|3,0,0]=4 1933 B13R1.1511 COCC(=O)c1ccc(cc1O)F 34a_100138415774_100009817053 [0,1,0,0,0,0|2,0,0]=3 1934 B13R1.1511 COCC(=O)c1ccc(cc1O)O 34a_100138415774_100009814262 [0,1,0,0,0,0|2,0,0]=3 1935 B13R1.1511 CSCC(=O)c1ccc(cc1Br)F 62a_100012361341_200000210301 [0,1,0,0,0,0|3,0,0]=4 1936 B13R1.1511 CSCC(=O)c1ccc(cc1C)C 62a_100000229959_200000210301 [0,1,0,0,0,0|3,0,0]=4 1937 B13R1.1511 CSCC(=O)c1ccc(cc1C)C 62a_200000210301_100000229959 [0,1,0,0,0,0|3,0,0]=4 1938 B13R1.1511 CSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_200000210301 [0,1,0,0,0,0|3,0,0]=4 1939 B13R1.1511 CSCC(=O)c1ccc(cc1Cl)F 62a_100012056422_200000210301 [0,1,0,0,0,0|3,0,0]=4 1940 B13R1.1511 CSCC(=O)c1ccc(cc1Cl)F 62a_200000210301_100012056422 [0,1,0,0,0,0|3,0,0]=4 1941 B13R1.1511 CSCC(=O)c1ccc(cc1F)Br 62a_200012361339_200000210301 [0,1,0,0,0,0|3,0,0]=4 1942 B13R1.1511 CSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_200000210301 [0,1,0,0,0,0|3,0,0]=4 1943 B13R1.1511 CSCC(=O)c1ccc(cc1F)Cl 62a_200000210301_100012351891 [0,1,0,0,0,0|3,0,0]=4 1944 B13R1.1511 CSCC(=O)c1ccc(cc1F)F 62a_100000229962_200000210301 [0,1,0,0,0,0|3,0,0]=4 1945 B13R1.1511 CSCC(=O)c1ccc(cc1F)F 62a_200000210301_100000229962 [0,1,0,0,0,0|3,0,0]=4 1946 B13R1.1511 CSCC(=O)c1ccc(cc1O)F 62a_100009817053_200000210301 [0,1,0,0,0,0|2,0,0]=3 1947 B13R1.1511 CSCC(=O)c1ccc(cc1O)F 62a_200000210301_100009817053 [0,1,0,0,0,0|2,0,0]=3 1948 B13R1.1511 CSCC(=O)c1ccc(cc1O)O 62a_100009814262_200000210301 [0,1,0,0,0,0|2,0,0]=3 1949 B13R1.1511 CSCC(=O)c1ccc(cc1O)O 62a_200000210301_100009814262 [0,1,0,0,0,0|2,0,0]=3 1950 B13R1.1511 Cc1cc(ccc1C(=O)CCF)Br 1458a_100000741311_100011217306 [0,1,0,0,0,0|3,0,0]=4 1951 B13R1.1511 Cc1cc(ccc1C(=O)CCF)Cl 1458a_100000688705_100011217306 [0,1,0,0,0,0|3,0,0]=4 1952 B13R1.1511 Cc1cc(ccc1C(=O)CCF)F 1458a_100000686989_100011217306 [0,1,0,0,0,0|3,0,0]=4 1953 B13R1.1511 Cc1cc(ccc1C(=O)CCF)I 1458a_100010189873_100011217306 [0,1,0,0,0,0|3,0,0]=4 1954 B13R1.1511 Cc1cc(ccc1C(=O)CCF)O 1458a_100000692822_100011217306 [0,1,0,0,0,0|3,0,0]=4 1955 B13R1.1511 Cc1cc(ccc1C(=O)CCO)Br 1458a_100000741311_100000211926 [0,1,0,0,0,0|3,0,0]=4 1956 B13R1.1511 Cc1cc(ccc1C(=O)CCO)Cl 1458a_100000688705_100000211926 [0,1,0,0,0,0|3,0,0]=4 1957 B13R1.1511 Cc1cc(ccc1C(=O)CCO)F 1458a_100000686989_100000211926 [0,1,0,0,0,0|3,0,0]=4 1958 B13R1.1511 Cc1cc(ccc1C(=O)CCO)I 1458a_100010189873_100000211926 [0,1,0,0,0,0|3,0,0]=4 1959 B13R1.1511 Cc1cc(ccc1C(=O)CCO)O 1458a_100000692822_100000211926 [0,1,0,0,0,0|3,0,0]=4 1960 B13R1.1511 Cc1ccc(c(c1)Br)C(=O)CCF 1458a_100000685072_100011217306 [0,1,0,0,0,0|3,0,0]=4 1961 B13R1.1511 Cc1ccc(c(c1)Br)C(=O)CCO 1458a_100000685072_100000211926 [0,1,0,0,0,0|3,0,0]=4 1962 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CCF 1458a_100000211164_100011217306 [0,1,0,0,0,0|3,0,0]=4 1963 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CCO 1458a_100000211164_100000211926 [0,1,0,0,0,0|3,0,0]=4 1964 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CS[13CH3] 62a_100000229959_200025704644 [0,1,0,0,0,0|3,0,0]=4 1965 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CS[13CH3] 62a_200025704644_100000229959 [0,1,0,0,0,0|3,0,0]=4 1966 B13R1.1511 Cc1ccc(c(c1)Cl)C(=O)CCF 1458a_100000766932_100011217306 [0,1,0,0,0,0|3,0,0]=4 1967 B13R1.1511 Cc1ccc(c(c1)Cl)C(=O)CCO 1458a_100000766932_100000211926 [0,1,0,0,0,0|3,0,0]=4 1968 B13R1.1511 Cc1ccc(c(c1)F)C(=O)CCF 1458a_100000766033_100011217306 [0,1,0,0,0,0|3,0,0]=4 1969 B13R1.1511 Cc1ccc(c(c1)F)C(=O)CCO 1458a_100000766033_100000211926 [0,1,0,0,0,0|3,0,0]=4 1970 B13R1.1511 Cc1ccc(c(c1)I)C(=O)CCF 1458a_100009999607_100011217306 [0,1,0,0,0,0|3,0,0]=4 1971 B13R1.1511 Cc1ccc(c(c1)I)C(=O)CCO 1458a_100009999607_100000211926 [0,1,0,0,0,0|3,0,0]=4 1972 B13R1.1511 Cc1ccc(c(c1)O)C(=O)CC#N 1458a_100000212137_100011214920 [0,1,0,0,0,0|2,0,1]=4 1973 B13R1.1511 Cc1ccc(c(c1)O)C(=O)CCF 1458a_100000212137_100011217306 [0,1,0,0,0,0|2,0,0]=3 1974 B13R1.1511 Cc1ccc(c(c1)O)C(=O)CCO 1458a_100000212137_100000211926 [0,1,0,0,0,0|2,0,0]=3 1975 B13R1.1511 N#CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011214920 [0,1,0,0,0,0|2,0,1]=4 1976 B13R1.1511 N#CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011214920 [0,1,0,0,0,0|2,0,1]=4 1977 B13R1.1511 N#CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011214920 [0,1,0,0,0,0|2,0,1]=4 1978 B13R1.1511 N#CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011214920 [0,1,0,0,0,0|2,0,1]=4 1979 B13R1.1511 N#CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011214920 [0,1,0,0,0,0|2,0,1]=4 1980 B13R1.1511 O=C(CCF)c1ccc(cc1Br)Br 1458a_100000762965_100011217306 [0,1,0,0,0,0|3,0,0]=4 1981 B13R1.1511 O=C(CCF)c1ccc(cc1Br)Cl 1458a_100000766353_100011217306 [0,1,0,0,0,0|3,0,0]=4 1982 B13R1.1511 O=C(CCF)c1ccc(cc1Br)F 1458a_100000212304_100011217306 [0,1,0,0,0,0|3,0,0]=4 1983 B13R1.1511 O=C(CCF)c1ccc(cc1Br)I 1458a_100012360512_100011217306 [0,1,0,0,0,0|3,0,0]=4 1984 B13R1.1511 O=C(CCF)c1ccc(cc1Br)O 1458a_100012344906_100011217306 [0,1,0,0,0,0|3,0,0]=4 1985 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)Br 1458a_100000741628_100011217306 [0,1,0,0,0,0|3,0,0]=4 1986 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)Cl 1458a_100000185840_100011217306 [0,1,0,0,0,0|3,0,0]=4 1987 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)F 1458a_100000211397_100011217306 [0,1,0,0,0,0|3,0,0]=4 1988 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)I 1458a_100000751301_100011217306 [0,1,0,0,0,0|3,0,0]=4 1989 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)O 1458a_100000702456_100011217306 [0,1,0,0,0,0|3,0,0]=4 1990 B13R1.1511 O=C(CCF)c1ccc(cc1F)Br 1458a_100000214689_100011217306 [0,1,0,0,0,0|3,0,0]=4 1991 B13R1.1511 O=C(CCF)c1ccc(cc1F)Cl 1458a_100000212326_100011217306 [0,1,0,0,0,0|3,0,0]=4 1992 B13R1.1511 O=C(CCF)c1ccc(cc1F)F 1458a_100000211022_100011217306 [0,1,0,0,0,0|3,0,0]=4 1993 B13R1.1511 O=C(CCF)c1ccc(cc1F)I 1458a_100000037189_100011217306 [0,1,0,0,0,0|3,0,0]=4 1994 B13R1.1511 O=C(CCF)c1ccc(cc1F)O 1458a_100000689029_100011217306 [0,1,0,0,0,0|3,0,0]=4 1995 B13R1.1511 O=C(CCF)c1ccc(cc1I)Br 1458a_100000751167_100011217306 [0,1,0,0,0,0|3,0,0]=4 1996 B13R1.1511 O=C(CCF)c1ccc(cc1I)Cl 1458a_100000739380_100011217306 [0,1,0,0,0,0|3,0,0]=4 1997 B13R1.1511 O=C(CCF)c1ccc(cc1I)F 1458a_100000739341_100011217306 [0,1,0,0,0,0|3,0,0]=4 1998 B13R1.1511 O=C(CCF)c1ccc(cc1O)Br 1458a_100000744433_100011217306 [0,1,0,0,0,0|2,0,0]=3 1999 B13R1.1511 O=C(CCF)c1ccc(cc1O)Cl 1458a_100000188622_100011217306 [0,1,0,0,0,0|2,0,0]=3 2000 B13R1.1511 O=C(CCF)c1ccc(cc1O)F 1458a_100000746061_100011217306 [0,1,0,0,0,0|2,0,0]=3 2001 B13R1.1511 O=C(CCF)c1ccc(cc1O)I 1458a_100000091984_100011217306 [0,1,0,0,0,0|2,0,0]=3 2002 B13R1.1511 O=C(CCF)c1ccc(cc1O)O 1458a_100000212172_100011217306 [0,1,0,0,0,0|2,0,0]=3 2003 B13R1.1511 O=C(CCO)c1ccc(cc1Br)Br 1458a_100000762965_100000211926 [0,1,0,0,0,0|3,0,0]=4 2004 B13R1.1511 O=C(CCO)c1ccc(cc1Br)Cl 1458a_100000766353_100000211926 [0,1,0,0,0,0|3,0,0]=4 2005 B13R1.1511 O=C(CCO)c1ccc(cc1Br)F 1458a_100000212304_100000211926 [0,1,0,0,0,0|3,0,0]=4 2006 B13R1.1511 O=C(CCO)c1ccc(cc1Br)I 1458a_100012360512_100000211926 [0,1,0,0,0,0|3,0,0]=4 2007 B13R1.1511 O=C(CCO)c1ccc(cc1Br)O 1458a_100012344906_100000211926 [0,1,0,0,0,0|3,0,0]=4 2008 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)Br 1458a_100000741628_100000211926 [0,1,0,0,0,0|3,0,0]=4 2009 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100000211926 [0,1,0,0,0,0|3,0,0]=4 2010 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)F 1458a_100000211397_100000211926 [0,1,0,0,0,0|3,0,0]=4 2011 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)I 1458a_100000751301_100000211926 [0,1,0,0,0,0|3,0,0]=4 2012 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)O 1458a_100000702456_100000211926 [0,1,0,0,0,0|3,0,0]=4 2013 B13R1.1511 O=C(CCO)c1ccc(cc1F)Br 1458a_100000214689_100000211926 [0,1,0,0,0,0|3,0,0]=4 2014 B13R1.1511 O=C(CCO)c1ccc(cc1F)Cl 1458a_100000212326_100000211926 [0,1,0,0,0,0|3,0,0]=4 2015 B13R1.1511 O=C(CCO)c1ccc(cc1F)F 1458a_100000211022_100000211926 [0,1,0,0,0,0|3,0,0]=4 2016 B13R1.1511 O=C(CCO)c1ccc(cc1F)I 1458a_100000037189_100000211926 [0,1,0,0,0,0|3,0,0]=4 2017 B13R1.1511 O=C(CCO)c1ccc(cc1F)O 1458a_100000689029_100000211926 [0,1,0,0,0,0|3,0,0]=4 2018 B13R1.1511 O=C(CCO)c1ccc(cc1I)Br 1458a_100000751167_100000211926 [0,1,0,0,0,0|3,0,0]=4 2019 B13R1.1511 O=C(CCO)c1ccc(cc1I)Cl 1458a_100000739380_100000211926 [0,1,0,0,0,0|3,0,0]=4 2020 B13R1.1511 O=C(CCO)c1ccc(cc1I)F 1458a_100000739341_100000211926 [0,1,0,0,0,0|3,0,0]=4 2021 B13R1.1511 O=C(CCO)c1ccc(cc1O)Br 1458a_100000744433_100000211926 [0,1,0,0,0,0|2,0,0]=3 2022 B13R1.1511 O=C(CCO)c1ccc(cc1O)Cl 1458a_100000188622_100000211926 [0,1,0,0,0,0|2,0,0]=3 2023 B13R1.1511 O=C(CCO)c1ccc(cc1O)F 1458a_100000746061_100000211926 [0,1,0,0,0,0|2,0,0]=3 2024 B13R1.1511 O=C(CCO)c1ccc(cc1O)I 1458a_100000091984_100000211926 [0,1,0,0,0,0|2,0,0]=3 2025 B13R1.1511 O=C(CCO)c1ccc(cc1O)O 1458a_100000212172_100000211926 [0,1,0,0,0,0|2,0,0]=3 2026 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Br)F 62a_100012361341_200025704644 [0,1,0,0,0,0|3,0,0]=4 2027 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_200025704644 [0,1,0,0,0,0|3,0,0]=4 2028 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Cl)F 62a_100012056422_200025704644 [0,1,0,0,0,0|3,0,0]=4 2029 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Cl)F 62a_200025704644_100012056422 [0,1,0,0,0,0|3,0,0]=4 2030 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Br 62a_200012361339_200025704644 [0,1,0,0,0,0|3,0,0]=4 2031 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Cl 62a_100012351891_200025704644 [0,1,0,0,0,0|3,0,0]=4 2032 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Cl 62a_200025704644_100012351891 [0,1,0,0,0,0|3,0,0]=4 2033 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)F 62a_100000229962_200025704644 [0,1,0,0,0,0|3,0,0]=4 2034 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)F 62a_200025704644_100000229962 [0,1,0,0,0,0|3,0,0]=4 2035 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)F 62a_100009817053_200025704644 [0,1,0,0,0,0|2,0,0]=3 2036 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)F 62a_200025704644_100009817053 [0,1,0,0,0,0|2,0,0]=3 2037 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)O 62a_100009814262_200025704644 [0,1,0,0,0,0|2,0,0]=3 2038 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)O 62a_200025704644_100009814262 [0,1,0,0,0,0|2,0,0]=3 2039 B13R1.2819 CCNS(=O)(=O)c1ccccc1Br 270084a_100015525214_100000184729 [0,1,0,0,0,0|3,0,0]=4 2040 B13R1.2819 CCNS(=O)(=O)c1ccccc1Br 274078a_100015525214_100000184729 [0,1,0,0,0,0|3,0,0]=4 2041 B13R1.2819 CCNS(=O)(=O)c1ccccc1Br 40a_100015525214_100010380725 [0,1,0,0,0,0|3,0,0]=4 2042 B13R1.2819 CCNS(=O)(=O)c1ccccc1C 270084a_100015525214_100000750907 [0,1,0,0,0,0|3,0,0]=4 2043 B13R1.2819 CCNS(=O)(=O)c1ccccc1C 274078a_100015525214_100000750907 [0,1,0,0,0,0|3,0,0]=4 2044 B13R1.2819 CCNS(=O)(=O)c1ccccc1C 40a_100015525214_100010269479 [0,1,0,0,0,0|3,0,0]=4 2045 B13R1.2819 CCNS(=O)(=O)c1ccccc1Cl 270084a_100015525214_100000184199 [0,1,0,0,0,0|3,0,0]=4 2046 B13R1.2819 CCNS(=O)(=O)c1ccccc1Cl 274078a_100015525214_100000184199 [0,1,0,0,0,0|3,0,0]=4 2047 B13R1.2819 CCNS(=O)(=O)c1ccccc1F 270084a_100015525214_100000184916 [0,1,0,0,0,0|3,0,0]=4 2048 B13R1.2819 CCNS(=O)(=O)c1ccccc1F 274078a_100015525214_100000184916 [0,1,0,0,0,0|3,0,0]=4 2049 B13R1.2819 CCNS(=O)(=O)c1ccccc1I 270084a_100015525214_100011191325 [0,1,0,0,0,0|3,0,0]=4 2050 B13R1.2819 CCNS(=O)(=O)c1ccccc1I 274078a_100015525214_100011191325 [0,1,0,0,0,0|3,0,0]=4 2051 B13R1.2819 CCNS(=O)(=O)c1ccccc1N 40a_100015525214_100000703237 [0,1,0,0,0,0|3,0,0]=4 2052 B13R1.2819 CCNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000165236 [0,1,0,0,0,0|2,0,0]=3 2053 B13R1.2819 CCOC(C)(C)c1ccccc1Br 34a_100011346021_100000210202 [0,1,0,0,0,0|2,0,1]=4 2054 B13R1.2819 CCOC(C)(C)c1ccccc1Br 7a_100011346021_100000210202 [0,1,0,0,0,0|2,0,1]=4 2055 B13R1.2819 CCOC(C)(C)c1ccccc1Cl 34a_100000690508_100000210202 [0,1,0,0,0,0|2,0,1]=4 2056 B13R1.2819 CCOC(C)(C)c1ccccc1Cl 7a_100000690508_100000210202 [0,1,0,0,0,0|2,0,1]=4 2057 B13R1.2819 CCOC(C)(C)c1ccccc1F 34a_100011345963_100000210202 [0,1,0,0,0,0|2,0,1]=4 2058 B13R1.2819 CCOC(C)(C)c1ccccc1F 7a_100011345963_100000210202 [0,1,0,0,0,0|2,0,1]=4 2059 B13R1.2819 CCOC(C)(C)c1ccccc1I 34a_100010296449_100000210202 [0,1,0,0,0,0|2,0,1]=4 2060 B13R1.2819 CCOC(C)(C)c1ccccc1I 7a_100010296449_100000210202 [0,1,0,0,0,0|2,0,1]=4 2061 B13R1.2819 CCOC(C)(C)c1ccccc1N 7a_100000081495_100000210202 [0,1,0,0,0,0|2,0,1]=4 2062 B13R1.2819 CCOC(F)(F)c1ccccc1F 34a_100121572206_100000070671 [0,1,0,0,0,0|2,0,1]=4 2063 B13R1.2819 O=S(=O)(CCO)c1ccccc1O 271570a_203496583355_200012340577 [0,1,0,0,0,0|3,0,0]=4 2064 B13R1.4453 C#CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000184674 [0,1,0,0,0,0|1,0,2]=4 2065 B13R1.4453 C#CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000184674 [0,1,0,0,0,0|1,0,2]=4 2066 B13R1.4453 C#CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000184674 [0,1,0,0,0,0|1,0,2]=4 2067 B13R1.4453 C#CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000184674 [0,1,0,0,0,0|1,0,2]=4 2068 B13R1.4453 C#CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000184674 [0,1,0,0,0,0|1,0,2]=4 2069 B13R1.4453 C=CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210623 [0,1,0,0,0,0|1,0,2]=4 2070 B13R1.4453 C=CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210623 [0,1,0,0,0,0|1,0,2]=4 2071 B13R1.4453 C=CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210623 [0,1,0,0,0,0|1,0,2]=4 2072 B13R1.4453 C=CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210623 [0,1,0,0,0,0|1,0,2]=4 2073 B13R1.4453 C=CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210623 [0,1,0,0,0,0|1,0,2]=4 2074 B13R1.4453 CCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210303 [0,1,0,0,0,0|2,0,0]=3 2075 B13R1.4453 CCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000210303 [0,1,0,0,0,0|2,0,0]=3 2076 B13R1.4453 CCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210303 [0,1,0,0,0,0|2,0,0]=3 2077 B13R1.4453 CCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210303 [0,1,0,0,0,0|2,0,0]=3 2078 B13R1.4453 CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210303 [0,1,0,0,0,0|1,0,0]=2 2079 B13R1.4453 CCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000210303 [0,1,0,0,0,0|2,0,0]=3 2080 B13R1.4453 CCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000210303 [0,1,0,0,0,0|2,0,0]=3 2081 B13R1.4453 CCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210303 [0,1,0,0,0,0|2,0,0]=3 2082 B13R1.4453 CCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210303 [0,1,0,0,0,0|2,0,0]=3 2083 B13R1.4453 CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210303 [0,1,0,0,0,0|1,0,0]=2 2084 B13R1.4453 CCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000210303 [0,1,0,0,0,0|2,0,0]=3 2085 B13R1.4453 CCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210303 [0,1,0,0,0,0|2,0,0]=3 2086 B13R1.4453 CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210303 [0,1,0,0,0,0|1,0,0]=2 2087 B13R1.4453 CCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210303 [0,1,0,0,0,0|2,0,0]=3 2088 B13R1.4453 CCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000210303 [0,1,0,0,0,0|2,0,0]=3 2089 B13R1.4453 CCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210303 [0,1,0,0,0,0|2,0,0]=3 2090 B13R1.4453 CCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210303 [0,1,0,0,0,0|2,0,0]=3 2091 B13R1.4453 CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210303 [0,1,0,0,0,0|1,0,0]=2 2092 B13R1.4453 CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210303 [0,1,0,0,0,0|1,0,0]=2 2093 B13R1.4453 CCNC(=O)c1c(cccc1Br)Br 11a_100015525214_100000690891 [0,1,0,0,0,0|2,0,0]=3 2094 B13R1.4453 CCNC(=O)c1c(cccc1Br)Br 240690a_100015525214_100000690891 [0,1,0,0,0,0|2,0,0]=3 2095 B13R1.4453 CCNC(=O)c1c(cccc1Br)Br 527a_100015525214_100000690891 [0,1,0,0,0,0|2,0,0]=3 2096 B13R1.4453 CCNC(=O)c1c(cccc1Br)C 11a_100015525214_100000701904 [0,1,0,0,0,0|2,0,0]=3 2097 B13R1.4453 CCNC(=O)c1c(cccc1Br)C 240690a_100015525214_100000701904 [0,1,0,0,0,0|2,0,0]=3 2098 B13R1.4453 CCNC(=O)c1c(cccc1Br)C 527a_100015525214_100000701904 [0,1,0,0,0,0|2,0,0]=3 2099 B13R1.4453 CCNC(=O)c1c(cccc1Br)Cl 11a_100015525214_100011253703 [0,1,0,0,0,0|2,0,0]=3 2100 B13R1.4453 CCNC(=O)c1c(cccc1Br)Cl 240690a_100015525214_100011253703 [0,1,0,0,0,0|2,0,0]=3 2101 B13R1.4453 CCNC(=O)c1c(cccc1Br)Cl 527a_100015525214_100011253703 [0,1,0,0,0,0|2,0,0]=3 2102 B13R1.4453 CCNC(=O)c1c(cccc1Br)F 11a_100015525214_100000752694 [0,1,0,0,0,0|2,0,0]=3 2103 B13R1.4453 CCNC(=O)c1c(cccc1Br)F 240690a_100015525214_100000752694 [0,1,0,0,0,0|2,0,0]=3 2104 B13R1.4453 CCNC(=O)c1c(cccc1Br)F 527a_100015525214_100000752694 [0,1,0,0,0,0|2,0,0]=3 2105 B13R1.4453 CCNC(=O)c1c(cccc1Br)O 240690a_100015525214_100011935254 [0,1,0,0,0,0|1,0,0]=2 2106 B13R1.4453 CCNC(=O)c1c(cccc1Br)O 527a_100015525214_100011935254 [0,1,0,0,0,0|1,0,0]=2 2107 B13R1.4453 CCNC(=O)c1c(cccc1C)C 11a_100015525214_100000758298 [0,1,0,0,0,0|2,0,0]=3 2108 B13R1.4453 CCNC(=O)c1c(cccc1C)C 240690a_100015525214_100000758298 [0,1,0,0,0,0|2,0,0]=3 2109 B13R1.4453 CCNC(=O)c1c(cccc1Cl)C 11a_100015525214_100000692601 [0,1,0,0,0,0|2,0,0]=3 2110 B13R1.4453 CCNC(=O)c1c(cccc1Cl)C 240690a_100015525214_100000692601 [0,1,0,0,0,0|2,0,0]=3 2111 B13R1.4453 CCNC(=O)c1c(cccc1Cl)Cl 11a_100015525214_100000210656 [0,1,0,0,0,0|2,0,0]=3 2112 B13R1.4453 CCNC(=O)c1c(cccc1Cl)Cl 240690a_100015525214_100000210656 [0,1,0,0,0,0|2,0,0]=3 2113 B13R1.4453 CCNC(=O)c1c(cccc1Cl)F 11a_100015525214_100000210369 [0,1,0,0,0,0|2,0,0]=3 2114 B13R1.4453 CCNC(=O)c1c(cccc1Cl)F 240690a_100015525214_100000210369 [0,1,0,0,0,0|2,0,0]=3 2115 B13R1.4453 CCNC(=O)c1c(cccc1Cl)F 527a_100015525214_100000210369 [0,1,0,0,0,0|2,0,0]=3 2116 B13R1.4453 CCNC(=O)c1c(cccc1Cl)O 240690a_100015525214_100000745519 [0,1,0,0,0,0|1,0,0]=2 2117 B13R1.4453 CCNC(=O)c1c(cccc1Cl)O 527a_100015525214_100000745519 [0,1,0,0,0,0|1,0,0]=2 2118 B13R1.4453 CCNC(=O)c1c(cccc1F)C 11a_100015525214_100000762013 [0,1,0,0,0,0|2,0,0]=3 2119 B13R1.4453 CCNC(=O)c1c(cccc1F)C 240690a_100015525214_100000762013 [0,1,0,0,0,0|2,0,0]=3 2120 B13R1.4453 CCNC(=O)c1c(cccc1F)C 527a_100015525214_100000762013 [0,1,0,0,0,0|2,0,0]=3 2121 B13R1.4453 CCNC(=O)c1c(cccc1F)F 11a_100015525214_100000210804 [0,1,0,0,0,0|2,0,0]=3 2122 B13R1.4453 CCNC(=O)c1c(cccc1F)F 240690a_100015525214_100000210804 [0,1,0,0,0,0|2,0,0]=3 2123 B13R1.4453 CCNC(=O)c1c(cccc1F)F 527a_100015525214_100000210804 [0,1,0,0,0,0|2,0,0]=3 2124 B13R1.4453 CCNC(=O)c1c(cccc1F)O 527a_100015525214_100000763259 [0,1,0,0,0,0|1,0,0]=2 2125 B13R1.4453 CCNC(=O)c1c(cccc1I)Br 11a_100015525214_100010232521 [0,1,0,0,0,0|2,0,0]=3 2126 B13R1.4453 CCNC(=O)c1c(cccc1I)Br 240690a_100015525214_100010232521 [0,1,0,0,0,0|2,0,0]=3 2127 B13R1.4453 CCNC(=O)c1c(cccc1I)Br 527a_100015525214_100010232521 [0,1,0,0,0,0|2,0,0]=3 2128 B13R1.4453 CCNC(=O)c1c(cccc1I)C 11a_100015525214_100000688020 [0,1,0,0,0,0|2,0,0]=3 2129 B13R1.4453 CCNC(=O)c1c(cccc1I)C 240690a_100015525214_100000688020 [0,1,0,0,0,0|2,0,0]=3 2130 B13R1.4453 CCNC(=O)c1c(cccc1I)Cl 11a_100015525214_100000702859 [0,1,0,0,0,0|2,0,0]=3 2131 B13R1.4453 CCNC(=O)c1c(cccc1I)Cl 240690a_100015525214_100000702859 [0,1,0,0,0,0|2,0,0]=3 2132 B13R1.4453 CCNC(=O)c1c(cccc1I)Cl 527a_100015525214_100000702859 [0,1,0,0,0,0|2,0,0]=3 2133 B13R1.4453 CCNC(=O)c1c(cccc1I)F 11a_100015525214_100000023732 [0,1,0,0,0,0|2,0,0]=3 2134 B13R1.4453 CCNC(=O)c1c(cccc1I)F 240690a_100015525214_100000023732 [0,1,0,0,0,0|2,0,0]=3 2135 B13R1.4453 CCNC(=O)c1c(cccc1O)O 527a_100015525214_100000755285 [0,1,0,0,0,0|1,0,0]=2 2136 B13R1.4453 CCOC(=O)c1c(cccc1F)O 271570a_203496583355_100012357633 [0,1,0,0,0,0|0,0,0]=1 2137 B13R1.4453 CCOC(=O)c1c(ccnc1O)C 271570a_203496583355_100010068243 [0,1,0,0,0,0|1,0,0]=2 2138 B13R1.4453 CCOC(=O)c1c(ncnc1O)C 271570a_203496583355_200010876006 [0,1,0,0,0,0|2,0,0]=3 2139 B13R1.4453 CCOC(C)c1c(cccc1Br)F 34a_100013085324_100000210202 [0,1,0,0,0,0|2,0,1]=4 2140 B13R1.4453 CCOC(C)c1c(cccc1Br)F 7a_100013085324_100000210202 [0,1,0,0,0,0|2,0,1]=4 2141 B13R1.4453 CCOC(C)c1c(cccc1C)C 34a_200000695261_100000210202 [0,1,0,0,0,0|2,0,1]=4 2142 B13R1.4453 CCOC(C)c1c(cccc1C)C 7a_200000695261_100000210202 [0,1,0,0,0,0|2,0,1]=4 2143 B13R1.4453 CCOC(C)c1c(cccc1Cl)Cl 34a_100011215154_100000210202 [0,1,0,0,0,0|2,0,1]=4 2144 B13R1.4453 CCOC(C)c1c(cccc1Cl)Cl 7a_100011215154_100000210202 [0,1,0,0,0,0|2,0,1]=4 2145 B13R1.4453 CCOC(C)c1c(cccc1F)F 34a_100000742607_100000210202 [0,1,0,0,0,0|2,0,1]=4 2146 B13R1.4453 CCOC(C)c1c(cccc1F)F 7a_100000742607_100000210202 [0,1,0,0,0,0|2,0,1]=4 2147 B13R1.4453 CCO[C@H](C)c1c(cccc1Cl)F 34a_200012136785_100000210202 [0,1,0,0,0,0|2,0,1]=4 2148 B13R1.4453 CCO[C@H](C)c1c(cccc1Cl)F 7a_200012136785_100000210202 [0,1,0,0,0,0|2,0,1]=4 2149 B13R1.4453 CNCC(=O)c1c(cccc1Cl)Cl 2230a_106832991635_100012340516 [0,1,0,0,0,0|3,0,0]=4 2150 B13R1.4453 CNCC(=O)c1c(cccc1Cl)Cl 34a_100102657272_100012340516 [0,1,0,0,0,0|3,0,0]=4 2151 B13R1.4453 CNCC(=O)c1c(cccc1Cl)F 2230a_106832991635_100011219195 [0,1,0,0,0,0|3,0,0]=4 2152 B13R1.4453 CNCC(=O)c1c(cccc1Cl)F 34a_100102657272_100011219195 [0,1,0,0,0,0|3,0,0]=4 2153 B13R1.4453 CNCC(=O)c1c(cccc1F)F 34a_100102657272_100000199083 [0,1,0,0,0,0|3,0,0]=4 2154 B13R1.4453 CNNC(=O)c1c(cccc1Br)Br 22a_100016993582_100000690891 [0,1,0,0,0,0|3,0,0]=4 2155 B13R1.4453 CNNC(=O)c1c(cccc1Br)C 22a_100016993582_100000701904 [0,1,0,0,0,0|3,0,0]=4 2156 B13R1.4453 CNNC(=O)c1c(cccc1Br)Cl 22a_100016993582_100011253703 [0,1,0,0,0,0|3,0,0]=4 2157 B13R1.4453 CNNC(=O)c1c(cccc1Br)F 22a_100016993582_100000752694 [0,1,0,0,0,0|3,0,0]=4 2158 B13R1.4453 CNNC(=O)c1c(cccc1Br)O 22a_100016993582_100011935254 [0,1,0,0,0,0|2,0,0]=3 2159 B13R1.4453 CNNC(=O)c1c(cccc1C)C 22a_100016993582_100000758298 [0,1,0,0,0,0|3,0,0]=4 2160 B13R1.4453 CNNC(=O)c1c(cccc1Cl)C 22a_100016993582_100000692601 [0,1,0,0,0,0|3,0,0]=4 2161 B13R1.4453 CNNC(=O)c1c(cccc1Cl)Cl 22a_100016993582_100000210656 [0,1,0,0,0,0|3,0,0]=4 2162 B13R1.4453 CNNC(=O)c1c(cccc1Cl)F 22a_100016993582_100000210369 [0,1,0,0,0,0|3,0,0]=4 2163 B13R1.4453 CNNC(=O)c1c(cccc1Cl)O 22a_100016993582_100000745519 [0,1,0,0,0,0|2,0,0]=3 2164 B13R1.4453 CNNC(=O)c1c(cccc1F)C 22a_100016993582_100000762013 [0,1,0,0,0,0|3,0,0]=4 2165 B13R1.4453 CNNC(=O)c1c(cccc1F)F 22a_100016993582_100000210804 [0,1,0,0,0,0|3,0,0]=4 2166 B13R1.4453 CNNC(=O)c1c(cccc1F)O 22a_100016993582_100000763259 [0,1,0,0,0,0|2,0,0]=3 2167 B13R1.4453 CNNC(=O)c1c(cccc1I)Br 22a_100016993582_100010232521 [0,1,0,0,0,0|3,0,0]=4 2168 B13R1.4453 CNNC(=O)c1c(cccc1I)C 22a_100016993582_100000688020 [0,1,0,0,0,0|3,0,0]=4 2169 B13R1.4453 CNNC(=O)c1c(cccc1I)Cl 22a_100016993582_100000702859 [0,1,0,0,0,0|3,0,0]=4 2170 B13R1.4453 CNNC(=O)c1c(cccc1I)F 22a_100016993582_100000023732 [0,1,0,0,0,0|3,0,0]=4 2171 B13R1.4453 CNNC(=O)c1c(cccc1O)C 22a_100016993582_100011934116 [0,1,0,0,0,0|2,0,0]=3 2172 B13R1.4453 COCC(=O)c1c(cccc1Cl)Cl 34a_100138415774_100012340516 [0,1,0,0,0,0|3,0,0]=4 2173 B13R1.4453 COCC(=O)c1c(cccc1Cl)F 34a_100138415774_100011219195 [0,1,0,0,0,0|3,0,0]=4 2174 B13R1.4453 COCC(=O)c1c(cccc1F)F 34a_100138415774_100000199083 [0,1,0,0,0,0|3,0,0]=4 2175 B13R1.4453 CSCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_200000210301 [0,1,0,0,0,0|3,0,0]=4 2176 B13R1.4453 CSCC(=O)c1c(cccc1Cl)F 62a_100011219195_200000210301 [0,1,0,0,0,0|3,0,0]=4 2177 B13R1.4453 CSCC(=O)c1c(cccc1Cl)F 62a_200000210301_100011219195 [0,1,0,0,0,0|3,0,0]=4 2178 B13R1.4453 CSCC(=O)c1c(cccc1F)F 62a_100000199083_200000210301 [0,1,0,0,0,0|3,0,0]=4 2179 B13R1.4453 CSCC(=O)c1c(cccc1F)F 62a_200000210301_100000199083 [0,1,0,0,0,0|3,0,0]=4 2180 B13R1.4453 Cc1cccc(c1C(=O)CC#N)O 1458a_100011934116_100011214920 [0,1,0,0,0,0|2,0,1]=4 2181 B13R1.4453 Cc1cccc(c1C(=O)CCF)Br 1458a_100000701904_100011217306 [0,1,0,0,0,0|3,0,0]=4 2182 B13R1.4453 Cc1cccc(c1C(=O)CCF)C 1458a_100000758298_100011217306 [0,1,0,0,0,0|3,0,0]=4 2183 B13R1.4453 Cc1cccc(c1C(=O)CCF)Cl 1458a_100000692601_100011217306 [0,1,0,0,0,0|3,0,0]=4 2184 B13R1.4453 Cc1cccc(c1C(=O)CCF)F 1458a_100000762013_100011217306 [0,1,0,0,0,0|3,0,0]=4 2185 B13R1.4453 Cc1cccc(c1C(=O)CCF)I 1458a_100000688020_100011217306 [0,1,0,0,0,0|3,0,0]=4 2186 B13R1.4453 Cc1cccc(c1C(=O)CCF)O 1458a_100011934116_100011217306 [0,1,0,0,0,0|2,0,0]=3 2187 B13R1.4453 Cc1cccc(c1C(=O)CCO)Br 1458a_100000701904_100000211926 [0,1,0,0,0,0|3,0,0]=4 2188 B13R1.4453 Cc1cccc(c1C(=O)CCO)C 1458a_100000758298_100000211926 [0,1,0,0,0,0|3,0,0]=4 2189 B13R1.4453 Cc1cccc(c1C(=O)CCO)Cl 1458a_100000692601_100000211926 [0,1,0,0,0,0|3,0,0]=4 2190 B13R1.4453 Cc1cccc(c1C(=O)CCO)F 1458a_100000762013_100000211926 [0,1,0,0,0,0|3,0,0]=4 2191 B13R1.4453 Cc1cccc(c1C(=O)CCO)I 1458a_100000688020_100000211926 [0,1,0,0,0,0|3,0,0]=4 2192 B13R1.4453 Cc1cccc(c1C(=O)CCO)O 1458a_100011934116_100000211926 [0,1,0,0,0,0|2,0,0]=3 2193 B13R1.4453 N#CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011214920 [0,1,0,0,0,0|2,0,1]=4 2194 B13R1.4453 N#CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011214920 [0,1,0,0,0,0|2,0,1]=4 2195 B13R1.4453 N#CCC(=O)c1c(cccc1F)O 1458a_100000763259_100011214920 [0,1,0,0,0,0|2,0,1]=4 2196 B13R1.4453 N#CCC(=O)c1c(cccc1O)O 1458a_100000755285_100011214920 [0,1,0,0,0,0|2,0,1]=4 2197 B13R1.4453 O=C(CCF)c1c(cccc1Br)Br 1458a_100000690891_100011217306 [0,1,0,0,0,0|3,0,0]=4 2198 B13R1.4453 O=C(CCF)c1c(cccc1Br)Cl 1458a_100011253703_100011217306 [0,1,0,0,0,0|3,0,0]=4 2199 B13R1.4453 O=C(CCF)c1c(cccc1Br)F 1458a_100000752694_100011217306 [0,1,0,0,0,0|3,0,0]=4 2200 B13R1.4453 O=C(CCF)c1c(cccc1Br)O 1458a_100011935254_100011217306 [0,1,0,0,0,0|2,0,0]=3 2201 B13R1.4453 O=C(CCF)c1c(cccc1Cl)Cl 1458a_100000210656_100011217306 [0,1,0,0,0,0|3,0,0]=4 2202 B13R1.4453 O=C(CCF)c1c(cccc1Cl)F 1458a_100000210369_100011217306 [0,1,0,0,0,0|3,0,0]=4 2203 B13R1.4453 O=C(CCF)c1c(cccc1Cl)O 1458a_100000745519_100011217306 [0,1,0,0,0,0|2,0,0]=3 2204 B13R1.4453 O=C(CCF)c1c(cccc1F)F 1458a_100000210804_100011217306 [0,1,0,0,0,0|3,0,0]=4 2205 B13R1.4453 O=C(CCF)c1c(cccc1F)O 1458a_100000763259_100011217306 [0,1,0,0,0,0|2,0,0]=3 2206 B13R1.4453 O=C(CCF)c1c(cccc1I)Br 1458a_100010232521_100011217306 [0,1,0,0,0,0|3,0,0]=4 2207 B13R1.4453 O=C(CCF)c1c(cccc1I)Cl 1458a_100000702859_100011217306 [0,1,0,0,0,0|3,0,0]=4 2208 B13R1.4453 O=C(CCF)c1c(cccc1I)F 1458a_100000023732_100011217306 [0,1,0,0,0,0|3,0,0]=4 2209 B13R1.4453 O=C(CCF)c1c(cccc1O)O 1458a_100000755285_100011217306 [0,1,0,0,0,0|2,0,0]=3 2210 B13R1.4453 O=C(CCO)c1c(cccc1Br)Br 1458a_100000690891_100000211926 [0,1,0,0,0,0|3,0,0]=4 2211 B13R1.4453 O=C(CCO)c1c(cccc1Br)Cl 1458a_100011253703_100000211926 [0,1,0,0,0,0|3,0,0]=4 2212 B13R1.4453 O=C(CCO)c1c(cccc1Br)F 1458a_100000752694_100000211926 [0,1,0,0,0,0|3,0,0]=4 2213 B13R1.4453 O=C(CCO)c1c(cccc1Br)O 1458a_100011935254_100000211926 [0,1,0,0,0,0|2,0,0]=3 2214 B13R1.4453 O=C(CCO)c1c(cccc1Cl)Cl 1458a_100000210656_100000211926 [0,1,0,0,0,0|3,0,0]=4 2215 B13R1.4453 O=C(CCO)c1c(cccc1Cl)F 1458a_100000210369_100000211926 [0,1,0,0,0,0|3,0,0]=4 2216 B13R1.4453 O=C(CCO)c1c(cccc1Cl)O 1458a_100000745519_100000211926 [0,1,0,0,0,0|2,0,0]=3 2217 B13R1.4453 O=C(CCO)c1c(cccc1F)F 1458a_100000210804_100000211926 [0,1,0,0,0,0|3,0,0]=4 2218 B13R1.4453 O=C(CCO)c1c(cccc1F)O 1458a_100000763259_100000211926 [0,1,0,0,0,0|2,0,0]=3 2219 B13R1.4453 O=C(CCO)c1c(cccc1I)Br 1458a_100010232521_100000211926 [0,1,0,0,0,0|3,0,0]=4 2220 B13R1.4453 O=C(CCO)c1c(cccc1I)Cl 1458a_100000702859_100000211926 [0,1,0,0,0,0|3,0,0]=4 2221 B13R1.4453 O=C(CCO)c1c(cccc1I)F 1458a_100000023732_100000211926 [0,1,0,0,0,0|3,0,0]=4 2222 B13R1.4453 O=C(CCO)c1c(cccc1O)O 1458a_100000755285_100000211926 [0,1,0,0,0,0|2,0,0]=3 2223 B13R1.4453 [13CH3]SCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_200025704644 [0,1,0,0,0,0|3,0,0]=4 2224 B13R1.4453 [13CH3]SCC(=O)c1c(cccc1Cl)F 62a_100011219195_200025704644 [0,1,0,0,0,0|3,0,0]=4 2225 B13R1.4453 [13CH3]SCC(=O)c1c(cccc1Cl)F 62a_200025704644_100011219195 [0,1,0,0,0,0|3,0,0]=4 2226 B13R1.4453 [13CH3]SCC(=O)c1c(cccc1F)F 62a_100000199083_200025704644 [0,1,0,0,0,0|3,0,0]=4 2227 B13R1.4453 [13CH3]SCC(=O)c1c(cccc1F)F 62a_200025704644_100000199083 [0,1,0,0,0,0|3,0,0]=4 2228 B11R0.5 C=CC=CC(=O)CC(=O)CCC 1458a_100016291481_100000747444 [0,0,1,0,0,0|1,0,2]=4 2229 B11R0.5 C=CC=CC(=O)CC(=O)NCC 1458a_100016291481_100000183381 [0,0,1,0,0,0|1,0,2]=4 2230 B11R0.5 C=CC=CC(=O)CC(=O)OCC 1458a_100016291481_100000188475 [0,0,1,0,0,0|0,0,2]=3 2231 B13R2.1 CC=Cc1coc2c1cccc2 271570a_100016259895_100009812202 [0,0,0,1,0,0|2,0,1]=4 2232 B13R2.1 CCNC1COc2c1cccc2 2230a_100000747519_100000210202 [0,0,0,1,0,0|2,0,1]=4 2233 B13R2.1 CCOC1CCc2c1cccc2 34a_100000212247_100000210202 [0,0,0,1,0,0|2,0,1]=4 2234 B13R2.1 CCOC1CCc2c1cccc2 7a_100000212247_100000210202 [0,0,0,1,0,0|2,0,1]=4 2235 B13R2.1 CCOc1csc2c1cccc2 34a_100000077758_100000210202 [0,0,0,1,0,0|1,1,0]=3 2236 B13R2.1 CCOc1csc2c1cccc2 7a_100000077758_100000210202 [0,0,0,1,0,0|1,1,0]=3 2237 B13R2.1 CCSc1coc2c1cccc2 62a_100000210202_100009812202 [0,0,0,1,0,0|1,1,0]=3 2238 B13R2.1 CCSc1coc2c1nccc2 62a_100000210202_100009889148 [0,0,0,1,0,0|2,1,0]=4 2239 B13R2.1 CCSc1csc2c1cccc2 62a_100000210202_100009813928 [0,0,0,1,0,0|1,2,0]=4 2240 B13R2.1 CCSc1n[nH]c2c1cccc2 62a_100000210202_100000050141 [0,0,0,1,0,0|2,1,0]=4 2241 B13R2.1 CCSc1noc2c1cccc2 62a_100000210202_200000703156 [0,0,0,1,0,0|1,1,0]=3 2242 B13R2.1 CCSc1noc2c1cccc2 62a_200000703156_100000210202 [0,0,0,1,0,0|1,1,0]=3 2243 B13R2.1 CNCc1coc2c1cccc2 207a_100102657272_100000688544 [0,0,0,1,0,0|3,0,0]=4 2244 B13R2.1 CNCc1coc2c1cccc2 270004a_106832991635_100000688544 [0,0,0,1,0,0|3,0,0]=4 2245 B13R2.1 CNCc1noc2c1cccc2 34a_100102657272_100009813815 [0,0,0,1,0,0|3,0,0]=4 2246 B13R2.1 CNCc1noc2c1cccc2 7a_106832991635_100009813815 [0,0,0,1,0,0|3,0,0]=4 2247 B13R2.1 COCc1noc2c1cccc2 34a_100138415774_100009813815 [0,0,0,1,0,0|3,0,0]=4 2248 B13R2.1 CSCc1noc2c1cccc2 62a_100009813815_200000210301 [0,0,0,1,0,0|3,0,0]=4 2249 B13R2.1 CSCc1noc2c1cccc2 62a_200000210301_100009813815 [0,0,0,1,0,0|3,0,0]=4 2250 B13R2.1 FCOc1csc2c1cccc2 34a_100000077758_100015361967 [0,0,0,1,0,0|2,1,0]=4 2251 B13R2.1 FCOc1csc2c1cccc2 7a_100000077758_100015361967 [0,0,0,1,0,0|2,1,0]=4 2252 B13R2.1 FCSc1coc2c1cccc2 62a_100015361967_100009812202 [0,0,0,1,0,0|2,1,0]=4 2253 B13R2.1 FCSc1noc2c1cccc2 62a_100015361967_200000703156 [0,0,0,1,0,0|2,1,0]=4 2254 B13R2.1 FCSc1noc2c1cccc2 62a_200000703156_100015361967 [0,0,0,1,0,0|2,1,0]=4 2255 B13R2.1 [13CH3]SCc1noc2c1cccc2 62a_100009813815_200025704644 [0,0,0,1,0,0|3,0,0]=4 2256 B13R2.1 [13CH3]SCc1noc2c1cccc2 62a_200025704644_100009813815 [0,0,0,1,0,0|3,0,0]=4 2257 B13R2.18 Brc1ccccc1C2=CCCC2 271570a_100000089523_100000695589 [0,0,0,1,0,0|3,0,0]=4 2258 B13R2.18 Cc1ccccc1C2=CCCC2 271570a_100000089523_100000210755 [0,0,0,1,0,0|3,0,0]=4 2259 B13R2.18 Clc1ccccc1C2=CCCC2 271570a_100000089523_100000764095 [0,0,0,1,0,0|3,0,0]=4 2260 B13R2.18 Fc1ccccc1C2=CCCC2 271570a_100000089523_100011215700 [0,0,0,1,0,0|3,0,0]=4 2261 B13R2.18 Nc1ccccc1C2=CCCC2 271570a_100000089523_100000210017 [0,0,0,1,0,0|3,0,0]=4 2262 B13R2.18 Oc1ccccc1C2=CCCC2 271570a_100000089523_100000739446 [0,0,0,1,0,0|2,0,0]=3 2263 B13R2.18 Oc1ccccc1C2=CCOC2 271570a_100009872500_100000739446 [0,0,0,1,0,0|3,0,0]=4 2264 B13R2.18 Oc1ccccc1C2=COCC2 271570a_100000118173_100000739446 [0,0,0,1,0,0|3,0,0]=4 2265 B13R2.18 Oc1ccccc1C2CCCN2 271570a_203496583355_100000686366 [0,0,0,1,0,0|2,0,1]=4 2266 B13R2.18 Oc1ccccc1C2OCCO2 271570a_203496583355_100009814316 [0,0,0,1,0,0|0,0,2]=3 2267 B13R2.18 Oc1ccccc1N2CCCC2 271570a_203496583355_100011821364 [0,0,0,1,0,0|3,0,0]=4 2268 B13R2.18 Oc1ccccc1c2ccco2 271570a_100000035170_100009814098 [0,0,0,1,0,0|1,0,2]=4 2269 B13R2.18 Oc1ccccc1c2ccco2 271570a_100000750936_100000739446 [0,0,0,1,0,0|1,0,2]=4 2270 B13R2.18 Oc1ccccc1c2ccno2 271570a_203496583355_100011218344 [0,0,0,1,0,0|2,0,1]=4 2271 B13R2.18 Oc1ccccc1c2cnco2 271570a_100000035170_100020591547 [0,0,0,1,0,0|2,0,1]=4 2272 B13R2.18 Oc1ccccc1c2cnco2 271570a_203496583355_100009816723 [0,0,0,1,0,0|2,0,1]=4 2273 B13R2.18 Oc1ccccc1c2ncco2 271570a_100000035170_100011787736 [0,0,0,1,0,0|1,0,2]=4 2274 B13R2.18 Oc1ccccc1c2ncco2 271570a_203496583355_100010188011 [0,0,0,1,0,0|1,0,2]=4 2275 B13R2.18 Oc1ccccc1c2nnco2 271570a_203496583355_100000179026 [0,0,0,1,0,0|2,0,1]=4 2276 B13R2.18 Oc1cccnc1C2=CCCC2 271570a_100000089523_100000034122 [0,0,0,1,0,0|3,0,0]=4 2277 B13R2.18 Oc1cnccc1C2=CCCC2 271570a_100000089523_100009817591 [0,0,0,1,0,0|3,0,0]=4 2278 B13R2.45 CSC1Cc2ccccc2C1=O 62a_100011218503_200000210301 [0,0,0,1,0,0|3,0,0]=4 2279 B13R2.45 CSC1Cc2ccccc2C1=O 62a_200000210301_100011218503 [0,0,0,1,0,0|3,0,0]=4 2280 B13R2.45 [13CH3]SC1Cc2ccccc2C1=O 62a_100011218503_200025704644 [0,0,0,1,0,0|3,0,0]=4 2281 B13R2.45 [13CH3]SC1Cc2ccccc2C1=O 62a_200025704644_100011218503 [0,0,0,1,0,0|3,0,0]=4 2282 B13R2.3097 C=C(c1ccccc1Br)C2CC2 271570a_100010895485_100000695589 [0,0,0,1,0,0|3,0,0]=4 2283 B13R2.3097 C=C(c1ccccc1C)C2CC2 271570a_100010895485_100000210755 [0,0,0,1,0,0|3,0,0]=4 2284 B13R2.3097 C=C(c1ccccc1Cl)C2CC2 271570a_100010895485_100000764095 [0,0,0,1,0,0|3,0,0]=4 2285 B13R2.3097 C=C(c1ccccc1F)C2CC2 271570a_100010895485_100011215700 [0,0,0,1,0,0|3,0,0]=4 2286 B13R2.3097 C=C(c1ccccc1N)C2CC2 271570a_100010895485_100000210017 [0,0,0,1,0,0|3,0,0]=4 2287 B13R2.3097 C=C(c1ccccc1O)C2CC2 271570a_100010895485_100000739446 [0,0,0,1,0,0|2,0,0]=3 2288 B13R2.3097 C=C(c1ccncc1O)C2CC2 271570a_100010895485_100009817591 [0,0,0,1,0,0|3,0,0]=4 2289 B13R2.3097 C=C(c1ncccc1O)C2CC2 271570a_100010895485_100000034122 [0,0,0,1,0,0|3,0,0]=4 2290 B13R2.3097 CN(c1ccccc1O)C2CC2 269982a_100000033821_100000211595 [0,0,0,1,0,0|3,0,0]=4 2291 B13R2.4818 O=C1CCCc2c1c(ccc2)O 271570a_203496583355_100009816782 [0,0,0,1,0,0|1,0,0]=2 2292 B13R2.4818 O=C1CCOc2c1c(ccc2)O 271570a_203496583355_100010205896 [0,0,0,1,0,0|2,0,0]=3 2293 B13R2.4818 O=c1[nH]cnc2c1c(ccc2)O 271570a_203496583355_100000696754 [0,0,0,1,0,0|2,0,1]=4 2294 B13R2.4857 Cn1nc(c2c1cccc2O)N 271570a_203496583355_100010211377 [0,0,0,1,0,0|3,0,0]=4 2295 B13R2.4857 O=C1NC(=O)c2c1cccc2O 271570a_203496583355_100010194295 [0,0,0,1,0,0|2,0,1]=4 2296 B13R2.4857 O=C1OC(=O)c2c1cccc2O 271570a_203496583355_100010195870 [0,0,0,1,0,0|1,0,1]=3 2297 B11R1.199 CCOC(=O)c1[nH]ncc1O 271570a_203496583355_100102524952 [0,0,0,0,1,0|2,0,0]=3 2298 B11R1.199 CCOC(=O)c1c[nH]nc1O 271570a_203496583355_100010255357 [0,0,0,0,1,0|2,0,0]=3 2299 B11R1.199 CCOC(=O)c1ccsc1O 271570a_203496583355_100010219215 [0,0,0,0,1,0|1,0,0]=2 2300 B11R1.199 CCOC(=O)c1cscc1O 271570a_203496583355_100012353568 [0,0,0,0,1,0|1,0,0]=2 2301 B11R1.199 CCOC(=O)c1ncsc1O 271570a_203496583355_100010232029 [0,0,0,0,1,0|2,0,0]=3 2302 B11R1.199 CCOC(=O)c1ocnc1O 271570a_203496583355_100010260153 [0,0,0,0,1,0|2,0,0]=3 2303 B11R1.199 CCOC(=O)c1scnc1O 271570a_203496583355_100012038550 [0,0,0,0,1,0|2,0,0]=3 2304 B13R1.470 C#CCC(=O)Cc1ccccc1O 1458a_100000743006_100000184674 [0,0,0,0,0,1|1,0,2]=4 2305 B13R1.470 C#CCC(=O)Nc1ccccc1O 527a_100000185747_100011220946 [0,0,0,0,0,1|1,0,2]=4 2306 B13R1.470 C=CCC(=O)Cc1ccccc1O 1458a_100000743006_100000210623 [0,0,0,0,0,1|1,0,2]=4 2307 B13R1.470 C=CCC(=O)Nc1ccccc1O 22a_100000185747_100000210193 [0,0,0,0,0,1|1,0,2]=4 2308 B13R1.470 C=CCC(=O)Nc1ccccc1O 527a_100000185747_100000210193 [0,0,0,0,0,1|1,0,2]=4 2309 B13R1.470 CC#CC(=O)Cc1ccccc1Br 1458a_100000763181_100000184730 [0,0,0,0,0,1|2,0,1]=4 2310 B13R1.470 CC#CC(=O)Cc1ccccc1C 1458a_100000763181_100000211839 [0,0,0,0,0,1|2,0,1]=4 2311 B13R1.470 CC#CC(=O)Cc1ccccc1Cl 1458a_100000763181_100000187162 [0,0,0,0,0,1|2,0,1]=4 2312 B13R1.470 CC#CC(=O)Cc1ccccc1F 1458a_100000763181_100000187165 [0,0,0,0,0,1|2,0,1]=4 2313 B13R1.470 CC#CC(=O)Cc1ccccc1I 1458a_100000763181_100011216222 [0,0,0,0,0,1|2,0,1]=4 2314 B13R1.470 CC#CC(=O)Cc1ncccc1O 1458a_100000763181_200020655725 [0,0,0,0,0,1|2,0,1]=4 2315 B13R1.470 CC#CC(=O)Nc1ccccc1C 22a_100015192222_100000763181 [0,0,0,0,0,1|2,0,1]=4 2316 B13R1.470 CC#CC(=O)Nc1ccccc1Cl 22a_100000185783_100000763181 [0,0,0,0,0,1|2,0,1]=4 2317 B13R1.470 CC#CC(=O)Nc1ccccc1F 22a_100000210422_100000763181 [0,0,0,0,0,1|2,0,1]=4 2318 B13R1.470 CC#CC(=O)Nc1ccccc1O 22a_100000185747_100000763181 [0,0,0,0,0,1|1,0,1]=3 2319 B13R1.470 CC=CC(=O)Cc1ccccc1Br 1458a_100000210699_100000184730 [0,0,0,0,0,1|2,0,1]=4 2320 B13R1.470 CC=CC(=O)Cc1ccccc1C 1458a_100000210699_100000211839 [0,0,0,0,0,1|2,0,1]=4 2321 B13R1.470 CC=CC(=O)Cc1ccccc1Cl 1458a_100000210699_100000187162 [0,0,0,0,0,1|2,0,1]=4 2322 B13R1.470 CC=CC(=O)Cc1ccccc1F 1458a_100000210699_100000187165 [0,0,0,0,0,1|2,0,1]=4 2323 B13R1.470 CC=CC(=O)Cc1ccccc1I 1458a_100000210699_100011216222 [0,0,0,0,0,1|2,0,1]=4 2324 B13R1.470 CC=CC(=O)Cc1ncccc1O 1458a_100000210699_200020655725 [0,0,0,0,0,1|2,0,1]=4 2325 B13R1.470 CC=CC(=O)Nc1ccccc1Br 11a_100000210017_100000210699 [0,0,0,0,0,1|2,0,1]=4 2326 B13R1.470 CC=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000210699 [0,0,0,0,0,1|2,0,1]=4 2327 B13R1.470 CC=CC(=O)Nc1ccccc1C 11a_100015192222_100000210699 [0,0,0,0,0,1|2,0,1]=4 2328 B13R1.470 CC=CC(=O)Nc1ccccc1C 1626a_100015192222_100000210699 [0,0,0,0,0,1|2,0,1]=4 2329 B13R1.470 CC=CC(=O)Nc1ccccc1C 22a_100015192222_100000210699 [0,0,0,0,0,1|2,0,1]=4 2330 B13R1.470 CC=CC(=O)Nc1ccccc1Cl 11a_100000185783_100000210699 [0,0,0,0,0,1|2,0,1]=4 2331 B13R1.470 CC=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210699 [0,0,0,0,0,1|2,0,1]=4 2332 B13R1.470 CC=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000210699 [0,0,0,0,0,1|2,0,1]=4 2333 B13R1.470 CC=CC(=O)Nc1ccccc1F 11a_100000210422_100000210699 [0,0,0,0,0,1|2,0,1]=4 2334 B13R1.470 CC=CC(=O)Nc1ccccc1F 1626a_100000210422_100000210699 [0,0,0,0,0,1|2,0,1]=4 2335 B13R1.470 CC=CC(=O)Nc1ccccc1F 22a_100000210422_100000210699 [0,0,0,0,0,1|2,0,1]=4 2336 B13R1.470 CC=CC(=O)Nc1ccccc1I 11a_100000210053_100000210699 [0,0,0,0,0,1|2,0,1]=4 2337 B13R1.470 CC=CC(=O)Nc1ccccc1I 1626a_100000210053_100000210699 [0,0,0,0,0,1|2,0,1]=4 2338 B13R1.470 CC=CC(=O)Nc1ccccc1O 22a_100000185747_100000210699 [0,0,0,0,0,1|1,0,1]=3 2339 B13R1.470 CCCC(=O)Cc1ccccc1Br 1458a_100000211992_100000184730 [0,0,0,0,0,1|2,0,0]=3 2340 B13R1.470 CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210303 [0,0,0,0,0,1|2,0,0]=3 2341 B13R1.470 CCCC(=O)Cc1ccccc1C 1458a_100000211992_100000211839 [0,0,0,0,0,1|2,0,0]=3 2342 B13R1.470 CCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210303 [0,0,0,0,0,1|2,0,0]=3 2343 B13R1.470 CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210303 [0,0,0,0,0,1|2,0,0]=3 2344 B13R1.470 CCCC(=O)Cc1ccccc1Cl 1458a_100000211992_100000187162 [0,0,0,0,0,1|2,0,0]=3 2345 B13R1.470 CCCC(=O)Cc1ccccc1F 1458a_100000211992_100000187165 [0,0,0,0,0,1|2,0,0]=3 2346 B13R1.470 CCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210303 [0,0,0,0,0,1|2,0,0]=3 2347 B13R1.470 CCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210303 [0,0,0,0,0,1|2,0,0]=3 2348 B13R1.470 CCCC(=O)Cc1ccccc1I 1458a_100000211992_100011216222 [0,0,0,0,0,1|2,0,0]=3 2349 B13R1.470 CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210303 [0,0,0,0,0,1|1,0,0]=2 2350 B13R1.470 CCCC(=O)Cc1cccnc1Br 1458a_100000211992_100010140945 [0,0,0,0,0,1|3,0,0]=4 2351 B13R1.470 CCCC(=O)Cc1cccnc1C 1458a_100000211992_100000732876 [0,0,0,0,0,1|3,0,0]=4 2352 B13R1.470 CCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210303 [0,0,0,0,0,1|3,0,0]=4 2353 B13R1.470 CCCC(=O)Cc1cccnc1Cl 1458a_100000211992_100000045678 [0,0,0,0,0,1|3,0,0]=4 2354 B13R1.470 CCCC(=O)Cc1cccnc1F 1458a_100000211992_100000099810 [0,0,0,0,0,1|3,0,0]=4 2355 B13R1.470 CCCC(=O)Cc1ccncc1C 1458a_100000211992_100020672808 [0,0,0,0,0,1|3,0,0]=4 2356 B13R1.470 CCCC(=O)Cc1ccncc1Cl 1458a_100000211992_100000763264 [0,0,0,0,0,1|3,0,0]=4 2357 B13R1.470 CCCC(=O)Cc1cnccc1C 1458a_100000211992_100000690890 [0,0,0,0,0,1|3,0,0]=4 2358 B13R1.470 CCCC(=O)Cc1ncccc1Br 1458a_100000211992_100025702911 [0,0,0,0,0,1|3,0,0]=4 2359 B13R1.470 CCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210303 [0,0,0,0,0,1|3,0,0]=4 2360 B13R1.470 CCCC(=O)Cc1ncccc1C 1458a_100000211992_100000696600 [0,0,0,0,0,1|3,0,0]=4 2361 B13R1.470 CCCC(=O)Cc1ncccc1C 1458a_200000722269_100000210303 [0,0,0,0,0,1|3,0,0]=4 2362 B13R1.470 CCCC(=O)Cc1ncccc1Cl 1458a_100000211992_100000099807 [0,0,0,0,0,1|3,0,0]=4 2363 B13R1.470 CCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210303 [0,0,0,0,0,1|3,0,0]=4 2364 B13R1.470 CCCC(=O)Cc1ncccc1F 1458a_100000211992_100000104219 [0,0,0,0,0,1|3,0,0]=4 2365 B13R1.470 CCCC(=O)Cc1ncccc1O 1458a_100000211992_200020655725 [0,0,0,0,0,1|2,0,0]=3 2366 B13R1.470 CCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210303 [0,0,0,0,0,1|2,0,1]=4 2367 B13R1.470 CCCC(=O)Nc1ccccc1Br 11a_100000210017_100000211992 [0,0,0,0,0,1|2,0,0]=3 2368 B13R1.470 CCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000211992 [0,0,0,0,0,1|2,0,0]=3 2369 B13R1.470 CCCC(=O)Nc1ccccc1C 11a_100015192222_100000211992 [0,0,0,0,0,1|2,0,0]=3 2370 B13R1.470 CCCC(=O)Nc1ccccc1C 1626a_100015192222_100000211992 [0,0,0,0,0,1|2,0,0]=3 2371 B13R1.470 CCCC(=O)Nc1ccccc1C 22a_100015192222_100000211992 [0,0,0,0,0,1|2,0,0]=3 2372 B13R1.470 CCCC(=O)Nc1ccccc1C 527a_100015192222_100000211992 [0,0,0,0,0,1|2,0,0]=3 2373 B13R1.470 CCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000211992 [0,0,0,0,0,1|2,0,0]=3 2374 B13R1.470 CCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000211992 [0,0,0,0,0,1|2,0,0]=3 2375 B13R1.470 CCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000211992 [0,0,0,0,0,1|2,0,0]=3 2376 B13R1.470 CCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000211992 [0,0,0,0,0,1|2,0,0]=3 2377 B13R1.470 CCCC(=O)Nc1ccccc1F 11a_100000210422_100000211992 [0,0,0,0,0,1|2,0,0]=3 2378 B13R1.470 CCCC(=O)Nc1ccccc1F 1626a_100000210422_100000211992 [0,0,0,0,0,1|2,0,0]=3 2379 B13R1.470 CCCC(=O)Nc1ccccc1F 22a_100000210422_100000211992 [0,0,0,0,0,1|2,0,0]=3 2380 B13R1.470 CCCC(=O)Nc1ccccc1F 527a_100000210422_100000211992 [0,0,0,0,0,1|2,0,0]=3 2381 B13R1.470 CCCC(=O)Nc1ccccc1I 11a_100000210053_100000211992 [0,0,0,0,0,1|2,0,0]=3 2382 B13R1.470 CCCC(=O)Nc1ccccc1I 1626a_100000210053_100000211992 [0,0,0,0,0,1|2,0,0]=3 2383 B13R1.470 CCCC(=O)Nc1ccccc1O 22a_100000185747_100000211992 [0,0,0,0,0,1|1,0,0]=2 2384 B13R1.470 CCCC(=O)Nc1ccccc1O 271570a_203496583355_100000153530 [0,0,0,0,0,1|1,0,0]=2 2385 B13R1.470 CCCC(=O)Nc1ccccc1O 527a_100000185747_100000211992 [0,0,0,0,0,1|1,0,0]=2 2386 B13R1.470 CCCC(C)Nc1ccccc1O 34a_100000185747_100000766640 [0,0,0,0,0,1|2,0,1]=4 2387 B13R1.470 CCCC(C)Sc1ccccc1O 62a_100000739446_100000766640 [0,0,0,0,0,1|2,0,1]=4 2388 B13R1.470 CCCC(C)Sc1ccccc1O 62a_100000766640_100000739446 [0,0,0,0,0,1|2,0,1]=4 2389 B13R1.470 CCCN(C)Cc1ccccc1O 2230a_100000749093_200000210301 [0,0,0,0,0,1|3,0,0]=4 2390 B13R1.470 CCCN(C)Cc1ccccc1O 2230a_100015189988_100000210303 [0,0,0,0,0,1|3,0,0]=4 2391 B13R1.470 CCCN(C)Cc1ccccc1O 269982a_100000749093_200000210301 [0,0,0,0,0,1|3,0,0]=4 2392 B13R1.470 CCCN(C)Cc1ccccc1O 269982a_100015189988_100000210303 [0,0,0,0,0,1|3,0,0]=4 2393 B13R1.470 CCCN([13CH3])Cc1ccccc1O 2230a_100000749093_200025704644 [0,0,0,0,0,1|3,0,0]=4 2394 B13R1.470 CCCN([13CH3])Cc1ccccc1O 269982a_100000749093_200025704644 [0,0,0,0,0,1|3,0,0]=4 2395 B13R1.470 CCNC(=O)Cc1ccccc1Br 11a_100015525214_100000751119 [0,0,0,0,0,1|2,0,0]=3 2396 B13R1.470 CCNC(=O)Cc1ccccc1Br 240690a_100015525214_100000751119 [0,0,0,0,0,1|2,0,0]=3 2397 B13R1.470 CCNC(=O)Cc1ccccc1Br 527a_100015525214_100000751119 [0,0,0,0,0,1|2,0,0]=3 2398 B13R1.470 CCNC(=O)Cc1ccccc1C 11a_100015525214_100000212180 [0,0,0,0,0,1|2,0,0]=3 2399 B13R1.470 CCNC(=O)Cc1ccccc1C 240690a_100015525214_100000212180 [0,0,0,0,0,1|2,0,0]=3 2400 B13R1.470 CCNC(=O)Cc1ccccc1C 527a_100015525214_100000212180 [0,0,0,0,0,1|2,0,0]=3 2401 B13R1.470 CCNC(=O)Cc1ccccc1Cl 11a_100015525214_100000183793 [0,0,0,0,0,1|2,0,0]=3 2402 B13R1.470 CCNC(=O)Cc1ccccc1Cl 240690a_100015525214_100000183793 [0,0,0,0,0,1|2,0,0]=3 2403 B13R1.470 CCNC(=O)Cc1ccccc1Cl 527a_100015525214_100000183793 [0,0,0,0,0,1|2,0,0]=3 2404 B13R1.470 CCNC(=O)Cc1ccccc1F 11a_100015525214_100000212012 [0,0,0,0,0,1|2,0,0]=3 2405 B13R1.470 CCNC(=O)Cc1ccccc1F 240690a_100015525214_100000212012 [0,0,0,0,0,1|2,0,0]=3 2406 B13R1.470 CCNC(=O)Cc1ccccc1F 527a_100015525214_100000212012 [0,0,0,0,0,1|2,0,0]=3 2407 B13R1.470 CCNC(=O)Cc1ccccc1I 11a_100015525214_100000036491 [0,0,0,0,0,1|2,0,0]=3 2408 B13R1.470 CCNC(=O)Cc1ccccc1I 240690a_100015525214_100000036491 [0,0,0,0,0,1|2,0,0]=3 2409 B13R1.470 CCNC(=O)Cc1ccccc1I 527a_100015525214_100000036491 [0,0,0,0,0,1|2,0,0]=3 2410 B13R1.470 CCNC(=O)Cc1ccccc1O 240690a_100015525214_100000743006 [0,0,0,0,0,1|1,0,0]=2 2411 B13R1.470 CCNC(=O)Cc1ccccc1O 271570a_203496583355_200009816148 [0,0,0,0,0,1|1,0,0]=2 2412 B13R1.470 CCNC(=O)Cc1ccccc1O 527a_100015525214_100000743006 [0,0,0,0,0,1|1,0,0]=2 2413 B13R1.470 CCNC(=O)Cc1cccnc1Cl 11a_100015525214_100000093521 [0,0,0,0,0,1|3,0,0]=4 2414 B13R1.470 CCNC(=O)Cc1cccnc1Cl 240690a_100015525214_100000093521 [0,0,0,0,0,1|3,0,0]=4 2415 B13R1.470 CCNC(=O)Cc1cccnc1Cl 527a_100015525214_100000093521 [0,0,0,0,0,1|3,0,0]=4 2416 B13R1.470 CCNC(=O)Cc1ncccc1Br 11a_100015525214_200012357574 [0,0,0,0,0,1|3,0,0]=4 2417 B13R1.470 CCNC(=O)Cc1ncccc1Br 240690a_100015525214_200012357574 [0,0,0,0,0,1|3,0,0]=4 2418 B13R1.470 CCNC(=O)Cc1ncccc1C 11a_100015525214_200000722269 [0,0,0,0,0,1|3,0,0]=4 2419 B13R1.470 CCNC(=O)Cc1ncccc1C 240690a_100015525214_200000722269 [0,0,0,0,0,1|3,0,0]=4 2420 B13R1.470 CCNC(=O)Cc1ncccc1Cl 11a_100015525214_100011998755 [0,0,0,0,0,1|3,0,0]=4 2421 B13R1.470 CCNC(=O)Cc1ncccc1Cl 240690a_100015525214_100011998755 [0,0,0,0,0,1|3,0,0]=4 2422 B13R1.470 CCNC(=O)Cc1ncccc1Cl 527a_100015525214_100011998755 [0,0,0,0,0,1|3,0,0]=4 2423 B13R1.470 CCNC(=O)Cn1ccccc1=O 240690a_100015525214_100000189665 [0,0,0,0,0,1|2,0,1]=4 2424 B13R1.470 CCNC(=O)Cn1ccccc1=O 527a_100015525214_100000189665 [0,0,0,0,0,1|2,0,1]=4 2425 B13R1.470 CCNC(=O)Nc1ccccc1Br 2430a_100000210017_100015525214 [0,0,0,0,0,1|2,0,0]=3 2426 B13R1.470 CCNC(=O)Nc1ccccc1C 2430a_100015192222_100015525214 [0,0,0,0,0,1|2,0,0]=3 2427 B13R1.470 CCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100015525214 [0,0,0,0,0,1|2,0,0]=3 2428 B13R1.470 CCNC(=O)Nc1ccccc1F 2430a_100000210422_100015525214 [0,0,0,0,0,1|2,0,0]=3 2429 B13R1.470 CCNC(=O)Nc1ccccc1I 2430a_100000210053_100015525214 [0,0,0,0,0,1|2,0,0]=3 2430 B13R1.470 CCNC(=O)Nc1ccccc1O 2430a_100000185747_100015525214 [0,0,0,0,0,1|1,0,0]=2 2431 B13R1.470 CCOC(=O)Cc1ccccc1O 271570a_203496583355_100011218996 [0,0,0,0,0,1|0,0,0]=1 2432 B13R1.470 CCOC(=O)Cc1cccnc1O 271570a_203496583355_100009886914 [0,0,0,0,0,1|1,0,0]=2 2433 B13R1.470 CCOC(=O)Cc1ccncc1O 271570a_203496583355_100010089795 [0,0,0,0,0,1|1,0,0]=2 2434 B13R1.470 CCOC(=O)Cc1ncccc1O 271570a_203496583355_100016306959 [0,0,0,0,0,1|1,0,0]=2 2435 B13R1.470 CCOC(=O)Cc1ncncc1O 271570a_203496583355_100010009764 [0,0,0,0,0,1|2,0,0]=3 2436 B13R1.470 CNCC(=O)Cc1ccccc1Br 2230a_106832991635_100000700504 [0,0,0,0,0,1|3,0,0]=4 2437 B13R1.470 CNCC(=O)Cc1ccccc1Br 34a_100102657272_100000700504 [0,0,0,0,0,1|3,0,0]=4 2438 B13R1.470 CNCC(=O)Cc1ccccc1Br 7a_106832991635_100000700504 [0,0,0,0,0,1|3,0,0]=4 2439 B13R1.470 CNCC(=O)Cc1ccccc1C 2230a_106832991635_100011223134 [0,0,0,0,0,1|3,0,0]=4 2440 B13R1.470 CNCC(=O)Cc1ccccc1C 7a_106832991635_100011223134 [0,0,0,0,0,1|3,0,0]=4 2441 B13R1.470 CNCC(=O)Nc1ccccc1Br 2230a_100000683505_200000210301 [0,0,0,0,0,1|3,0,0]=4 2442 B13R1.470 CNCC(=O)Nc1ccccc1Br 2230a_106832991635_100000182372 [0,0,0,0,0,1|3,0,0]=4 2443 B13R1.470 CNCC(=O)Nc1ccccc1Br 7a_106832991635_100000182372 [0,0,0,0,0,1|3,0,0]=4 2444 B13R1.470 CNCC(=O)Nc1ccccc1C 2230a_100015186652_200000210301 [0,0,0,0,0,1|3,0,0]=4 2445 B13R1.470 CNCC(=O)Nc1ccccc1C 2230a_106832991635_100000183529 [0,0,0,0,0,1|3,0,0]=4 2446 B13R1.470 CNCC(=O)Nc1ccccc1C 34a_100102657272_100000183529 [0,0,0,0,0,1|3,0,0]=4 2447 B13R1.470 CNCC(=O)Nc1ccccc1C 7a_106832991635_100000183529 [0,0,0,0,0,1|3,0,0]=4 2448 B13R1.470 CNCC(=O)Nc1ccccc1Cl 2230a_106832991635_100000182448 [0,0,0,0,0,1|3,0,0]=4 2449 B13R1.470 CNCC(=O)Nc1ccccc1Cl 34a_100102657272_100000182448 [0,0,0,0,0,1|3,0,0]=4 2450 B13R1.470 CNCC(=O)Nc1ccccc1Cl 7a_106832991635_100000182448 [0,0,0,0,0,1|3,0,0]=4 2451 B13R1.470 CNCC(=O)Nc1ccccc1F 2230a_106832991635_100000182988 [0,0,0,0,0,1|3,0,0]=4 2452 B13R1.470 CNCC(=O)Nc1ccccc1F 34a_100102657272_100000243840 [0,0,0,0,0,1|3,0,0]=4 2453 B13R1.470 CNCC(=O)Nc1ccccc1F 7a_106832991635_100000182988 [0,0,0,0,0,1|3,0,0]=4 2454 B13R1.470 CNCC(=O)Nc1ccccc1I 2230a_106832991635_100000180142 [0,0,0,0,0,1|3,0,0]=4 2455 B13R1.470 CNCC(=O)Nc1ccccc1I 34a_100102657272_100000180142 [0,0,0,0,0,1|3,0,0]=4 2456 B13R1.470 CNCC(=O)Nc1ccccc1I 7a_106832991635_100000180142 [0,0,0,0,0,1|3,0,0]=4 2457 B13R1.470 CNCC(=O)Nc1ccccc1O 7a_106832991635_100000014494 [0,0,0,0,0,1|2,0,0]=3 2458 B13R1.470 CNNC(=O)Cc1ccccc1Br 22a_100016993582_100000751119 [0,0,0,0,0,1|3,0,0]=4 2459 B13R1.470 CNNC(=O)Cc1ccccc1C 22a_100016993582_100000212180 [0,0,0,0,0,1|3,0,0]=4 2460 B13R1.470 CNNC(=O)Cc1ccccc1Cl 22a_100016993582_100000183793 [0,0,0,0,0,1|3,0,0]=4 2461 B13R1.470 CNNC(=O)Cc1ccccc1F 22a_100016993582_100000212012 [0,0,0,0,0,1|3,0,0]=4 2462 B13R1.470 CNNC(=O)Cc1ccccc1I 22a_100016993582_100000036491 [0,0,0,0,0,1|3,0,0]=4 2463 B13R1.470 CNNC(=O)Cc1ccccc1O 22a_100016993582_100000743006 [0,0,0,0,0,1|2,0,0]=3 2464 B13R1.470 COCC(=O)Cc1ccccc1Br 1458a_100000210968_100000184730 [0,0,0,0,0,1|3,0,0]=4 2465 B13R1.470 COCC(=O)Cc1ccccc1Br 34a_100138415774_100000700504 [0,0,0,0,0,1|3,0,0]=4 2466 B13R1.470 COCC(=O)Cc1ccccc1C 1458a_100000210968_100000211839 [0,0,0,0,0,1|3,0,0]=4 2467 B13R1.470 COCC(=O)Cc1ccccc1Cl 1458a_100000210968_100000187162 [0,0,0,0,0,1|3,0,0]=4 2468 B13R1.470 COCC(=O)Cc1ccccc1F 1458a_100000210968_100000187165 [0,0,0,0,0,1|3,0,0]=4 2469 B13R1.470 COCC(=O)Cc1ccccc1I 1458a_100000210968_100011216222 [0,0,0,0,0,1|3,0,0]=4 2470 B13R1.470 COCC(=O)Cc1ncccc1O 1458a_100000210968_200020655725 [0,0,0,0,0,1|3,0,0]=4 2471 B13R1.470 COCC(=O)Nc1ccccc1Br 11a_100000210017_100000210968 [0,0,0,0,0,1|3,0,0]=4 2472 B13R1.470 COCC(=O)Nc1ccccc1Br 1626a_100000210017_100000210968 [0,0,0,0,0,1|3,0,0]=4 2473 B13R1.470 COCC(=O)Nc1ccccc1C 11a_100015192222_100000210968 [0,0,0,0,0,1|3,0,0]=4 2474 B13R1.470 COCC(=O)Nc1ccccc1C 1626a_100015192222_100000210968 [0,0,0,0,0,1|3,0,0]=4 2475 B13R1.470 COCC(=O)Nc1ccccc1C 22a_100015192222_100000210968 [0,0,0,0,0,1|3,0,0]=4 2476 B13R1.470 COCC(=O)Nc1ccccc1C 34a_100138415774_100000183529 [0,0,0,0,0,1|3,0,0]=4 2477 B13R1.470 COCC(=O)Nc1ccccc1C 527a_100015192222_100000210968 [0,0,0,0,0,1|3,0,0]=4 2478 B13R1.470 COCC(=O)Nc1ccccc1Cl 11a_100000185783_100000210968 [0,0,0,0,0,1|3,0,0]=4 2479 B13R1.470 COCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210968 [0,0,0,0,0,1|3,0,0]=4 2480 B13R1.470 COCC(=O)Nc1ccccc1Cl 22a_100000185783_100000210968 [0,0,0,0,0,1|3,0,0]=4 2481 B13R1.470 COCC(=O)Nc1ccccc1Cl 34a_100138415774_100000182448 [0,0,0,0,0,1|3,0,0]=4 2482 B13R1.470 COCC(=O)Nc1ccccc1Cl 527a_100000185783_100000210968 [0,0,0,0,0,1|3,0,0]=4 2483 B13R1.470 COCC(=O)Nc1ccccc1F 11a_100000210422_100000210968 [0,0,0,0,0,1|3,0,0]=4 2484 B13R1.470 COCC(=O)Nc1ccccc1F 1626a_100000210422_100000210968 [0,0,0,0,0,1|3,0,0]=4 2485 B13R1.470 COCC(=O)Nc1ccccc1F 22a_100000210422_100000210968 [0,0,0,0,0,1|3,0,0]=4 2486 B13R1.470 COCC(=O)Nc1ccccc1F 34a_100138415774_100000243840 [0,0,0,0,0,1|3,0,0]=4 2487 B13R1.470 COCC(=O)Nc1ccccc1F 527a_100000210422_100000210968 [0,0,0,0,0,1|3,0,0]=4 2488 B13R1.470 COCC(=O)Nc1ccccc1I 11a_100000210053_100000210968 [0,0,0,0,0,1|3,0,0]=4 2489 B13R1.470 COCC(=O)Nc1ccccc1I 1626a_100000210053_100000210968 [0,0,0,0,0,1|3,0,0]=4 2490 B13R1.470 COCC(=O)Nc1ccccc1I 34a_100138415774_100000180142 [0,0,0,0,0,1|3,0,0]=4 2491 B13R1.470 COCC(=O)Nc1ccccc1O 22a_100000185747_100000210968 [0,0,0,0,0,1|2,0,0]=3 2492 B13R1.470 COCC(=O)Nc1ccccc1O 271570a_203496583355_200000158336 [0,0,0,0,0,1|2,0,0]=3 2493 B13R1.470 COCC(=O)Nc1ccccc1O 527a_100000185747_100000210968 [0,0,0,0,0,1|2,0,0]=3 2494 B13R1.470 CSCC(=O)Cc1ccccc1Br 1458a_100000184570_100000184730 [0,0,0,0,0,1|3,0,0]=4 2495 B13R1.470 CSCC(=O)Cc1ccccc1Br 62a_100000700504_200000210301 [0,0,0,0,0,1|3,0,0]=4 2496 B13R1.470 CSCC(=O)Cc1ccccc1Br 62a_200000210301_100000700504 [0,0,0,0,0,1|3,0,0]=4 2497 B13R1.470 CSCC(=O)Cc1ccccc1C 1458a_100000184570_100000211839 [0,0,0,0,0,1|3,0,0]=4 2498 B13R1.470 CSCC(=O)Cc1ccccc1C 62a_100011223134_200000210301 [0,0,0,0,0,1|3,0,0]=4 2499 B13R1.470 CSCC(=O)Cc1ccccc1C 62a_200000210301_100011223134 [0,0,0,0,0,1|3,0,0]=4 2500 B13R1.470 CSCC(=O)Cc1ccccc1Cl 1458a_100000184570_100000187162 [0,0,0,0,0,1|3,0,0]=4 2501 B13R1.470 CSCC(=O)Cc1ccccc1F 1458a_100000184570_100000187165 [0,0,0,0,0,1|3,0,0]=4 2502 B13R1.470 CSCC(=O)Cc1ccccc1I 1458a_100000184570_100011216222 [0,0,0,0,0,1|3,0,0]=4 2503 B13R1.470 CSCC(=O)Cc1ncccc1O 1458a_100000184570_200020655725 [0,0,0,0,0,1|3,0,0]=4 2504 B13R1.470 CSCC(=O)Nc1ccccc1Br 11a_100000210017_100000184570 [0,0,0,0,0,1|3,0,0]=4 2505 B13R1.470 CSCC(=O)Nc1ccccc1Br 1626a_100000210017_100000184570 [0,0,0,0,0,1|3,0,0]=4 2506 B13R1.470 CSCC(=O)Nc1ccccc1Br 62a_100000182372_200000210301 [0,0,0,0,0,1|3,0,0]=4 2507 B13R1.470 CSCC(=O)Nc1ccccc1Br 62a_200000210301_100000182372 [0,0,0,0,0,1|3,0,0]=4 2508 B13R1.470 CSCC(=O)Nc1ccccc1C 11a_100015192222_100000184570 [0,0,0,0,0,1|3,0,0]=4 2509 B13R1.470 CSCC(=O)Nc1ccccc1C 1626a_100015192222_100000184570 [0,0,0,0,0,1|3,0,0]=4 2510 B13R1.470 CSCC(=O)Nc1ccccc1C 22a_100015192222_100000184570 [0,0,0,0,0,1|3,0,0]=4 2511 B13R1.470 CSCC(=O)Nc1ccccc1C 527a_100015192222_100000184570 [0,0,0,0,0,1|3,0,0]=4 2512 B13R1.470 CSCC(=O)Nc1ccccc1C 62a_200000210301_100000183529 [0,0,0,0,0,1|3,0,0]=4 2513 B13R1.470 CSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000184570 [0,0,0,0,0,1|3,0,0]=4 2514 B13R1.470 CSCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000184570 [0,0,0,0,0,1|3,0,0]=4 2515 B13R1.470 CSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000184570 [0,0,0,0,0,1|3,0,0]=4 2516 B13R1.470 CSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000184570 [0,0,0,0,0,1|3,0,0]=4 2517 B13R1.470 CSCC(=O)Nc1ccccc1Cl 62a_200000210301_100000182448 [0,0,0,0,0,1|3,0,0]=4 2518 B13R1.470 CSCC(=O)Nc1ccccc1Cl 62a_200011202291_200000210301 [0,0,0,0,0,1|3,0,0]=4 2519 B13R1.470 CSCC(=O)Nc1ccccc1F 11a_100000210422_100000184570 [0,0,0,0,0,1|3,0,0]=4 2520 B13R1.470 CSCC(=O)Nc1ccccc1F 1626a_100000210422_100000184570 [0,0,0,0,0,1|3,0,0]=4 2521 B13R1.470 CSCC(=O)Nc1ccccc1F 22a_100000210422_100000184570 [0,0,0,0,0,1|3,0,0]=4 2522 B13R1.470 CSCC(=O)Nc1ccccc1F 527a_100000210422_100000184570 [0,0,0,0,0,1|3,0,0]=4 2523 B13R1.470 CSCC(=O)Nc1ccccc1F 62a_100000182988_200000210301 [0,0,0,0,0,1|3,0,0]=4 2524 B13R1.470 CSCC(=O)Nc1ccccc1F 62a_200000210301_100000182988 [0,0,0,0,0,1|3,0,0]=4 2525 B13R1.470 CSCC(=O)Nc1ccccc1I 11a_100000210053_100000184570 [0,0,0,0,0,1|3,0,0]=4 2526 B13R1.470 CSCC(=O)Nc1ccccc1I 1626a_100000210053_100000184570 [0,0,0,0,0,1|3,0,0]=4 2527 B13R1.470 CSCC(=O)Nc1ccccc1I 62a_100000180142_200000210301 [0,0,0,0,0,1|3,0,0]=4 2528 B13R1.470 CSCC(=O)Nc1ccccc1I 62a_200000210301_100000180142 [0,0,0,0,0,1|3,0,0]=4 2529 B13R1.470 CSCC(=O)Nc1ccccc1O 22a_100000185747_100000184570 [0,0,0,0,0,1|2,0,0]=3 2530 B13R1.470 CSCC(=O)Nc1ccccc1O 527a_100000185747_100000184570 [0,0,0,0,0,1|2,0,0]=3 2531 B13R1.470 CSCC(=O)Nc1ccccc1O 62a_200000210301_100000014494 [0,0,0,0,0,1|2,0,0]=3 2532 B13R1.470 Cc1ccccc1CC(=O)CCF 1458a_100000212180_100011217306 [0,0,0,0,0,1|3,0,0]=4 2533 B13R1.470 Cc1ccccc1CC(=O)CCO 1458a_100000212180_100000211926 [0,0,0,0,0,1|3,0,0]=4 2534 B13R1.470 Cc1ccccc1CC(=O)CCO 1458a_100011216618_100000211839 [0,0,0,0,0,1|3,0,0]=4 2535 B13R1.470 Cc1ccccc1CC(=O)CS[13CH3] 62a_100011223134_200025704644 [0,0,0,0,0,1|3,0,0]=4 2536 B13R1.470 Cc1ccccc1CC(=O)CS[13CH3] 62a_200025704644_100011223134 [0,0,0,0,0,1|3,0,0]=4 2537 B13R1.470 Cc1ccccc1NC(=O)CCO 22a_100015192222_100011216618 [0,0,0,0,0,1|3,0,0]=4 2538 B13R1.470 Cc1ccccc1NC(=O)CN[13CH3] 2230a_100015186652_200025704644 [0,0,0,0,0,1|3,0,0]=4 2539 B13R1.470 Cc1ccccc1NC(=O)CS[13CH3] 62a_200025704644_100000183529 [0,0,0,0,0,1|3,0,0]=4 2540 B13R1.470 N#CCC(=O)Cc1ccccc1O 1458a_100000743006_100011214920 [0,0,0,0,0,1|2,0,1]=4 2541 B13R1.470 N#CCC(=O)Nc1ccccc1O 22a_100000185747_100051588842 [0,0,0,0,0,1|2,0,1]=4 2542 B13R1.470 O=C(CCF)Cc1ccccc1Br 1458a_100000751119_100011217306 [0,0,0,0,0,1|3,0,0]=4 2543 B13R1.470 O=C(CCF)Cc1ccccc1Cl 1458a_100000183793_100011217306 [0,0,0,0,0,1|3,0,0]=4 2544 B13R1.470 O=C(CCF)Cc1ccccc1F 1458a_100000212012_100011217306 [0,0,0,0,0,1|3,0,0]=4 2545 B13R1.470 O=C(CCF)Cc1ccccc1I 1458a_100000036491_100011217306 [0,0,0,0,0,1|3,0,0]=4 2546 B13R1.470 O=C(CCF)Cc1ccccc1O 1458a_100000743006_100011217306 [0,0,0,0,0,1|2,0,0]=3 2547 B13R1.470 O=C(CCO)Cc1ccccc1Br 1458a_100000751119_100000211926 [0,0,0,0,0,1|3,0,0]=4 2548 B13R1.470 O=C(CCO)Cc1ccccc1Br 1458a_100011216618_100000184730 [0,0,0,0,0,1|3,0,0]=4 2549 B13R1.470 O=C(CCO)Cc1ccccc1Cl 1458a_100000183793_100000211926 [0,0,0,0,0,1|3,0,0]=4 2550 B13R1.470 O=C(CCO)Cc1ccccc1Cl 1458a_100011216618_100000187162 [0,0,0,0,0,1|3,0,0]=4 2551 B13R1.470 O=C(CCO)Cc1ccccc1F 1458a_100000212012_100000211926 [0,0,0,0,0,1|3,0,0]=4 2552 B13R1.470 O=C(CCO)Cc1ccccc1F 1458a_100011216618_100000187165 [0,0,0,0,0,1|3,0,0]=4 2553 B13R1.470 O=C(CCO)Cc1ccccc1I 1458a_100000036491_100000211926 [0,0,0,0,0,1|3,0,0]=4 2554 B13R1.470 O=C(CCO)Cc1ccccc1I 1458a_100011216618_100011216222 [0,0,0,0,0,1|3,0,0]=4 2555 B13R1.470 O=C(CCO)Cc1ccccc1O 1458a_100000743006_100000211926 [0,0,0,0,0,1|2,0,0]=3 2556 B13R1.470 O=C(CCO)Cc1ncccc1O 1458a_100011216618_200020655725 [0,0,0,0,0,1|3,0,0]=4 2557 B13R1.470 O=C(CCO)Nc1ccccc1Cl 22a_100000185783_100011216618 [0,0,0,0,0,1|3,0,0]=4 2558 B13R1.470 O=C(CCO)Nc1ccccc1F 22a_100000210422_100011216618 [0,0,0,0,0,1|3,0,0]=4 2559 B13R1.470 O=C(CCO)Nc1ccccc1O 22a_100000185747_100011216618 [0,0,0,0,0,1|2,0,0]=3 2560 B13R1.470 [13CH3]NCC(=O)Nc1ccccc1Br 2230a_100000683505_200025704644 [0,0,0,0,0,1|3,0,0]=4 2561 B13R1.470 [13CH3]SCC(=O)Cc1ccccc1Br 62a_100000700504_200025704644 [0,0,0,0,0,1|3,0,0]=4 2562 B13R1.470 [13CH3]SCC(=O)Cc1ccccc1Br 62a_200025704644_100000700504 [0,0,0,0,0,1|3,0,0]=4 2563 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1Br 62a_100000182372_200025704644 [0,0,0,0,0,1|3,0,0]=4 2564 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1Br 62a_200025704644_100000182372 [0,0,0,0,0,1|3,0,0]=4 2565 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1Cl 62a_200011202291_200025704644 [0,0,0,0,0,1|3,0,0]=4 2566 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1Cl 62a_200025704644_100000182448 [0,0,0,0,0,1|3,0,0]=4 2567 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1F 62a_100000182988_200025704644 [0,0,0,0,0,1|3,0,0]=4 2568 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1F 62a_200025704644_100000182988 [0,0,0,0,0,1|3,0,0]=4 2569 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1I 62a_100000180142_200025704644 [0,0,0,0,0,1|3,0,0]=4 2570 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1I 62a_200025704644_100000180142 [0,0,0,0,0,1|3,0,0]=4 2571 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1O 62a_200025704644_100000014494 [0,0,0,0,0,1|2,0,0]=3 2572 B10R0.18 C=CC=CC(=O)CC(=O)CC 1458a_100016291481_100000747405 [1,0,1,0,0,0|0,0,2]=4 2573 B10R0.18 C=CC=CC(=O)CC(=O)OC 1458a_100016291481_100000747449 [1,0,1,0,0,0|0,0,2]=4 2574 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [2,0,0,0,0,0|0,0,0]=2 2575 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [2,0,0,0,0,0|2,0,0]=4 2576 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [2,0,0,0,0,0|2,0,0]=4 2577 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [2,0,0,0,0,0|2,0,0]=4 2578 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [2,0,0,0,0,0|2,0,0]=4 2579 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [2,0,0,0,0,0|2,0,0]=4 2580 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [2,0,0,0,0,0|2,0,0]=4 2581 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [2,0,0,0,0,0|2,0,0]=4 2582 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [2,0,0,0,0,0|2,0,0]=4 2583 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [2,0,0,0,0,0|2,0,0]=4 2584 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [2,0,0,0,0,0|1,0,0]=3 2585 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [2,0,0,0,0,0|1,0,0]=3 2586 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [2,0,0,0,0,0|1,0,0]=3 2587 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [2,0,0,0,0,0|1,0,0]=3 2588 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [2,0,0,0,0,0|1,0,1]=4 2589 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [2,0,0,0,0,0|1,0,1]=4 2590 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [2,0,0,0,0,0|1,0,1]=4 2591 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [2,0,0,0,0,0|1,0,1]=4 2592 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [2,0,0,0,0,0|1,0,1]=4 2593 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [2,0,0,0,0,0|1,0,0]=3 2594 B10R1.17 CCCCc1ccccc1 271570a_100020621405_100000210277 [2,0,0,0,0,0|1,0,1]=4 2595 B10R1.17 CCCNc1ccccc1 34a_100000106764_100000210303 [2,0,0,0,0,0|2,0,0]=4 2596 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [2,0,0,0,0,0|2,0,0]=4 2597 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [2,0,0,0,0,0|2,0,0]=4 2598 B10R1.17 CCCSc1ccccc1 62a_100000210303_100000041952 [2,0,0,0,0,0|2,0,0]=4 2599 B10R1.17 CCCSc1ccccc1 62a_100000719477_100000210303 [2,0,0,0,0,0|2,0,0]=4 2600 B10R1.17 CCNCc1ccccc1 207a_100015525214_100015611070 [2,0,0,0,0,0|1,0,1]=4 2601 B10R1.17 CCNCc1ccccc1 2230a_100015324214_100000210202 [2,0,0,0,0,0|1,0,1]=4 2602 B10R1.17 CCNCc1ccccc1 2230a_100015525214_100015291786 [2,0,0,0,0,0|1,0,1]=4 2603 B10R1.17 CCNCc1ccccc1 270004a_100015525214_100015611070 [2,0,0,0,0,0|1,0,1]=4 2604 B10R1.17 CCNCc1ccccc1 34a_100015324214_100000210202 [2,0,0,0,0,0|1,0,1]=4 2605 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [2,0,0,0,0,0|0,0,1]=3 2606 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [2,0,0,0,0,0|0,0,1]=3 2607 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [2,0,0,0,0,0|0,0,1]=3 2608 B10R1.17 CCOCc1ccccn1 34a_100121572206_100000721315 [2,0,0,0,0,0|1,0,1]=4 2609 B10R1.17 CCOCc1cccnc1 34a_100121572206_100000733263 [2,0,0,0,0,0|1,0,1]=4 2610 B10R1.17 CCSCc1ccccc1 62a_100000210202_100015291786 [2,0,0,0,0,0|0,1,1]=4 2611 B10R1.17 CCSCc1ccccc1 62a_100000211182_100000210202 [2,0,0,0,0,0|0,1,1]=4 2612 B10R1.17 FCOCc1ccccc1 34a_100000210790_100015361967 [2,0,0,0,0,0|1,0,1]=4 2613 B10R1.17 FCOCc1ccccc1 7a_100000210790_100015361967 [2,0,0,0,0,0|1,0,1]=4 2614 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [2,0,0,0,0,0|0,0,2]=4 2615 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [2,0,0,0,0,0|1,0,1]=4 2616 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [2,0,0,0,0,0|1,0,1]=4 2617 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [2,0,0,0,0,0|1,0,1]=4 2618 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [2,0,0,0,0,0|1,0,1]=4 2619 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [2,0,0,0,0,0|1,0,1]=4 2620 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [2,0,0,0,0,0|0,0,1]=3 2621 B10R1.4 CC=Cc1ccncc1O 271570a_100016259895_100009817591 [2,0,0,0,0,0|1,0,1]=4 2622 B10R1.4 CC=Cc1ncccc1O 271570a_100016259895_100000034122 [2,0,0,0,0,0|1,0,1]=4 2623 B10R1.4 CCNc1ccccc1Br 34a_100000210017_100000210202 [2,0,0,0,0,0|2,0,0]=4 2624 B10R1.4 CCNc1ccccc1C 34a_100015192222_100000210202 [2,0,0,0,0,0|2,0,0]=4 2625 B10R1.4 CCNc1ccccc1Cl 34a_100000185783_100000210202 [2,0,0,0,0,0|2,0,0]=4 2626 B10R1.4 CCNc1ccccc1F 34a_100000210422_100000210202 [2,0,0,0,0,0|2,0,0]=4 2627 B10R1.4 CCNc1ccccc1I 34a_100000210053_100000210202 [2,0,0,0,0,0|2,0,0]=4 2628 B10R1.4 CCNc1ccccc1O 271570a_203496583355_114873767003 [2,0,0,0,0,0|1,0,0]=3 2629 B10R1.4 CCNc1ccccc1O 34a_100000185747_100000210202 [2,0,0,0,0,0|1,0,0]=3 2630 B10R1.4 CCOc1cccc[n+]1[O-] 7a_100000211761_100000210202 [2,0,0,0,0,0|1,0,1]=4 2631 B10R1.4 CCOc1ccccc1Br 34a_100000181306_100000210202 [2,0,0,0,0,0|1,0,0]=3 2632 B10R1.4 CCOc1ccccc1Br 7a_100000181306_100000210202 [2,0,0,0,0,0|1,0,0]=3 2633 B10R1.4 CCOc1ccccc1C 34a_100000210338_100000210202 [2,0,0,0,0,0|1,0,0]=3 2634 B10R1.4 CCOc1ccccc1C 7a_100000210338_100000210202 [2,0,0,0,0,0|1,0,0]=3 2635 B10R1.4 CCOc1ccccc1Cl 34a_100000210172_100000210202 [2,0,0,0,0,0|1,0,0]=3 2636 B10R1.4 CCOc1ccccc1Cl 7a_100000210172_100000210202 [2,0,0,0,0,0|1,0,0]=3 2637 B10R1.4 CCOc1ccccc1F 34a_100000210171_100000210202 [2,0,0,0,0,0|1,0,0]=3 2638 B10R1.4 CCOc1ccccc1F 7a_100000210171_100000210202 [2,0,0,0,0,0|1,0,0]=3 2639 B10R1.4 CCOc1ccccc1I 34a_100000739446_100000210202 [2,0,0,0,0,0|1,0,0]=3 2640 B10R1.4 CCOc1ccccc1I 7a_100000739446_100000210202 [2,0,0,0,0,0|1,0,0]=3 2641 B10R1.4 CCOc1ccccc1N 34a_100000185747_100000210202 [2,0,0,0,0,0|1,0,0]=3 2642 B10R1.4 CCOc1ccccc1N 7a_100000185747_100000210202 [2,0,0,0,0,0|1,0,0]=3 2643 B10R1.4 CCOc1ccccc1O 271570a_203496583355_100000230754 [2,0,0,0,0,0|0,0,0]=2 2644 B10R1.4 CCOc1cccnc1Br 34a_100000744436_100000210202 [2,0,0,0,0,0|2,0,0]=4 2645 B10R1.4 CCOc1cccnc1Br 7a_100000744436_100000210202 [2,0,0,0,0,0|2,0,0]=4 2646 B10R1.4 CCOc1cccnc1C 34a_100000745507_100000210202 [2,0,0,0,0,0|2,0,0]=4 2647 B10R1.4 CCOc1cccnc1C 7a_100000745507_100000210202 [2,0,0,0,0,0|2,0,0]=4 2648 B10R1.4 CCOc1cccnc1Cl 34a_100000757616_100000210202 [2,0,0,0,0,0|2,0,0]=4 2649 B10R1.4 CCOc1cccnc1Cl 7a_100000757616_100000210202 [2,0,0,0,0,0|2,0,0]=4 2650 B10R1.4 CCOc1cccnc1F 34a_100000061740_100000210202 [2,0,0,0,0,0|2,0,0]=4 2651 B10R1.4 CCOc1cccnc1F 7a_100000061740_100000210202 [2,0,0,0,0,0|2,0,0]=4 2652 B10R1.4 CCOc1cccnc1I 34a_100000034122_100000210202 [2,0,0,0,0,0|2,0,0]=4 2653 B10R1.4 CCOc1cccnc1I 7a_100000034122_100000210202 [2,0,0,0,0,0|2,0,0]=4 2654 B10R1.4 CCOc1cccnc1N 34a_100000211975_100000210202 [2,0,0,0,0,0|2,0,0]=4 2655 B10R1.4 CCOc1cccnc1N 7a_100000211975_100000210202 [2,0,0,0,0,0|2,0,0]=4 2656 B10R1.4 CCOc1cccnc1O 271570a_203496583355_100011597540 [2,0,0,0,0,0|1,0,0]=3 2657 B10R1.4 CCOc1cccoc1=O 34a_100000077404_100000210202 [2,0,0,0,0,0|1,0,1]=4 2658 B10R1.4 CCOc1cccoc1=O 7a_100000077404_100000210202 [2,0,0,0,0,0|1,0,1]=4 2659 B10R1.4 CCOc1ccncc1Br 34a_100011996408_100000210202 [2,0,0,0,0,0|2,0,0]=4 2660 B10R1.4 CCOc1ccncc1C 34a_100000694293_100000210202 [2,0,0,0,0,0|2,0,0]=4 2661 B10R1.4 CCOc1ccncc1Cl 34a_100011997054_100000210202 [2,0,0,0,0,0|2,0,0]=4 2662 B10R1.4 CCOc1ccncc1F 34a_200000081243_100000210202 [2,0,0,0,0,0|2,0,0]=4 2663 B10R1.4 CCOc1cnccc1C 34a_100011997053_100000210202 [2,0,0,0,0,0|2,0,0]=4 2664 B10R1.4 CCOc1cnccc1C 7a_100011997053_100000210202 [2,0,0,0,0,0|2,0,0]=4 2665 B10R1.4 CCOc1cnccc1Cl 34a_100011996695_100000210202 [2,0,0,0,0,0|2,0,0]=4 2666 B10R1.4 CCOc1cnccc1I 34a_100000050107_100000210202 [2,0,0,0,0,0|2,0,0]=4 2667 B10R1.4 CCOc1cnccc1N 34a_100000753702_100000210202 [2,0,0,0,0,0|2,0,0]=4 2668 B10R1.4 CCOc1coccc1=O 34a_100000060831_100000210202 [2,0,0,0,0,0|1,0,1]=4 2669 B10R1.4 CCOc1ncccc1Cl 34a_100011290957_100000210202 [2,0,0,0,0,0|2,0,0]=4 2670 B10R1.4 CCOc1ncccc1F 34a_100011219419_100000210202 [2,0,0,0,0,0|2,0,0]=4 2671 B10R1.4 CCOc1ncccc1N 34a_100000746358_100000210202 [2,0,0,0,0,0|2,0,0]=4 2672 B10R1.4 CCOc1ncccc1O 271570a_203496583355_100011465154 [2,0,0,0,0,0|1,0,0]=3 2673 B10R1.4 CCOc1nccnc1O 271570a_203496583355_200010128176 [2,0,0,0,0,0|2,0,0]=4 2674 B10R1.4 CCSc1ccccc1Br 62a_100000210202_100000695589 [2,0,0,0,0,0|1,1,0]=4 2675 B10R1.4 CCSc1ccccc1Br 62a_100000695589_100000210202 [2,0,0,0,0,0|1,1,0]=4 2676 B10R1.4 CCSc1ccccc1C 62a_100000210202_100000210755 [2,0,0,0,0,0|1,1,0]=4 2677 B10R1.4 CCSc1ccccc1C 62a_100000210755_100000210202 [2,0,0,0,0,0|1,1,0]=4 2678 B10R1.4 CCSc1ccccc1Cl 62a_100000210202_100000764095 [2,0,0,0,0,0|1,1,0]=4 2679 B10R1.4 CCSc1ccccc1Cl 62a_100000764095_100000210202 [2,0,0,0,0,0|1,1,0]=4 2680 B10R1.4 CCSc1ccccc1F 62a_100000210202_100011215700 [2,0,0,0,0,0|1,1,0]=4 2681 B10R1.4 CCSc1ccccc1F 62a_100011215700_100000210202 [2,0,0,0,0,0|1,1,0]=4 2682 B10R1.4 CCSc1ccccc1N 62a_100000210017_100000210202 [2,0,0,0,0,0|1,1,0]=4 2683 B10R1.4 CCSc1ccccc1N 62a_100000210202_100000210017 [2,0,0,0,0,0|1,1,0]=4 2684 B10R1.4 CCSc1ccccc1O 271570a_203496583355_100000230856 [2,0,0,0,0,0|0,1,0]=3 2685 B10R1.4 CCSc1ccccc1O 62a_100000210202_100000739446 [2,0,0,0,0,0|0,1,0]=3 2686 B10R1.4 CCSc1ccccc1O 62a_100000739446_100000210202 [2,0,0,0,0,0|0,1,0]=3 2687 B10R1.4 CCSc1cccnc1O 62a_100000210202_100000760158 [2,0,0,0,0,0|1,1,0]=4 2688 B10R1.4 CCSc1cccnc1O 62a_100000760158_100000210202 [2,0,0,0,0,0|1,1,0]=4 2689 B10R1.4 CCSc1ccncc1O 62a_100000210202_100009817591 [2,0,0,0,0,0|1,1,0]=4 2690 B10R1.4 CCSc1ccncc1O 62a_100009817591_100000210202 [2,0,0,0,0,0|1,1,0]=4 2691 B10R1.4 CCSc1ncccc1O 62a_100000034122_100000210202 [2,0,0,0,0,0|1,1,0]=4 2692 B10R1.4 CCSc1ncccc1O 62a_100000210202_100000034122 [2,0,0,0,0,0|1,1,0]=4 2693 B10R1.4 CNCc1ccccc1O 271570a_203496583355_100000184654 [2,0,0,0,0,0|1,0,1]=4 2694 B10R1.4 CNCc1ccccc1O 34a_100000185550_200000210301 [2,0,0,0,0,0|1,0,1]=4 2695 B10R1.4 COCc1ccccc1Br 34a_100000756307_200000210301 [2,0,0,0,0,0|1,0,1]=4 2696 B10R1.4 COCc1ccccc1Br 34a_100138415774_100000184730 [2,0,0,0,0,0|1,0,1]=4 2697 B10R1.4 COCc1ccccc1Br 7a_100000756307_200000210301 [2,0,0,0,0,0|1,0,1]=4 2698 B10R1.4 COCc1ccccc1C 34a_100000698903_200000210301 [2,0,0,0,0,0|1,0,1]=4 2699 B10R1.4 COCc1ccccc1C 34a_100138415774_100000211839 [2,0,0,0,0,0|1,0,1]=4 2700 B10R1.4 COCc1ccccc1C 7a_100000698903_200000210301 [2,0,0,0,0,0|1,0,1]=4 2701 B10R1.4 COCc1ccccc1Cl 34a_100000210847_200000210301 [2,0,0,0,0,0|1,0,1]=4 2702 B10R1.4 COCc1ccccc1Cl 34a_100138415774_100000187162 [2,0,0,0,0,0|1,0,1]=4 2703 B10R1.4 COCc1ccccc1Cl 7a_100000210847_200000210301 [2,0,0,0,0,0|1,0,1]=4 2704 B10R1.4 COCc1ccccc1F 34a_100000211962_200000210301 [2,0,0,0,0,0|1,0,1]=4 2705 B10R1.4 COCc1ccccc1F 34a_100138415774_100000211605 [2,0,0,0,0,0|1,0,1]=4 2706 B10R1.4 COCc1ccccc1F 7a_100000211962_200000210301 [2,0,0,0,0,0|1,0,1]=4 2707 B10R1.4 COCc1ccccc1I 34a_100000187465_200000210301 [2,0,0,0,0,0|1,0,1]=4 2708 B10R1.4 COCc1ccccc1I 34a_100138415774_100011215278 [2,0,0,0,0,0|1,0,1]=4 2709 B10R1.4 COCc1ccccc1I 7a_100000187465_200000210301 [2,0,0,0,0,0|1,0,1]=4 2710 B10R1.4 COCc1ccccc1N 34a_100000212039_200000210301 [2,0,0,0,0,0|1,0,1]=4 2711 B10R1.4 COCc1ccccc1O 271570a_203496583355_100011493684 [2,0,0,0,0,0|0,0,1]=3 2712 B10R1.4 COCc1ncccc1O 34a_100138415774_200020655725 [2,0,0,0,0,0|1,0,1]=4 2713 B10R1.4 CSCc1ccccc1O 271570a_203496583355_100000148299 [2,0,0,0,0,0|0,1,1]=4 2714 B10R1.4 Cc1ccccc1CO[13CH3] 34a_100000698903_200025704644 [2,0,0,0,0,0|1,0,1]=4 2715 B10R1.4 Cc1ccccc1CO[13CH3] 7a_100000698903_200025704644 [2,0,0,0,0,0|1,0,1]=4 2716 B10R1.4 Cc1ccccc1OCF 34a_100000210338_100015361967 [2,0,0,0,0,0|2,0,0]=4 2717 B10R1.4 Cc1ccccc1OCF 7a_100000210338_100015361967 [2,0,0,0,0,0|2,0,0]=4 2718 B10R1.4 FCOc1ccccc1Br 34a_100000181306_100015361967 [2,0,0,0,0,0|2,0,0]=4 2719 B10R1.4 FCOc1ccccc1Br 7a_100000181306_100015361967 [2,0,0,0,0,0|2,0,0]=4 2720 B10R1.4 FCOc1ccccc1Cl 34a_100000210172_100015361967 [2,0,0,0,0,0|2,0,0]=4 2721 B10R1.4 FCOc1ccccc1Cl 7a_100000210172_100015361967 [2,0,0,0,0,0|2,0,0]=4 2722 B10R1.4 FCOc1ccccc1F 34a_100000210171_100015361967 [2,0,0,0,0,0|2,0,0]=4 2723 B10R1.4 FCOc1ccccc1F 7a_100000210171_100015361967 [2,0,0,0,0,0|2,0,0]=4 2724 B10R1.4 FCOc1ccccc1I 34a_100000739446_100015361967 [2,0,0,0,0,0|2,0,0]=4 2725 B10R1.4 FCOc1ccccc1I 7a_100000739446_100015361967 [2,0,0,0,0,0|2,0,0]=4 2726 B10R1.4 NCCc1ccccc1O 271570a_203496583355_100000747383 [2,0,0,0,0,0|1,0,1]=4 2727 B10R1.4 Nc1ccccc1OCF 34a_100000185747_100015361967 [2,0,0,0,0,0|2,0,0]=4 2728 B10R1.4 Nc1ccccc1OCF 7a_100000185747_100015361967 [2,0,0,0,0,0|2,0,0]=4 2729 B10R1.4 OCCc1ccccc1O 271570a_203496583355_100000731337 [2,0,0,0,0,0|1,0,1]=4 2730 B10R1.4 Oc1ccccc1NCF 34a_100000185747_100015361967 [2,0,0,0,0,0|2,0,0]=4 2731 B10R1.4 Oc1ccccc1SCF 62a_100000739446_100015361967 [2,0,0,0,0,0|1,1,0]=4 2732 B10R1.4 Oc1ccccc1SCF 62a_100015361967_100000739446 [2,0,0,0,0,0|1,1,0]=4 2733 B10R1.4 [13CH3]NCc1ccccc1O 34a_100000185550_200025704644 [2,0,0,0,0,0|1,0,1]=4 2734 B10R1.4 [13CH3]OCc1ccccc1Br 34a_100000756307_200025704644 [2,0,0,0,0,0|1,0,1]=4 2735 B10R1.4 [13CH3]OCc1ccccc1Br 7a_100000756307_200025704644 [2,0,0,0,0,0|1,0,1]=4 2736 B10R1.4 [13CH3]OCc1ccccc1Cl 34a_100000210847_200025704644 [2,0,0,0,0,0|1,0,1]=4 2737 B10R1.4 [13CH3]OCc1ccccc1Cl 7a_100000210847_200025704644 [2,0,0,0,0,0|1,0,1]=4 2738 B10R1.4 [13CH3]OCc1ccccc1F 34a_100000211962_200025704644 [2,0,0,0,0,0|1,0,1]=4 2739 B10R1.4 [13CH3]OCc1ccccc1F 7a_100000211962_200025704644 [2,0,0,0,0,0|1,0,1]=4 2740 B10R1.4 [13CH3]OCc1ccccc1I 34a_100000187465_200025704644 [2,0,0,0,0,0|1,0,1]=4 2741 B10R1.4 [13CH3]OCc1ccccc1I 7a_100000187465_200025704644 [2,0,0,0,0,0|1,0,1]=4 2742 B10R1.4 [13CH3]OCc1ccccc1N 34a_100000212039_200025704644 [2,0,0,0,0,0|1,0,1]=4 2743 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [2,0,0,0,0,0|2,0,0]=4 2744 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [2,0,0,0,0,0|2,0,0]=4 2745 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [2,0,0,0,0,0|2,0,0]=4 2746 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [2,0,0,0,0,0|2,0,0]=4 2747 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [2,0,0,0,0,0|2,0,0]=4 2748 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [2,0,0,0,0,0|1,0,0]=3 2749 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [2,0,0,0,0,0|2,0,0]=4 2750 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [2,0,0,0,0,0|2,0,0]=4 2751 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [2,0,0,0,0,0|1,0,0]=3 2752 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [2,0,0,0,0,0|1,0,0]=3 2753 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [2,0,0,0,0,0|1,0,0]=3 2754 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [2,0,0,0,0,0|1,0,0]=3 2755 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [2,0,0,0,0,0|1,0,0]=3 2756 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [2,0,0,0,0,0|0,0,0]=2 2757 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [2,0,0,0,0,0|0,0,0]=2 2758 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [2,0,0,0,0,0|0,0,1]=3 2759 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [2,0,0,0,0,0|1,0,0]=3 2760 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [2,0,0,0,0,0|1,0,0]=3 2761 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [2,0,0,0,0,0|1,0,0]=3 2762 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [2,0,0,0,0,0|1,0,0]=3 2763 B10R1.61 CC(=O)c1nccnc1O 271570a_203496583355_100000099859 [2,0,0,0,0,0|2,0,0]=4 2764 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [2,0,0,0,0,0|1,0,1]=4 2765 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [2,0,0,0,0,0|1,0,1]=4 2766 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [2,0,0,0,0,0|0,0,2]=4 2767 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [2,0,0,0,0,0|2,0,0]=4 2768 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [2,0,0,0,0,0|2,0,0]=4 2769 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [2,0,0,0,0,0|2,0,0]=4 2770 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [2,0,0,0,0,0|1,0,0]=3 2771 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [2,0,0,0,0,0|1,0,0]=3 2772 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [2,0,0,0,0,0|1,0,0]=3 2773 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [2,0,0,0,0,0|2,0,0]=4 2774 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [2,0,0,0,0,0|2,0,0]=4 2775 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [2,0,0,0,0,0|2,0,0]=4 2776 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [2,0,0,0,0,0|2,0,0]=4 2777 B10R1.61 OB(O)c1ccccc1O 271570a_203496583355_100000693059 [2,0,0,0,0,0|1,0,1]=4 2778 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [2,0,0,0,0,0|1,0,0]=3 2779 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [2,0,0,0,0,0|1,0,0]=3 2780 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [2,0,0,0,0,0|1,0,0]=3 2781 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [2,0,0,0,0,0|1,0,0]=3 2782 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [2,0,0,0,0,0|0,0,0]=2 2783 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [2,0,0,0,0,0|0,0,1]=3 2784 B12R0.101 C/C=C/CC(=O)C=CC(=O)OCC 1458a_100000210415_100102629194 [0,1,1,0,0,0|1,0,1]=4 2785 B12R0.101 CC=CCC(=O)C=CC(=O)OCC 1458a_100000210415_100000070051 [0,1,1,0,0,0|1,0,1]=4 2786 B12R0.239 C/C=C/C=CC(=O)CC(=O)OCC 1458a_100000185730_100000188475 [0,1,1,0,0,0|1,0,1]=4 2787 B12R0.2 C=CC=CC(=O)CC(=O)OC(C)C 1458a_100016291481_100011215430 [0,1,1,0,0,0|0,0,2]=4 2788 B12R0.103 C=CC=CC(=O)CC(=O)OCCC 1458a_100016291481_200011215008 [0,1,1,0,0,0|0,0,2]=4 2789 B12R0.353 C=CC=CC(=O)C(C)C(=O)OCC 1458a_100016291481_100011216346 [0,1,1,0,0,0|0,0,2]=4 2790 B12R0.353 C=CC=CC(=O)C(F)C(=O)OCC 1458a_100016291481_100000760018 [0,1,1,0,0,0|0,0,2]=4 2791 B12R1.3 C#CC(OCC)c1ccccc1 34a_100011219616_100000210202 [1,1,0,0,0,0|1,0,1]=4 2792 B12R1.3 C#CC(OCC)c1ccccc1 7a_100011219616_100000210202 [1,1,0,0,0,0|1,0,1]=4 2793 B12R1.3 C=CC(OCC)c1ccccc1 34a_100011215659_100000210202 [1,1,0,0,0,0|1,0,1]=4 2794 B12R1.3 C=CC(OCC)c1ccccc1 7a_100011215659_100000210202 [1,1,0,0,0,0|1,0,1]=4 2795 B12R1.3 CCOC(C#N)c1ccccc1 7a_100011217353_100000210202 [1,1,0,0,0,0|1,0,1]=4 2796 B12R1.3 CCOC(CBr)c1ccccc1 7a_100000185958_100000210202 [1,1,0,0,0,0|1,0,1]=4 2797 B12R1.3 CCOC(CC)c1ccccc1 34a_100000698172_100000210202 [1,1,0,0,0,0|1,0,1]=4 2798 B12R1.3 CCOC(CC)c1ccccc1 7a_100000698172_100000210202 [1,1,0,0,0,0|1,0,1]=4 2799 B12R1.3 CCOC(CN)c1ccccc1 34a_100000210709_100000210202 [1,1,0,0,0,0|1,0,1]=4 2800 B12R1.3 CCO[C@H](CCl)c1ccccc1 34a_100011933945_100000210202 [1,1,0,0,0,0|1,0,1]=4 2801 B12R1.3 CCO[C@H](CCl)c1ccccc1 7a_100011933945_100000210202 [1,1,0,0,0,0|1,0,1]=4 2802 B12R1.16 CC#CC(=O)c1ccc(cc1)O 271570a_203496583355_100153741113 [1,1,0,0,0,0|1,0,1]=4 2803 B12R1.16 CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210303 [1,1,0,0,0,0|1,0,0]=3 2804 B12R1.16 CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210303 [1,1,0,0,0,0|1,0,0]=3 2805 B12R1.16 CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210303 [1,1,0,0,0,0|1,0,0]=3 2806 B12R1.16 CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210303 [1,1,0,0,0,0|1,0,0]=3 2807 B12R1.16 CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210303 [1,1,0,0,0,0|1,0,0]=3 2808 B12R1.16 CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210303 [1,1,0,0,0,0|1,0,0]=3 2809 B12R1.16 CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011267722 [1,1,0,0,0,0|1,0,0]=3 2810 B12R1.16 CCCC(=O)c1ccc(nc1)O 271570a_203496583355_200012185933 [1,1,0,0,0,0|2,0,0]=4 2811 B12R1.16 CCNC(=O)c1ccc(cc1)Br 11a_100015525214_100000185839 [1,1,0,0,0,0|1,0,0]=3 2812 B12R1.16 CCNC(=O)c1ccc(cc1)Br 240690a_100015525214_100000185839 [1,1,0,0,0,0|1,0,0]=3 2813 B12R1.16 CCNC(=O)c1ccc(cc1)Br 527a_100015525214_100000185839 [1,1,0,0,0,0|1,0,0]=3 2814 B12R1.16 CCNC(=O)c1ccc(cc1)C 11a_100015525214_100000188618 [1,1,0,0,0,0|1,0,0]=3 2815 B12R1.16 CCNC(=O)c1ccc(cc1)C 240690a_100015525214_100000188618 [1,1,0,0,0,0|1,0,0]=3 2816 B12R1.16 CCNC(=O)c1ccc(cc1)C 527a_100015525214_100000188618 [1,1,0,0,0,0|1,0,0]=3 2817 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 11a_100015525214_100000210187 [1,1,0,0,0,0|1,0,0]=3 2818 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 240690a_100015525214_100000210187 [1,1,0,0,0,0|1,0,0]=3 2819 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 527a_100015525214_100000210187 [1,1,0,0,0,0|1,0,0]=3 2820 B12R1.16 CCNC(=O)c1ccc(cc1)F 11a_100015525214_100000187176 [1,1,0,0,0,0|1,0,0]=3 2821 B12R1.16 CCNC(=O)c1ccc(cc1)F 240690a_100015525214_100000187176 [1,1,0,0,0,0|1,0,0]=3 2822 B12R1.16 CCNC(=O)c1ccc(cc1)F 527a_100015525214_100000187176 [1,1,0,0,0,0|1,0,0]=3 2823 B12R1.16 CCNC(=O)c1ccc(cc1)I 11a_100015525214_100000187904 [1,1,0,0,0,0|1,0,0]=3 2824 B12R1.16 CCNC(=O)c1ccc(cc1)I 240690a_100015525214_100000187904 [1,1,0,0,0,0|1,0,0]=3 2825 B12R1.16 CCNC(=O)c1ccc(cc1)I 527a_100015525214_100000187904 [1,1,0,0,0,0|1,0,0]=3 2826 B12R1.16 CCNC(=O)c1ccc(cc1)O 240690a_100015525214_100000212099 [1,1,0,0,0,0|1,0,0]=3 2827 B12R1.16 CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155177 [1,1,0,0,0,0|1,0,0]=3 2828 B12R1.16 CCNC(=O)c1ccc(cc1)O 527a_100015525214_100000212099 [1,1,0,0,0,0|1,0,0]=3 2829 B12R1.16 CCNC(=O)c1ccc(cn1)O 271570a_203496583355_200011781264 [1,1,0,0,0,0|2,0,0]=4 2830 B12R1.16 CCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000160145 [1,1,0,0,0,0|2,0,0]=4 2831 B12R1.16 CCOC(=O)c1ccc(cc1)O 271570a_203496583355_100000170077 [1,1,0,0,0,0|0,0,0]=2 2832 B12R1.16 CCOC(=O)c1ccc(cn1)O 271570a_203496583355_100011781174 [1,1,0,0,0,0|1,0,0]=3 2833 B12R1.16 CCOC(=O)c1ccc(nc1)O 271570a_203496583355_100000170224 [1,1,0,0,0,0|1,0,0]=3 2834 B12R1.16 CCOC(=O)c1ccc(nn1)O 271570a_203496583355_100011933454 [1,1,0,0,0,0|2,0,0]=4 2835 B12R1.16 CCOC(=O)c1cnc(cn1)O 271570a_203496583355_100000707868 [1,1,0,0,0,0|2,0,0]=4 2836 B12R1.16 CCOC(=O)c1cnc(nc1)O 271570a_203496583355_100011935661 [1,1,0,0,0,0|2,0,0]=4 2837 B12R1.16 CCOC(=O)c1ncc(cn1)O 271570a_203496583355_100010168878 [1,1,0,0,0,0|2,0,0]=4 2838 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100000745893_100000210202 [1,1,0,0,0,0|1,0,1]=4 2839 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100121572206_100000755118 [1,1,0,0,0,0|1,0,1]=4 2840 B12R1.16 CCOC(C)c1ccc(cc1)Br 7a_100000745893_100000210202 [1,1,0,0,0,0|1,0,1]=4 2841 B12R1.16 CCOC(C)c1ccc(cc1)C 34a_100121572206_100011261388 [1,1,0,0,0,0|1,0,1]=4 2842 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100000181323_100000210202 [1,1,0,0,0,0|1,0,1]=4 2843 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100121572206_100000743420 [1,1,0,0,0,0|1,0,1]=4 2844 B12R1.16 CCOC(C)c1ccc(cc1)F 7a_100000181323_100000210202 [1,1,0,0,0,0|1,0,1]=4 2845 B12R1.16 CCOC(C)c1ccc(cc1)N 34a_100011216399_100000210202 [1,1,0,0,0,0|1,0,1]=4 2846 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210202 [1,1,0,0,0,0|1,0,1]=4 2847 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210202 [1,1,0,0,0,0|1,0,1]=4 2848 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210202 [1,1,0,0,0,0|1,0,1]=4 2849 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210202 [1,1,0,0,0,0|1,0,1]=4 2850 B12R1.16 CNCC(=O)c1ccc(cc1)Br 34a_100102657272_100000188085 [1,1,0,0,0,0|2,0,0]=4 2851 B12R1.16 CNCC(=O)c1ccc(cc1)Br 7a_106832991635_100000188085 [1,1,0,0,0,0|2,0,0]=4 2852 B12R1.16 CNCC(=O)c1ccc(cc1)C 2230a_106832991635_100000211441 [1,1,0,0,0,0|2,0,0]=4 2853 B12R1.16 CNCC(=O)c1ccc(cc1)C 34a_100102657272_100000211441 [1,1,0,0,0,0|2,0,0]=4 2854 B12R1.16 CNCC(=O)c1ccc(cc1)C 7a_106832991635_100000211441 [1,1,0,0,0,0|2,0,0]=4 2855 B12R1.16 CNCC(=O)c1ccc(cc1)Cl 7a_106832991635_100000211071 [1,1,0,0,0,0|2,0,0]=4 2856 B12R1.16 CNCC(=O)c1ccc(cc1)F 7a_106832991635_100000211279 [1,1,0,0,0,0|2,0,0]=4 2857 B12R1.16 CNCC(=O)c1ccc(cc1)I 34a_100102657272_100011216261 [1,1,0,0,0,0|2,0,0]=4 2858 B12R1.16 CNCC(=O)c1ccc(cc1)I 7a_106832991635_100011216261 [1,1,0,0,0,0|2,0,0]=4 2859 B12R1.16 CNCC(=O)c1ccc(cc1)O 34a_100102657272_100009814261 [1,1,0,0,0,0|2,0,0]=4 2860 B12R1.16 CNCC(=O)c1ccc(cc1)O 7a_106832991635_100000018856 [1,1,0,0,0,0|2,0,0]=4 2861 B12R1.16 CNNC(=O)c1ccc(cc1)Br 22a_100016993582_100000185839 [1,1,0,0,0,0|2,0,0]=4 2862 B12R1.16 CNNC(=O)c1ccc(cc1)C 22a_100016993582_100000188618 [1,1,0,0,0,0|2,0,0]=4 2863 B12R1.16 CNNC(=O)c1ccc(cc1)Cl 22a_100016993582_100000210187 [1,1,0,0,0,0|2,0,0]=4 2864 B12R1.16 CNNC(=O)c1ccc(cc1)F 22a_100016993582_100000187176 [1,1,0,0,0,0|2,0,0]=4 2865 B12R1.16 CNNC(=O)c1ccc(cc1)I 22a_100016993582_100000187904 [1,1,0,0,0,0|2,0,0]=4 2866 B12R1.16 CNNC(=O)c1ccc(cc1)O 22a_100016993582_100000212099 [1,1,0,0,0,0|2,0,0]=4 2867 B12R1.16 COCC(=O)c1ccc(cc1)Br 34a_100138415774_100000188085 [1,1,0,0,0,0|2,0,0]=4 2868 B12R1.16 COCC(=O)c1ccc(cc1)C 34a_100138415774_100000211441 [1,1,0,0,0,0|2,0,0]=4 2869 B12R1.16 COCC(=O)c1ccc(cc1)F 34a_100000246311_200000210301 [1,1,0,0,0,0|2,0,0]=4 2870 B12R1.16 COCC(=O)c1ccc(cc1)I 34a_100138415774_100011216261 [1,1,0,0,0,0|2,0,0]=4 2871 B12R1.16 COCC(=O)c1ccc(cc1)O 271570a_203496583355_200011343064 [1,1,0,0,0,0|2,0,0]=4 2872 B12R1.16 COCC(=O)c1ccc(cc1)O 34a_100138415774_100009814261 [1,1,0,0,0,0|2,0,0]=4 2873 B12R1.16 CSCC(=O)c1ccc(cc1)Br 62a_100000188085_200000210301 [1,1,0,0,0,0|2,0,0]=4 2874 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_100000211441_200000210301 [1,1,0,0,0,0|2,0,0]=4 2875 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_200000210301_100000211441 [1,1,0,0,0,0|2,0,0]=4 2876 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_200000210301 [1,1,0,0,0,0|2,0,0]=4 2877 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_200000210301_100000211071 [1,1,0,0,0,0|2,0,0]=4 2878 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_100000211279_200000210301 [1,1,0,0,0,0|2,0,0]=4 2879 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_200000210301_100000211279 [1,1,0,0,0,0|2,0,0]=4 2880 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_100011216261_200000210301 [1,1,0,0,0,0|2,0,0]=4 2881 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_200000210301_100011216261 [1,1,0,0,0,0|2,0,0]=4 2882 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_100009814261_200000210301 [1,1,0,0,0,0|2,0,0]=4 2883 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_200000210301_100009814261 [1,1,0,0,0,0|2,0,0]=4 2884 B12R1.16 Cc1ccc(cc1)C(=O)CCF 1458a_100000188618_100011217306 [1,1,0,0,0,0|2,0,0]=4 2885 B12R1.16 Cc1ccc(cc1)C(=O)CCO 1458a_100000188618_100000211926 [1,1,0,0,0,0|2,0,0]=4 2886 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_100000211441_200025704644 [1,1,0,0,0,0|2,0,0]=4 2887 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000211441 [1,1,0,0,0,0|2,0,0]=4 2888 B12R1.16 O=C(CCF)c1ccc(cc1)Br 1458a_100000185839_100011217306 [1,1,0,0,0,0|2,0,0]=4 2889 B12R1.16 O=C(CCF)c1ccc(cc1)Cl 1458a_100000210187_100011217306 [1,1,0,0,0,0|2,0,0]=4 2890 B12R1.16 O=C(CCF)c1ccc(cc1)F 1458a_100000187176_100011217306 [1,1,0,0,0,0|2,0,0]=4 2891 B12R1.16 O=C(CCF)c1ccc(cc1)I 1458a_100000187904_100011217306 [1,1,0,0,0,0|2,0,0]=4 2892 B12R1.16 O=C(CCF)c1ccc(cc1)O 1458a_100000212099_100011217306 [1,1,0,0,0,0|2,0,0]=4 2893 B12R1.16 O=C(CCO)c1ccc(cc1)Br 1458a_100000185839_100000211926 [1,1,0,0,0,0|2,0,0]=4 2894 B12R1.16 O=C(CCO)c1ccc(cc1)Cl 1458a_100000210187_100000211926 [1,1,0,0,0,0|2,0,0]=4 2895 B12R1.16 O=C(CCO)c1ccc(cc1)F 1458a_100000187176_100000211926 [1,1,0,0,0,0|2,0,0]=4 2896 B12R1.16 O=C(CCO)c1ccc(cc1)I 1458a_100000187904_100000211926 [1,1,0,0,0,0|2,0,0]=4 2897 B12R1.16 O=C(CCO)c1ccc(cc1)O 1458a_100000212099_100000211926 [1,1,0,0,0,0|2,0,0]=4 2898 B12R1.16 [13CH3]OCC(=O)c1ccc(cc1)F 34a_100000246311_200025704644 [1,1,0,0,0,0|2,0,0]=4 2899 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Br 62a_100000188085_200025704644 [1,1,0,0,0,0|2,0,0]=4 2900 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_100000211071_200025704644 [1,1,0,0,0,0|2,0,0]=4 2901 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_200025704644_100000211071 [1,1,0,0,0,0|2,0,0]=4 2902 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_100000211279_200025704644 [1,1,0,0,0,0|2,0,0]=4 2903 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_200025704644_100000211279 [1,1,0,0,0,0|2,0,0]=4 2904 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_100011216261_200025704644 [1,1,0,0,0,0|2,0,0]=4 2905 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_200025704644_100011216261 [1,1,0,0,0,0|2,0,0]=4 2906 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_100009814261_200025704644 [1,1,0,0,0,0|2,0,0]=4 2907 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_200025704644_100009814261 [1,1,0,0,0,0|2,0,0]=4 2908 B12R1.16 [2H]C(OCC)c1ccc(cc1)F 34a_217856618577_100000210202 [1,1,0,0,0,0|1,0,1]=4 2909 B12R1.16 [2H]C(OCC)c1ccc(cc1)F 7a_217856618577_100000210202 [1,1,0,0,0,0|1,0,1]=4 2910 B12R1.17 CCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210303 [1,1,0,0,0,0|1,0,0]=3 2911 B12R1.17 CCCC(=O)c1cccc(c1)C 1458a_100000189346_100000210303 [1,1,0,0,0,0|1,0,0]=3 2912 B12R1.17 CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210303 [1,1,0,0,0,0|1,0,0]=3 2913 B12R1.17 CCCC(=O)c1cccc(c1)F 1458a_100000210950_100000210303 [1,1,0,0,0,0|1,0,0]=3 2914 B12R1.17 CCCC(=O)c1cccc(c1)I 1458a_100000184098_100000210303 [1,1,0,0,0,0|1,0,0]=3 2915 B12R1.17 CCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210303 [1,1,0,0,0,0|1,0,0]=3 2916 B12R1.17 CCNC(=O)c1cc(ccn1)O 271570a_203496583355_100000194128 [1,1,0,0,0,0|2,0,0]=4 2917 B12R1.17 CCNC(=O)c1cccc(c1)Br 11a_100015525214_100000210664 [1,1,0,0,0,0|1,0,0]=3 2918 B12R1.17 CCNC(=O)c1cccc(c1)Br 240690a_100015525214_100000210664 [1,1,0,0,0,0|1,0,0]=3 2919 B12R1.17 CCNC(=O)c1cccc(c1)Br 527a_100015525214_100000210664 [1,1,0,0,0,0|1,0,0]=3 2920 B12R1.17 CCNC(=O)c1cccc(c1)C 11a_100015525214_100000189346 [1,1,0,0,0,0|1,0,0]=3 2921 B12R1.17 CCNC(=O)c1cccc(c1)C 240690a_100015525214_100000189346 [1,1,0,0,0,0|1,0,0]=3 2922 B12R1.17 CCNC(=O)c1cccc(c1)C 527a_100015525214_100000189346 [1,1,0,0,0,0|1,0,0]=3 2923 B12R1.17 CCNC(=O)c1cccc(c1)Cl 11a_100015525214_100000210390 [1,1,0,0,0,0|1,0,0]=3 2924 B12R1.17 CCNC(=O)c1cccc(c1)Cl 240690a_100015525214_100000210390 [1,1,0,0,0,0|1,0,0]=3 2925 B12R1.17 CCNC(=O)c1cccc(c1)Cl 527a_100015525214_100000210390 [1,1,0,0,0,0|1,0,0]=3 2926 B12R1.17 CCNC(=O)c1cccc(c1)F 11a_100015525214_100000210950 [1,1,0,0,0,0|1,0,0]=3 2927 B12R1.17 CCNC(=O)c1cccc(c1)F 240690a_100015525214_100000210950 [1,1,0,0,0,0|1,0,0]=3 2928 B12R1.17 CCNC(=O)c1cccc(c1)F 527a_100015525214_100000210950 [1,1,0,0,0,0|1,0,0]=3 2929 B12R1.17 CCNC(=O)c1cccc(c1)I 11a_100015525214_100000184098 [1,1,0,0,0,0|1,0,0]=3 2930 B12R1.17 CCNC(=O)c1cccc(c1)I 240690a_100015525214_100000184098 [1,1,0,0,0,0|1,0,0]=3 2931 B12R1.17 CCNC(=O)c1cccc(c1)I 527a_100015525214_100000184098 [1,1,0,0,0,0|1,0,0]=3 2932 B12R1.17 CCNC(=O)c1cccc(c1)O 240690a_100015525214_100000183914 [1,1,0,0,0,0|1,0,0]=3 2933 B12R1.17 CCNC(=O)c1cccc(c1)O 271570a_203496583355_100000155180 [1,1,0,0,0,0|1,0,0]=3 2934 B12R1.17 CCNC(=O)c1cccc(c1)O 527a_100015525214_100000183914 [1,1,0,0,0,0|1,0,0]=3 2935 B12R1.17 CCNC(=O)c1ccnc(c1)O 271570a_203496583355_100000229823 [1,1,0,0,0,0|2,0,0]=4 2936 B12R1.17 CCNC(=O)c1cncc(c1)O 271570a_203496583355_200000155184 [1,1,0,0,0,0|2,0,0]=4 2937 B12R1.17 CCOC(=O)c1cc(ccn1)O 271570a_203496583355_100010210110 [1,1,0,0,0,0|1,0,0]=3 2938 B12R1.17 CCOC(=O)c1cc(ncn1)O 271570a_203496583355_100009878719 [1,1,0,0,0,0|2,0,0]=4 2939 B12R1.17 CCOC(=O)c1cccc(c1)O 271570a_203496583355_100000170211 [1,1,0,0,0,0|0,0,0]=2 2940 B12R1.17 CCOC(=O)c1cccc(n1)O 271570a_203496583355_100000695914 [1,1,0,0,0,0|1,0,0]=3 2941 B12R1.17 CCOC(=O)c1ccnc(c1)O 271570a_203496583355_100011213083 [1,1,0,0,0,0|1,0,0]=3 2942 B12R1.17 CCOC(=O)c1ccnc(n1)O 271570a_203496583355_100000087789 [1,1,0,0,0,0|2,0,0]=4 2943 B12R1.17 CCOC(=O)c1cncc(c1)O 271570a_203496583355_100000170250 [1,1,0,0,0,0|1,0,0]=3 2944 B12R1.17 CCOC(=O)c1cncc(n1)O 271570a_203496583355_100012185986 [1,1,0,0,0,0|2,0,0]=4 2945 B12R1.17 CCOC(=O)c1cnnc(c1)O 271570a_203496583355_100009853686 [1,1,0,0,0,0|2,0,0]=4 2946 B12R1.17 CCOC(C)c1cccc(c1)Br 34a_100000246457_100000210202 [1,1,0,0,0,0|1,0,1]=4 2947 B12R1.17 CCOC(C)c1cccc(c1)Br 7a_100000246457_100000210202 [1,1,0,0,0,0|1,0,1]=4 2948 B12R1.17 CCOC(C)c1cccc(c1)C 34a_100000757818_100000210202 [1,1,0,0,0,0|1,0,1]=4 2949 B12R1.17 CCOC(C)c1cccc(c1)C 7a_100000757818_100000210202 [1,1,0,0,0,0|1,0,1]=4 2950 B12R1.17 CCOC(C)c1cccc(c1)F 34a_100000744526_100000210202 [1,1,0,0,0,0|1,0,1]=4 2951 B12R1.17 CCOC(C)c1cccc(c1)F 7a_100000744526_100000210202 [1,1,0,0,0,0|1,0,1]=4 2952 B12R1.17 CCOC(C)c1cccc(c1)I 34a_100013085317_100000210202 [1,1,0,0,0,0|1,0,1]=4 2953 B12R1.17 CCOC(C)c1cccc(c1)I 7a_100013085317_100000210202 [1,1,0,0,0,0|1,0,1]=4 2954 B12R1.17 CCOC(C)c1cccc(c1)N 34a_100011217120_100000210202 [1,1,0,0,0,0|1,0,1]=4 2955 B12R1.17 CCOC(C)c1cccc(c1)N 7a_100011217120_100000210202 [1,1,0,0,0,0|1,0,1]=4 2956 B12R1.17 CCO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210202 [1,1,0,0,0,0|1,0,1]=4 2957 B12R1.17 CCO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210202 [1,1,0,0,0,0|1,0,1]=4 2958 B12R1.17 CNCC(=O)c1cccc(c1)Br 2230a_106832991635_100000212080 [1,1,0,0,0,0|2,0,0]=4 2959 B12R1.17 CNCC(=O)c1cccc(c1)Br 34a_100102657272_100000212080 [1,1,0,0,0,0|2,0,0]=4 2960 B12R1.17 CNCC(=O)c1cccc(c1)Br 7a_106832991635_100000212080 [1,1,0,0,0,0|2,0,0]=4 2961 B12R1.17 CNCC(=O)c1cccc(c1)C 2230a_106832991635_100000739480 [1,1,0,0,0,0|2,0,0]=4 2962 B12R1.17 CNCC(=O)c1cccc(c1)C 34a_100102657272_100000739480 [1,1,0,0,0,0|2,0,0]=4 2963 B12R1.17 CNCC(=O)c1cccc(c1)C 7a_106832991635_100000739480 [1,1,0,0,0,0|2,0,0]=4 2964 B12R1.17 CNCC(=O)c1cccc(c1)Cl 2230a_106832991635_100000211444 [1,1,0,0,0,0|2,0,0]=4 2965 B12R1.17 CNCC(=O)c1cccc(c1)Cl 34a_100102657272_100000211444 [1,1,0,0,0,0|2,0,0]=4 2966 B12R1.17 CNCC(=O)c1cccc(c1)Cl 7a_106832991635_100000211444 [1,1,0,0,0,0|2,0,0]=4 2967 B12R1.17 CNCC(=O)c1cccc(c1)F 2230a_106832991635_100000215616 [1,1,0,0,0,0|2,0,0]=4 2968 B12R1.17 CNCC(=O)c1cccc(c1)F 34a_100102657272_100000215616 [1,1,0,0,0,0|2,0,0]=4 2969 B12R1.17 CNCC(=O)c1cccc(c1)O 34a_100102657272_100009813753 [1,1,0,0,0,0|2,0,0]=4 2970 B12R1.17 CNCC(=O)c1cccc(c1)O 7a_106832991635_100009813753 [1,1,0,0,0,0|2,0,0]=4 2971 B12R1.17 CNNC(=O)c1cccc(c1)Br 22a_100016993582_100000210664 [1,1,0,0,0,0|2,0,0]=4 2972 B12R1.17 CNNC(=O)c1cccc(c1)C 22a_100016993582_100000189346 [1,1,0,0,0,0|2,0,0]=4 2973 B12R1.17 CNNC(=O)c1cccc(c1)Cl 22a_100016993582_100000210390 [1,1,0,0,0,0|2,0,0]=4 2974 B12R1.17 CNNC(=O)c1cccc(c1)F 22a_100016993582_100000210950 [1,1,0,0,0,0|2,0,0]=4 2975 B12R1.17 CNNC(=O)c1cccc(c1)I 22a_100016993582_100000184098 [1,1,0,0,0,0|2,0,0]=4 2976 B12R1.17 CNNC(=O)c1cccc(c1)O 22a_100016993582_100000183914 [1,1,0,0,0,0|2,0,0]=4 2977 B12R1.17 COCC(=O)c1cccc(c1)Br 34a_100138415774_100000212080 [1,1,0,0,0,0|2,0,0]=4 2978 B12R1.17 COCC(=O)c1cccc(c1)C 34a_100138415774_100000739480 [1,1,0,0,0,0|2,0,0]=4 2979 B12R1.17 COCC(=O)c1cccc(c1)Cl 34a_100138415774_100000211444 [1,1,0,0,0,0|2,0,0]=4 2980 B12R1.17 COCC(=O)c1cccc(c1)Cl 7a_200011592804_200000210301 [1,1,0,0,0,0|2,0,0]=4 2981 B12R1.17 COCC(=O)c1cccc(c1)F 34a_100011592800_200000210301 [1,1,0,0,0,0|2,0,0]=4 2982 B12R1.17 COCC(=O)c1cccc(c1)F 34a_100138415774_100000215616 [1,1,0,0,0,0|2,0,0]=4 2983 B12R1.17 COCC(=O)c1cccc(c1)F 7a_100011592800_200000210301 [1,1,0,0,0,0|2,0,0]=4 2984 B12R1.17 COCC(=O)c1cccc(c1)O 34a_100138415774_100009813753 [1,1,0,0,0,0|2,0,0]=4 2985 B12R1.17 CSCC(=O)c1cccc(c1)Br 62a_100000212080_200000210301 [1,1,0,0,0,0|2,0,0]=4 2986 B12R1.17 CSCC(=O)c1cccc(c1)Br 62a_200000210301_100000212080 [1,1,0,0,0,0|2,0,0]=4 2987 B12R1.17 CSCC(=O)c1cccc(c1)C 62a_100000739480_200000210301 [1,1,0,0,0,0|2,0,0]=4 2988 B12R1.17 CSCC(=O)c1cccc(c1)C 62a_200000210301_100000739480 [1,1,0,0,0,0|2,0,0]=4 2989 B12R1.17 CSCC(=O)c1cccc(c1)Cl 62a_100000211444_200000210301 [1,1,0,0,0,0|2,0,0]=4 2990 B12R1.17 CSCC(=O)c1cccc(c1)Cl 62a_200000210301_100000211444 [1,1,0,0,0,0|2,0,0]=4 2991 B12R1.17 CSCC(=O)c1cccc(c1)F 62a_100000215616_200000210301 [1,1,0,0,0,0|2,0,0]=4 2992 B12R1.17 CSCC(=O)c1cccc(c1)F 62a_200000210301_100000215616 [1,1,0,0,0,0|2,0,0]=4 2993 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_100009813753_200000210301 [1,1,0,0,0,0|2,0,0]=4 2994 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_200000210301_100009813753 [1,1,0,0,0,0|2,0,0]=4 2995 B12R1.17 Cc1cccc(c1)C(=O)CCF 1458a_100000189346_100011217306 [1,1,0,0,0,0|2,0,0]=4 2996 B12R1.17 Cc1cccc(c1)C(=O)CCO 1458a_100000189346_100000211926 [1,1,0,0,0,0|2,0,0]=4 2997 B12R1.17 Cc1cccc(c1)C(=O)CS[13CH3] 62a_100000739480_200025704644 [1,1,0,0,0,0|2,0,0]=4 2998 B12R1.17 Cc1cccc(c1)C(=O)CS[13CH3] 62a_200025704644_100000739480 [1,1,0,0,0,0|2,0,0]=4 2999 B12R1.17 O=C(CCF)c1cccc(c1)Br 1458a_100000210664_100011217306 [1,1,0,0,0,0|2,0,0]=4 3000 B12R1.17 O=C(CCF)c1cccc(c1)Cl 1458a_100000210390_100011217306 [1,1,0,0,0,0|2,0,0]=4 3001 B12R1.17 O=C(CCF)c1cccc(c1)F 1458a_100000210950_100011217306 [1,1,0,0,0,0|2,0,0]=4 3002 B12R1.17 O=C(CCF)c1cccc(c1)I 1458a_100000184098_100011217306 [1,1,0,0,0,0|2,0,0]=4 3003 B12R1.17 O=C(CCF)c1cccc(c1)O 1458a_100000183914_100011217306 [1,1,0,0,0,0|2,0,0]=4 3004 B12R1.17 O=C(CCO)c1cccc(c1)Br 1458a_100000210664_100000211926 [1,1,0,0,0,0|2,0,0]=4 3005 B12R1.17 O=C(CCO)c1cccc(c1)Cl 1458a_100000210390_100000211926 [1,1,0,0,0,0|2,0,0]=4 3006 B12R1.17 O=C(CCO)c1cccc(c1)F 1458a_100000210950_100000211926 [1,1,0,0,0,0|2,0,0]=4 3007 B12R1.17 O=C(CCO)c1cccc(c1)I 1458a_100000184098_100000211926 [1,1,0,0,0,0|2,0,0]=4 3008 B12R1.17 O=C(CCO)c1cccc(c1)O 1458a_100000183914_100000211926 [1,1,0,0,0,0|2,0,0]=4 3009 B12R1.17 [13CH3]OCC(=O)c1cccc(c1)Cl 7a_200011592804_200025704644 [1,1,0,0,0,0|2,0,0]=4 3010 B12R1.17 [13CH3]OCC(=O)c1cccc(c1)F 34a_100011592800_200025704644 [1,1,0,0,0,0|2,0,0]=4 3011 B12R1.17 [13CH3]OCC(=O)c1cccc(c1)F 7a_100011592800_200025704644 [1,1,0,0,0,0|2,0,0]=4 3012 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Br 62a_100000212080_200025704644 [1,1,0,0,0,0|2,0,0]=4 3013 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Br 62a_200025704644_100000212080 [1,1,0,0,0,0|2,0,0]=4 3014 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Cl 62a_100000211444_200025704644 [1,1,0,0,0,0|2,0,0]=4 3015 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Cl 62a_200025704644_100000211444 [1,1,0,0,0,0|2,0,0]=4 3016 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)F 62a_100000215616_200025704644 [1,1,0,0,0,0|2,0,0]=4 3017 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)F 62a_200025704644_100000215616 [1,1,0,0,0,0|2,0,0]=4 3018 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_100009813753_200025704644 [1,1,0,0,0,0|2,0,0]=4 3019 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_200025704644_100009813753 [1,1,0,0,0,0|2,0,0]=4 3020 B12R1.30 C#CCCC(=O)c1ccccc1 1458a_100000185807_100000753159 [1,1,0,0,0,0|1,0,1]=4 3021 B12R1.30 C#CCNC(=O)c1ccccc1 11a_100000212058_100000185807 [1,1,0,0,0,0|1,0,1]=4 3022 B12R1.30 C#CCNC(=O)c1ccccc1 1626a_100000212058_100000185807 [1,1,0,0,0,0|1,0,1]=4 3023 B12R1.30 C#CCNC(=O)c1ccccc1 240690a_100000212058_100000185807 [1,1,0,0,0,0|1,0,1]=4 3024 B12R1.30 C#CCNC(=O)c1ccccc1 527a_100000212058_100000185807 [1,1,0,0,0,0|1,0,1]=4 3025 B12R1.30 C/C=C/CC(=O)c1ccccc1 1458a_100000185807_100102629194 [1,1,0,0,0,0|1,0,1]=4 3026 B12R1.30 C=CCCC(=O)c1ccccc1 1458a_100000185807_100000754431 [1,1,0,0,0,0|1,0,1]=4 3027 B12R1.30 C=CCNC(=O)c1ccccc1 1626a_100020586998_100000185807 [1,1,0,0,0,0|1,0,1]=4 3028 B12R1.30 C=CCNC(=O)c1ccccc1 240690a_100020586998_100000185807 [1,1,0,0,0,0|1,0,1]=4 3029 B12R1.30 C=CCNC(=O)c1ccccc1 527a_100020586998_100000185807 [1,1,0,0,0,0|1,0,1]=4 3030 B12R1.30 CC#CCC(=O)c1ccccc1 1458a_100000185807_100000748600 [1,1,0,0,0,0|1,0,1]=4 3031 B12R1.30 CC(OCCBr)c1ccccc1 34a_100000211926_100000211855 [1,1,0,0,0,0|1,0,1]=4 3032 B12R1.30 CC(OCCN)c1ccccc1 34a_100000210304_100000211855 [1,1,0,0,0,0|1,0,1]=4 3033 B12R1.30 CC=CCC(=O)c1ccccc1 1458a_100000185807_100000070051 [1,1,0,0,0,0|1,0,1]=4 3034 B12R1.30 CC=NNC(=O)c1ccccc1 4a_100000184135_200000210099 [1,1,0,0,0,0|1,0,1]=4 3035 B12R1.30 CCCCC(=O)c1ccccc1 1458a_100000185807_100000210211 [1,1,0,0,0,0|1,0,0]=3 3036 B12R1.30 CCCNC(=O)c1ccccc1 11a_100020643023_100000185807 [1,1,0,0,0,0|1,0,0]=3 3037 B12R1.30 CCCNC(=O)c1ccccc1 1626a_100020643023_100000185807 [1,1,0,0,0,0|1,0,0]=3 3038 B12R1.30 CCCNC(=O)c1ccccc1 240690a_100020643023_100000185807 [1,1,0,0,0,0|1,0,0]=3 3039 B12R1.30 CCCNC(=O)c1ccccc1 527a_100020643023_100000185807 [1,1,0,0,0,0|1,0,0]=3 3040 B12R1.30 CCCOC(C)c1ccccc1 34a_100000210258_100000211855 [1,1,0,0,0,0|1,0,1]=4 3041 B12R1.30 CCCO[C@H](C)c1ccccc1 34a_100000761318_100000210303 [1,1,0,0,0,0|1,0,1]=4 3042 B12R1.30 CCCO[C@H](C)c1ccccc1 7a_100000761318_100000210303 [1,1,0,0,0,0|1,0,1]=4 3043 B12R1.30 CCNN=C(C)c1ccccc1 4a_100000756455_100000185851 [1,1,0,0,0,0|2,0,0]=4 3044 B12R1.30 CCNNC(=O)c1ccccc1 22a_100000756455_100000185807 [1,1,0,0,0,0|1,0,0]=3 3045 B12R1.30 CCOCC(=O)c1ccccn1 34a_100121572206_100000027445 [1,1,0,0,0,0|1,0,0]=3 3046 B12R1.30 CCOCC(C)c1ccccc1 34a_100011215166_100000210202 [1,1,0,0,0,0|1,0,1]=4 3047 B12R1.30 CCOCC(C)c1ccccc1 34a_100121572206_100000756946 [1,1,0,0,0,0|1,0,1]=4 3048 B12R1.30 CCOCC(C)c1ccccc1 7a_100011215166_100000210202 [1,1,0,0,0,0|1,0,1]=4 3049 B12R1.30 CCOCC(O)c1ccccc1 34a_100121572206_100000185958 [1,1,0,0,0,0|0,0,2]=4 3050 B12R1.30 CCOCN(C)c1ccccc1 269982a_100000210012_100000739092 [1,1,0,0,0,0|2,0,0]=4 3051 B12R1.30 CCOC[C@@H](N)c1ccccc1 34a_100000751927_100000210202 [1,1,0,0,0,0|1,0,1]=4 3052 B12R1.30 CCOC[C@@H](O)c1ccccc1 34a_100121572206_100011933945 [1,1,0,0,0,0|0,0,2]=4 3053 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000210202_100000211460 [1,1,0,0,0,0|0,1,0]=3 3054 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000211460_100000210202 [1,1,0,0,0,0|0,1,0]=3 3055 B12R1.30 CCSCC(=O)c1ccccn1 62a_100000027445_100000210202 [1,1,0,0,0,0|1,1,0]=4 3056 B12R1.30 CCSCC(=O)c1ccccn1 62a_100000210202_100000027445 [1,1,0,0,0,0|1,1,0]=4 3057 B12R1.30 CCSCC(=O)c1cccnc1 62a_100000210202_100000757877 [1,1,0,0,0,0|1,1,0]=4 3058 B12R1.30 CCSCC(=O)c1cccnc1 62a_100000757877_100000210202 [1,1,0,0,0,0|1,1,0]=4 3059 B12R1.30 CCSCC(=O)c1ccncc1 62a_100000027454_100000210202 [1,1,0,0,0,0|1,1,0]=4 3060 B12R1.30 CCSCC(=O)c1ccncc1 62a_100000210202_100000027454 [1,1,0,0,0,0|1,1,0]=4 3061 B12R1.30 CCSCS(=O)c1ccccc1 62a_100000210202_100000031784 [1,1,0,0,0,0|1,1,0]=4 3062 B12R1.30 CNCCC(=O)c1ccccc1 2230a_106832991635_100000750707 [1,1,0,0,0,0|1,0,0]=3 3063 B12R1.30 CNCCC(=O)c1ccccc1 7a_106832991635_100000750707 [1,1,0,0,0,0|1,0,0]=3 3064 B12R1.30 CNCCS(=O)c1ccccc1 2230a_106832991635_100000740319 [1,1,0,0,0,0|2,0,0]=4 3065 B12R1.30 CNCCS(=O)c1ccccc1 7a_106832991635_100000740319 [1,1,0,0,0,0|2,0,0]=4 3066 B12R1.30 CNCOC(=O)c1ccccc1 7a_106832991635_100000073877 [1,1,0,0,0,0|0,0,0]=2 3067 B12R1.30 COCCC(=O)c1ccccc1 1458a_100000185807_100000233755 [1,1,0,0,0,0|1,0,0]=3 3068 B12R1.30 CSCCC(=O)c1ccccc1 1458a_100000185807_100000751147 [1,1,0,0,0,0|1,0,0]=3 3069 B12R1.30 CSCCC(=O)c1ccccc1 62a_100000750707_200000210301 [1,1,0,0,0,0|1,0,0]=3 3070 B12R1.30 CSCCC(=O)c1ccccc1 62a_200000210301_100000750707 [1,1,0,0,0,0|1,0,0]=3 3071 B12R1.30 CSCCS(=O)c1ccccc1 62a_200000210301_100000740319 [1,1,0,0,0,0|2,0,0]=4 3072 B12R1.30 CSCOC(=O)c1ccccc1 62a_100000073877_200000210301 [1,1,0,0,0,0|0,0,0]=2 3073 B12R1.30 CSCOC(=O)c1ccccc1 62a_200000210301_100000073877 [1,1,0,0,0,0|0,0,0]=2 3074 B12R1.30 CSCO[C@H](C)c1ccccc1 34a_100000761318_100011218213 [1,1,0,0,0,0|1,0,1]=4 3075 B12R1.30 C[C@@H](OCCF)c1ccccc1 34a_100000761318_100011217306 [1,1,0,0,0,0|1,0,1]=4 3076 B12R1.30 C[C@@H](OCCF)c1ccccc1 7a_100000761318_100011217306 [1,1,0,0,0,0|1,0,1]=4 3077 B12R1.30 C[C@@H](OCCO)c1ccccc1 34a_100000761318_100000211926 [1,1,0,0,0,0|1,0,1]=4 3078 B12R1.30 C[C@@H](OCCO)c1ccccc1 7a_100000761318_100000211926 [1,1,0,0,0,0|1,0,1]=4 3079 B12R1.30 N#CCCC(=O)c1ccccc1 1458a_100000185807_100011215226 [1,1,0,0,0,0|1,0,1]=4 3080 B12R1.30 N#CCNC(=O)c1ccccc1 1626a_100000734998_100000185807 [1,1,0,0,0,0|1,0,1]=4 3081 B12R1.30 N#CCNC(=O)c1ccccc1 527a_100000734998_100000185807 [1,1,0,0,0,0|1,0,1]=4 3082 B12R1.30 O=C(CCCF)c1ccccc1 1458a_100000185807_100011934791 [1,1,0,0,0,0|1,0,0]=3 3083 B12R1.30 O=C(CCCO)c1ccccc1 1458a_100000185807_100011215043 [1,1,0,0,0,0|1,0,0]=3 3084 B12R1.30 O=C(CSCF)c1ccccc1 62a_100000211460_100015361967 [1,1,0,0,0,0|1,1,0]=4 3085 B12R1.30 O=C(CSCF)c1ccccc1 62a_100015361967_100000211460 [1,1,0,0,0,0|1,1,0]=4 3086 B12R1.30 O=C(NCCF)c1ccccc1 11a_100000724931_100000185807 [1,1,0,0,0,0|1,0,0]=3 3087 B12R1.30 O=C(NCCF)c1ccccc1 1626a_100000724931_100000185807 [1,1,0,0,0,0|1,0,0]=3 3088 B12R1.30 O=C(NCCF)c1ccccc1 240690a_100000724931_100000185807 [1,1,0,0,0,0|1,0,0]=3 3089 B12R1.30 O=C(NCCF)c1ccccc1 527a_100000724931_100000185807 [1,1,0,0,0,0|1,0,0]=3 3090 B12R1.30 O=C(NCCO)c1ccccc1 240690a_100000210304_100000185807 [1,1,0,0,0,0|1,0,0]=3 3091 B12R1.30 O=C(NCCO)c1ccccc1 527a_100000210304_100000185807 [1,1,0,0,0,0|1,0,0]=3 3092 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_100000750707_200025704644 [1,1,0,0,0,0|1,0,0]=3 3093 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_200025704644_100000750707 [1,1,0,0,0,0|1,0,0]=3 3094 B12R1.30 [13CH3]SCCS(=O)c1ccccc1 62a_200025704644_100000740319 [1,1,0,0,0,0|2,0,0]=4 3095 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_100000073877_200025704644 [1,1,0,0,0,0|0,0,0]=2 3096 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_200025704644_100000073877 [1,1,0,0,0,0|0,0,0]=2 3097 B12R1.34 C=C(C(=O)CC)c1ccccc1 1458a_100000065200_100000210202 [1,1,0,0,0,0|2,0,0]=4 3098 B12R1.34 CC(S[13CH3])C(=O)c1ccccc1 62a_100000239700_200025704644 [1,1,0,0,0,0|2,0,0]=4 3099 B12R1.34 CC(S[13CH3])C(=O)c1ccccc1 62a_200025704644_100000239700 [1,1,0,0,0,0|2,0,0]=4 3100 B12R1.34 CCC(C)C(=O)c1ccccc1 1458a_100000185807_100000758301 [1,1,0,0,0,0|1,0,0]=3 3101 B12R1.34 CCN(C)C(=O)c1ccccc1 11a_100000225621_100000185807 [1,1,0,0,0,0|1,0,0]=3 3102 B12R1.34 CCN(C)C(=O)c1ccccc1 1626a_100000225621_100000185807 [1,1,0,0,0,0|1,0,0]=3 3103 B12R1.34 CCN(C)C(=O)c1ccccc1 240690a_100000225621_100000185807 [1,1,0,0,0,0|1,0,0]=3 3104 B12R1.34 CCN(C)C(=O)c1ccccc1 527a_100000225621_100000185807 [1,1,0,0,0,0|1,0,0]=3 3105 B12R1.34 CNC(C)C(=O)c1ccccc1 2230a_106832991635_100000239700 [1,1,0,0,0,0|2,0,0]=4 3106 B12R1.34 CNC(C)C(=O)c1ccccc1 7a_106832991635_100000239700 [1,1,0,0,0,0|2,0,0]=4 3107 B12R1.34 CSC(C)C(=O)c1ccccc1 62a_100000239700_200000210301 [1,1,0,0,0,0|2,0,0]=4 3108 B12R1.34 CSC(C)C(=O)c1ccccc1 62a_200000210301_100000239700 [1,1,0,0,0,0|2,0,0]=4 3109 B12R1.39 CCNS(=O)(=O)c1ccccc1 270084a_100015525214_100000210345 [1,1,0,0,0,0|2,0,0]=4 3110 B12R1.39 CCNS(=O)(=O)c1ccccc1 274078a_100015525214_100000210345 [1,1,0,0,0,0|2,0,0]=4 3111 B12R1.39 CCNS(=O)(=O)c1ccccc1 40a_100015525214_100000032697 [1,1,0,0,0,0|2,0,0]=4 3112 B12R1.39 CCOC(C)(C)c1ccccc1 7a_100000694644_100000210202 [1,1,0,0,0,0|1,0,1]=4 3113 B12R1.107 C=C(C)CC(=O)c1ccccc1 1458a_100000185807_100000748629 [1,1,0,0,0,0|1,0,1]=4 3114 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [1,1,0,0,0,0|1,0,1]=4 3115 B12R1.107 CC(C)CC(=O)c1ccccc1 1458a_100000185807_100000210624 [1,1,0,0,0,0|1,0,0]=3 3116 B12R1.107 CC(C)NC(=O)c1ccccc1 11a_100138425928_100000185807 [1,1,0,0,0,0|1,0,0]=3 3117 B12R1.107 CC(C)NC(=O)c1ccccc1 1626a_100138425928_100000185807 [1,1,0,0,0,0|1,0,0]=3 3118 B12R1.107 CC(C)NC(=O)c1ccccc1 240690a_100138425928_100000185807 [1,1,0,0,0,0|1,0,0]=3 3119 B12R1.107 CC(C)NC(=O)c1ccccc1 527a_100138425928_100000185807 [1,1,0,0,0,0|1,0,0]=3 3120 B12R1.107 CC(C)OC(C)c1ccccc1 34a_100000212225_100000211855 [1,1,0,0,0,0|1,0,1]=4 3121 B12R1.107 CC(C)O[C@H](C)c1ccccc1 34a_100000761318_100000210206 [1,1,0,0,0,0|1,0,1]=4 3122 B12R1.107 CC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000210206 [1,1,0,0,0,0|1,0,1]=4 3123 B12R1.107 CC(O)CC(=O)c1ccccc1 1458a_100000185807_100011218427 [1,1,0,0,0,0|1,0,0]=3 3124 B12R1.107 CN(C)CC(=O)c1ccccc1 269982a_100102631434_100000211460 [1,1,0,0,0,0|2,0,0]=4 3125 B12R1.107 O=C(CC(F)F)c1ccccc1 1458a_100000185807_100011934356 [1,1,0,0,0,0|2,0,0]=4 3126 B12R1.25 CCCCc1cccc(c1O)Br 271570a_100020621405_100010084509 [1,1,0,0,0,0|1,0,1]=4 3127 B12R1.25 CCCCc1cccc(c1O)C 271570a_100020621405_100009817157 [1,1,0,0,0,0|1,0,1]=4 3128 B12R1.25 CCCCc1cccc(c1O)Cl 271570a_100020621405_100010202889 [1,1,0,0,0,0|1,0,1]=4 3129 B12R1.25 CCCCc1cccc(c1O)F 271570a_100020621405_100009813666 [1,1,0,0,0,0|1,0,1]=4 3130 B12R1.25 CCCCc1cccc(c1O)N 271570a_100020621405_100011934915 [1,1,0,0,0,0|1,0,1]=4 3131 B12R1.25 CCCCc1cccc(c1O)O 271570a_100020621405_100009815950 [1,1,0,0,0,0|1,0,1]=4 3132 B12R1.25 CCCNc1cccc(c1O)Br 34a_100011934915_100000210303 [1,1,0,0,0,0|2,0,0]=4 3133 B12R1.25 CCCNc1cccc(c1O)C 34a_100000756359_100000210303 [1,1,0,0,0,0|2,0,0]=4 3134 B12R1.25 CCCNc1cccc(c1O)Cl 34a_100000754742_100000210303 [1,1,0,0,0,0|2,0,0]=4 3135 B12R1.25 CCCNc1cccc(c1O)F 34a_100011934987_100000210303 [1,1,0,0,0,0|2,0,0]=4 3136 B12R1.25 CCCSc1cccc(c1O)Br 62a_100000210303_100010084509 [1,1,0,0,0,0|2,0,0]=4 3137 B12R1.25 CCCSc1cccc(c1O)Br 62a_100010084509_100000210303 [1,1,0,0,0,0|2,0,0]=4 3138 B12R1.25 CCCSc1cccc(c1O)C 62a_100000210303_100009817157 [1,1,0,0,0,0|2,0,0]=4 3139 B12R1.25 CCCSc1cccc(c1O)C 62a_100009817157_100000210303 [1,1,0,0,0,0|2,0,0]=4 3140 B12R1.25 CCCSc1cccc(c1O)Cl 62a_100000210303_100010202889 [1,1,0,0,0,0|2,0,0]=4 3141 B12R1.25 CCCSc1cccc(c1O)Cl 62a_100010202889_100000210303 [1,1,0,0,0,0|2,0,0]=4 3142 B12R1.25 CCCSc1cccc(c1O)F 62a_100000210303_100009813666 [1,1,0,0,0,0|2,0,0]=4 3143 B12R1.25 CCCSc1cccc(c1O)F 62a_100009813666_100000210303 [1,1,0,0,0,0|2,0,0]=4 3144 B12R1.25 CCCSc1cccc(c1O)N 62a_100000210303_100010084371 [1,1,0,0,0,0|2,0,0]=4 3145 B12R1.25 CCCSc1cccc(c1O)N 62a_100011934915_100000210303 [1,1,0,0,0,0|2,0,0]=4 3146 B12R1.25 CCCSc1cccc(c1O)O 62a_100000210303_100009815950 [1,1,0,0,0,0|2,0,0]=4 3147 B12R1.25 CCNCc1cccc(c1O)C 34a_100020639391_100000210202 [1,1,0,0,0,0|1,0,1]=4 3148 B12R1.25 CCOCc1cccc(c1Br)C 34a_100011659289_100000210202 [1,1,0,0,0,0|1,0,1]=4 3149 B12R1.25 CCOCc1cccc(c1Br)C 34a_100121572206_200012349612 [1,1,0,0,0,0|1,0,1]=4 3150 B12R1.25 CCOCc1cccc(c1Br)C 7a_100011659289_100000210202 [1,1,0,0,0,0|1,0,1]=4 3151 B12R1.25 CCOCc1cccc(c1Br)Cl 34a_100010168166_100000210202 [1,1,0,0,0,0|1,0,1]=4 3152 B12R1.25 CCOCc1cccc(c1Br)Cl 34a_100121572206_100010145525 [1,1,0,0,0,0|1,0,1]=4 3153 B12R1.25 CCOCc1cccc(c1Br)Cl 7a_100010168166_100000210202 [1,1,0,0,0,0|1,0,1]=4 3154 B12R1.25 CCOCc1cccc(c1Br)F 34a_100012351117_100000210202 [1,1,0,0,0,0|1,0,1]=4 3155 B12R1.25 CCOCc1cccc(c1Br)F 34a_100121572206_100012351116 [1,1,0,0,0,0|1,0,1]=4 3156 B12R1.25 CCOCc1cccc(c1Br)F 7a_100012351117_100000210202 [1,1,0,0,0,0|1,0,1]=4 3157 B12R1.25 CCOCc1cccc(c1Br)I 34a_100010240205_100000210202 [1,1,0,0,0,0|1,0,1]=4 3158 B12R1.25 CCOCc1cccc(c1Br)I 34a_100121572206_100010254545 [1,1,0,0,0,0|1,0,1]=4 3159 B12R1.25 CCOCc1cccc(c1Br)I 7a_100010240205_100000210202 [1,1,0,0,0,0|1,0,1]=4 3160 B12R1.25 CCOCc1cccc(c1C)Br 34a_100000694458_100000210202 [1,1,0,0,0,0|1,0,1]=4 3161 B12R1.25 CCOCc1cccc(c1C)Br 34a_100121572206_100000694682 [1,1,0,0,0,0|1,0,1]=4 3162 B12R1.25 CCOCc1cccc(c1C)Br 7a_100000694458_100000210202 [1,1,0,0,0,0|1,0,1]=4 3163 B12R1.25 CCOCc1cccc(c1C)C 34a_100011219135_100000210202 [1,1,0,0,0,0|1,0,1]=4 3164 B12R1.25 CCOCc1cccc(c1C)C 34a_100121572206_100011273979 [1,1,0,0,0,0|1,0,1]=4 3165 B12R1.25 CCOCc1cccc(c1C)C 7a_100011219135_100000210202 [1,1,0,0,0,0|1,0,1]=4 3166 B12R1.25 CCOCc1cccc(c1C)Cl 34a_100012000165_100000210202 [1,1,0,0,0,0|1,0,1]=4 3167 B12R1.25 CCOCc1cccc(c1C)Cl 34a_100121572206_100012186920 [1,1,0,0,0,0|1,0,1]=4 3168 B12R1.25 CCOCc1cccc(c1C)Cl 7a_100012000165_100000210202 [1,1,0,0,0,0|1,0,1]=4 3169 B12R1.25 CCOCc1cccc(c1C)F 34a_100000042775_100000210202 [1,1,0,0,0,0|1,0,1]=4 3170 B12R1.25 CCOCc1cccc(c1C)F 34a_100121572206_100009813626 [1,1,0,0,0,0|1,0,1]=4 3171 B12R1.25 CCOCc1cccc(c1C)F 7a_100000042775_100000210202 [1,1,0,0,0,0|1,0,1]=4 3172 B12R1.25 CCOCc1cccc(c1C)I 34a_100010150139_100000210202 [1,1,0,0,0,0|1,0,1]=4 3173 B12R1.25 CCOCc1cccc(c1C)I 34a_100121572206_100010150147 [1,1,0,0,0,0|1,0,1]=4 3174 B12R1.25 CCOCc1cccc(c1C)I 7a_100010150139_100000210202 [1,1,0,0,0,0|1,0,1]=4 3175 B12R1.25 CCOCc1cccc(c1C)N 34a_102495339961_100000210202 [1,1,0,0,0,0|1,0,1]=4 3176 B12R1.25 CCOCc1cccc(c1C)N 7a_102495339961_100000210202 [1,1,0,0,0,0|1,0,1]=4 3177 B12R1.25 CCOCc1cccc(c1Cl)Br 34a_100012351182_100000210202 [1,1,0,0,0,0|1,0,1]=4 3178 B12R1.25 CCOCc1cccc(c1Cl)Br 34a_100121572206_100012349491 [1,1,0,0,0,0|1,0,1]=4 3179 B12R1.25 CCOCc1cccc(c1Cl)Br 7a_100012351182_100000210202 [1,1,0,0,0,0|1,0,1]=4 3180 B12R1.25 CCOCc1cccc(c1Cl)C 34a_100000710031_100000210202 [1,1,0,0,0,0|1,0,1]=4 3181 B12R1.25 CCOCc1cccc(c1Cl)C 7a_100000710031_100000210202 [1,1,0,0,0,0|1,0,1]=4 3182 B12R1.25 CCOCc1cccc(c1Cl)Cl 34a_100000720469_100000210202 [1,1,0,0,0,0|1,0,1]=4 3183 B12R1.25 CCOCc1cccc(c1Cl)Cl 34a_100121572206_100000723366 [1,1,0,0,0,0|1,0,1]=4 3184 B12R1.25 CCOCc1cccc(c1Cl)Cl 7a_100000720469_100000210202 [1,1,0,0,0,0|1,0,1]=4 3185 B12R1.25 CCOCc1cccc(c1Cl)F 34a_100000696319_100000210202 [1,1,0,0,0,0|1,0,1]=4 3186 B12R1.25 CCOCc1cccc(c1Cl)F 34a_100121572206_100000696688 [1,1,0,0,0,0|1,0,1]=4 3187 B12R1.25 CCOCc1cccc(c1Cl)F 7a_100000696319_100000210202 [1,1,0,0,0,0|1,0,1]=4 3188 B12R1.25 CCOCc1cccc(c1F)Br 34a_100011935076_100000210202 [1,1,0,0,0,0|1,0,1]=4 3189 B12R1.25 CCOCc1cccc(c1F)Br 34a_100121572206_100012356506 [1,1,0,0,0,0|1,0,1]=4 3190 B12R1.25 CCOCc1cccc(c1F)Br 7a_100011935076_100000210202 [1,1,0,0,0,0|1,0,1]=4 3191 B12R1.25 CCOCc1cccc(c1F)C 34a_100121572206_100011216058 [1,1,0,0,0,0|1,0,1]=4 3192 B12R1.25 CCOCc1cccc(c1F)C 34a_200011219517_100000210202 [1,1,0,0,0,0|1,0,1]=4 3193 B12R1.25 CCOCc1cccc(c1F)C 7a_200011219517_100000210202 [1,1,0,0,0,0|1,0,1]=4 3194 B12R1.25 CCOCc1cccc(c1F)Cl 34a_100011216988_100000210202 [1,1,0,0,0,0|1,0,1]=4 3195 B12R1.25 CCOCc1cccc(c1F)Cl 34a_100121572206_100000716733 [1,1,0,0,0,0|1,0,1]=4 3196 B12R1.25 CCOCc1cccc(c1F)Cl 7a_100011216988_100000210202 [1,1,0,0,0,0|1,0,1]=4 3197 B12R1.25 CCOCc1cccc(c1F)F 34a_100011218644_100000210202 [1,1,0,0,0,0|1,0,1]=4 3198 B12R1.25 CCOCc1cccc(c1F)F 34a_100121572206_100000217499 [1,1,0,0,0,0|1,0,1]=4 3199 B12R1.25 CCOCc1cccc(c1F)F 7a_100011218644_100000210202 [1,1,0,0,0,0|1,0,1]=4 3200 B12R1.25 CCOCc1cccc(c1F)I 34a_200010235739_100000210202 [1,1,0,0,0,0|1,0,1]=4 3201 B12R1.25 CCOCc1cccc(c1F)I 7a_200010235739_100000210202 [1,1,0,0,0,0|1,0,1]=4 3202 B12R1.25 CCOCc1cccc(c1F)N 34a_100012023829_100000210202 [1,1,0,0,0,0|1,0,1]=4 3203 B12R1.25 CCOCc1cccc(c1I)Br 34a_100010146604_100000210202 [1,1,0,0,0,0|1,0,1]=4 3204 B12R1.25 CCOCc1cccc(c1I)Br 7a_100010146604_100000210202 [1,1,0,0,0,0|1,0,1]=4 3205 B12R1.25 CCOCc1cccc(c1I)C 34a_100012349780_100000210202 [1,1,0,0,0,0|1,0,1]=4 3206 B12R1.25 CCOCc1cccc(c1I)C 7a_100012349780_100000210202 [1,1,0,0,0,0|1,0,1]=4 3207 B12R1.25 CCOCc1cccc(c1I)F 34a_100000692438_100000210202 [1,1,0,0,0,0|1,0,1]=4 3208 B12R1.25 CCOCc1cccc(c1I)F 34a_100121572206_100010149603 [1,1,0,0,0,0|1,0,1]=4 3209 B12R1.25 CCOCc1cccc(c1I)F 7a_100000692438_100000210202 [1,1,0,0,0,0|1,0,1]=4 3210 B12R1.25 CCOCc1cccc(c1N)Br 34a_100012349457_100000210202 [1,1,0,0,0,0|1,0,1]=4 3211 B12R1.25 CCOCc1cccc(c1N)C 34a_100011215590_100000210202 [1,1,0,0,0,0|1,0,1]=4 3212 B12R1.25 CCOCc1cccc(c1N)Cl 34a_100012182729_100000210202 [1,1,0,0,0,0|1,0,1]=4 3213 B12R1.25 CCOCc1cccc(c1N)F 34a_100000692437_100000210202 [1,1,0,0,0,0|1,0,1]=4 3214 B12R1.69 CCCCc1ccc(cc1O)Br 271570a_100020621405_100012344904 [1,1,0,0,0,0|1,0,1]=4 3215 B12R1.69 CCCCc1ccc(cc1O)C 271570a_100020621405_100012002257 [1,1,0,0,0,0|1,0,1]=4 3216 B12R1.69 CCCCc1ccc(cc1O)Cl 271570a_100020621405_100000050036 [1,1,0,0,0,0|1,0,1]=4 3217 B12R1.69 CCCCc1ccc(cc1O)F 271570a_100020621405_100000690578 [1,1,0,0,0,0|1,0,1]=4 3218 B12R1.69 CCCCc1ccc(cc1O)O 271570a_100020621405_100009813921 [1,1,0,0,0,0|1,0,1]=4 3219 B12R1.69 CCCNc1ccc(cc1O)Br 34a_100000739049_100000210303 [1,1,0,0,0,0|2,0,0]=4 3220 B12R1.69 CCCNc1ccc(cc1O)C 34a_100000211527_100000210303 [1,1,0,0,0,0|2,0,0]=4 3221 B12R1.69 CCCNc1ccc(cc1O)Cl 34a_100000185728_100000210303 [1,1,0,0,0,0|2,0,0]=4 3222 B12R1.69 CCCNc1ccc(cc1O)F 34a_100000753323_100000210303 [1,1,0,0,0,0|2,0,0]=4 3223 B12R1.69 CCCNc1ccc(cc1O)O 34a_100000106777_100000210303 [1,1,0,0,0,0|2,0,0]=4 3224 B12R1.69 CCCOc1ccc(cc1O)F 271570a_203496583355_200000171698 [1,1,0,0,0,0|2,0,0]=4 3225 B12R1.69 CCCSc1ccc(cc1O)Br 62a_100000210303_100012344904 [1,1,0,0,0,0|2,0,0]=4 3226 B12R1.69 CCCSc1ccc(cc1O)Br 62a_100012344904_100000210303 [1,1,0,0,0,0|2,0,0]=4 3227 B12R1.69 CCCSc1ccc(cc1O)C 62a_100000210303_100012002257 [1,1,0,0,0,0|2,0,0]=4 3228 B12R1.69 CCCSc1ccc(cc1O)C 62a_100012002257_100000210303 [1,1,0,0,0,0|2,0,0]=4 3229 B12R1.69 CCCSc1ccc(cc1O)Cl 62a_100000050036_100000210303 [1,1,0,0,0,0|2,0,0]=4 3230 B12R1.69 CCCSc1ccc(cc1O)Cl 62a_100000210303_100000050036 [1,1,0,0,0,0|2,0,0]=4 3231 B12R1.69 CCCSc1ccc(cc1O)F 62a_100000210303_100000690578 [1,1,0,0,0,0|2,0,0]=4 3232 B12R1.69 CCCSc1ccc(cc1O)F 62a_100000690578_100000210303 [1,1,0,0,0,0|2,0,0]=4 3233 B12R1.69 CCCSc1ccc(cc1O)O 62a_100000210303_100009813921 [1,1,0,0,0,0|2,0,0]=4 3234 B12R1.69 CCOCc1ccc(cc1Br)Br 34a_100012357508_100000210202 [1,1,0,0,0,0|1,0,1]=4 3235 B12R1.69 CCOCc1ccc(cc1Br)Br 34a_100121572206_200012351560 [1,1,0,0,0,0|1,0,1]=4 3236 B12R1.69 CCOCc1ccc(cc1Br)Br 7a_100012357508_100000210202 [1,1,0,0,0,0|1,0,1]=4 3237 B12R1.69 CCOCc1ccc(cc1Br)Cl 34a_100000707881_100000210202 [1,1,0,0,0,0|1,0,1]=4 3238 B12R1.69 CCOCc1ccc(cc1Br)Cl 34a_100121572206_100000755608 [1,1,0,0,0,0|1,0,1]=4 3239 B12R1.69 CCOCc1ccc(cc1Br)Cl 7a_100000707881_100000210202 [1,1,0,0,0,0|1,0,1]=4 3240 B12R1.69 CCOCc1ccc(cc1Br)F 34a_100000744086_100000210202 [1,1,0,0,0,0|1,0,1]=4 3241 B12R1.69 CCOCc1ccc(cc1Br)F 34a_100121572206_100000243222 [1,1,0,0,0,0|1,0,1]=4 3242 B12R1.69 CCOCc1ccc(cc1Br)F 7a_100000744086_100000210202 [1,1,0,0,0,0|1,0,1]=4 3243 B12R1.69 CCOCc1ccc(cc1Br)I 34a_100121572206_100010146610 [1,1,0,0,0,0|1,0,1]=4 3244 B12R1.69 CCOCc1ccc(cc1Br)I 7a_100010240206_100000210202 [1,1,0,0,0,0|1,0,1]=4 3245 B12R1.69 CCOCc1ccc(cc1C)Br 34a_100000748258_100000210202 [1,1,0,0,0,0|1,0,1]=4 3246 B12R1.69 CCOCc1ccc(cc1C)Br 34a_100121572206_100000708836 [1,1,0,0,0,0|1,0,1]=4 3247 B12R1.69 CCOCc1ccc(cc1C)Br 7a_100000748258_100000210202 [1,1,0,0,0,0|1,0,1]=4 3248 B12R1.69 CCOCc1ccc(cc1C)C 34a_100011215341_100000210202 [1,1,0,0,0,0|1,0,1]=4 3249 B12R1.69 CCOCc1ccc(cc1C)C 34a_100121572206_100011219618 [1,1,0,0,0,0|1,0,1]=4 3250 B12R1.69 CCOCc1ccc(cc1C)C 7a_100011215341_100000210202 [1,1,0,0,0,0|1,0,1]=4 3251 B12R1.69 CCOCc1ccc(cc1C)Cl 34a_100000702939_100000210202 [1,1,0,0,0,0|1,0,1]=4 3252 B12R1.69 CCOCc1ccc(cc1C)Cl 34a_100121572206_100012361307 [1,1,0,0,0,0|1,0,1]=4 3253 B12R1.69 CCOCc1ccc(cc1C)Cl 7a_100000702939_100000210202 [1,1,0,0,0,0|1,0,1]=4 3254 B12R1.69 CCOCc1ccc(cc1C)F 34a_100000700136_100000210202 [1,1,0,0,0,0|1,0,1]=4 3255 B12R1.69 CCOCc1ccc(cc1C)F 34a_100121572206_100000700533 [1,1,0,0,0,0|1,0,1]=4 3256 B12R1.69 CCOCc1ccc(cc1C)F 7a_100000700136_100000210202 [1,1,0,0,0,0|1,0,1]=4 3257 B12R1.69 CCOCc1ccc(cc1C)N 34a_100000102464_100000210202 [1,1,0,0,0,0|1,0,1]=4 3258 B12R1.69 CCOCc1ccc(cc1C)N 7a_100000102464_100000210202 [1,1,0,0,0,0|1,0,1]=4 3259 B12R1.69 CCOCc1ccc(cc1Cl)Br 34a_100000756401_100000210202 [1,1,0,0,0,0|1,0,1]=4 3260 B12R1.69 CCOCc1ccc(cc1Cl)Br 34a_100121572206_100011740631 [1,1,0,0,0,0|1,0,1]=4 3261 B12R1.69 CCOCc1ccc(cc1Cl)Br 7a_100000756401_100000210202 [1,1,0,0,0,0|1,0,1]=4 3262 B12R1.69 CCOCc1ccc(cc1Cl)C 34a_100000720314_100000210202 [1,1,0,0,0,0|1,0,1]=4 3263 B12R1.69 CCOCc1ccc(cc1Cl)C 34a_100121572206_100012349684 [1,1,0,0,0,0|1,0,1]=4 3264 B12R1.69 CCOCc1ccc(cc1Cl)C 7a_100000720314_100000210202 [1,1,0,0,0,0|1,0,1]=4 3265 B12R1.69 CCOCc1ccc(cc1Cl)Cl 34a_100000215721_100000210202 [1,1,0,0,0,0|1,0,1]=4 3266 B12R1.69 CCOCc1ccc(cc1Cl)Cl 34a_100121572206_100000188473 [1,1,0,0,0,0|1,0,1]=4 3267 B12R1.69 CCOCc1ccc(cc1Cl)Cl 7a_100000215721_100000210202 [1,1,0,0,0,0|1,0,1]=4 3268 B12R1.69 CCOCc1ccc(cc1Cl)F 34a_100011219954_100000210202 [1,1,0,0,0,0|1,0,1]=4 3269 B12R1.69 CCOCc1ccc(cc1Cl)F 34a_100121572206_100011216360 [1,1,0,0,0,0|1,0,1]=4 3270 B12R1.69 CCOCc1ccc(cc1Cl)F 7a_100011219954_100000210202 [1,1,0,0,0,0|1,0,1]=4 3271 B12R1.69 CCOCc1ccc(cc1Cl)N 34a_100000689119_100000210202 [1,1,0,0,0,0|1,0,1]=4 3272 B12R1.69 CCOCc1ccc(cc1F)Br 34a_100011191541_100000210202 [1,1,0,0,0,0|1,0,1]=4 3273 B12R1.69 CCOCc1ccc(cc1F)Br 34a_100121572206_100000211606 [1,1,0,0,0,0|1,0,1]=4 3274 B12R1.69 CCOCc1ccc(cc1F)Br 7a_100011191541_100000210202 [1,1,0,0,0,0|1,0,1]=4 3275 B12R1.69 CCOCc1ccc(cc1F)C 34a_100011216587_100000210202 [1,1,0,0,0,0|1,0,1]=4 3276 B12R1.69 CCOCc1ccc(cc1F)C 34a_100121572206_100012002367 [1,1,0,0,0,0|1,0,1]=4 3277 B12R1.69 CCOCc1ccc(cc1F)C 7a_100011216587_100000210202 [1,1,0,0,0,0|1,0,1]=4 3278 B12R1.69 CCOCc1ccc(cc1F)Cl 34a_100011217562_100000210202 [1,1,0,0,0,0|1,0,1]=4 3279 B12R1.69 CCOCc1ccc(cc1F)Cl 34a_100121572206_100000709361 [1,1,0,0,0,0|1,0,1]=4 3280 B12R1.69 CCOCc1ccc(cc1F)Cl 7a_100011217562_100000210202 [1,1,0,0,0,0|1,0,1]=4 3281 B12R1.69 CCOCc1ccc(cc1F)F 34a_100011215441_100000210202 [1,1,0,0,0,0|1,0,1]=4 3282 B12R1.69 CCOCc1ccc(cc1F)F 34a_100121572206_100000748237 [1,1,0,0,0,0|1,0,1]=4 3283 B12R1.69 CCOCc1ccc(cc1F)F 7a_100011215441_100000210202 [1,1,0,0,0,0|1,0,1]=4 3284 B12R1.69 CCOCc1ccc(cc1F)I 34a_100121572206_100010244991 [1,1,0,0,0,0|1,0,1]=4 3285 B12R1.69 CCOCc1ccc(cc1F)I 34a_200010202041_100000210202 [1,1,0,0,0,0|1,0,1]=4 3286 B12R1.69 CCOCc1ccc(cc1F)I 7a_200010202041_100000210202 [1,1,0,0,0,0|1,0,1]=4 3287 B12R1.69 CCOCc1ccc(cc1I)Br 34a_100121572206_100010146615 [1,1,0,0,0,0|1,0,1]=4 3288 B12R1.69 CCOCc1ccc(cc1I)Br 7a_100010146605_100000210202 [1,1,0,0,0,0|1,0,1]=4 3289 B12R1.69 CCOCc1ccc(cc1I)Cl 34a_100000722340_100000210202 [1,1,0,0,0,0|1,0,1]=4 3290 B12R1.69 CCOCc1ccc(cc1I)Cl 34a_100121572206_100010254388 [1,1,0,0,0,0|1,0,1]=4 3291 B12R1.69 CCOCc1ccc(cc1I)Cl 7a_100000722340_100000210202 [1,1,0,0,0,0|1,0,1]=4 3292 B12R1.69 CCOCc1ccc(cc1I)F 34a_100011356828_100000210202 [1,1,0,0,0,0|1,0,1]=4 3293 B12R1.69 CCOCc1ccc(cc1I)F 34a_100121572206_100012354799 [1,1,0,0,0,0|1,0,1]=4 3294 B12R1.69 CCOCc1ccc(cc1I)F 7a_100011356828_100000210202 [1,1,0,0,0,0|1,0,1]=4 3295 B12R1.69 CCOCc1ccc(cc1N)Br 34a_100000718831_100000210202 [1,1,0,0,0,0|1,0,1]=4 3296 B12R1.69 CCOCc1ccc(cc1N)Br 7a_100000718831_100000210202 [1,1,0,0,0,0|1,0,1]=4 3297 B12R1.69 CCOCc1ccc(cc1N)C 34a_100000087799_100000210202 [1,1,0,0,0,0|1,0,1]=4 3298 B12R1.69 CCOCc1ccc(cc1N)C 7a_100000087799_100000210202 [1,1,0,0,0,0|1,0,1]=4 3299 B12R1.69 CCOCc1ccc(cc1N)Cl 34a_100000238622_100000210202 [1,1,0,0,0,0|1,0,1]=4 3300 B12R1.69 CCOCc1ccc(cc1N)Cl 7a_100000238622_100000210202 [1,1,0,0,0,0|1,0,1]=4 3301 B12R1.69 CCOCc1ccc(cc1N)F 34a_100011996588_100000210202 [1,1,0,0,0,0|1,0,1]=4 3302 B12R1.121 C#Cc1ccccc1COCC 34a_100000054652_100000210202 [1,1,0,0,0,0|1,0,1]=4 3303 B12R1.121 C#Cc1ccccc1COCC 7a_100000054652_100000210202 [1,1,0,0,0,0|1,0,1]=4 3304 B12R1.121 C=Cc1ccccc1COCC 271570a_100011290941_200011493690 [1,1,0,0,0,0|1,0,1]=4 3305 B12R1.121 C=Cc1ccccc1COCC 34a_200010883148_100000210202 [1,1,0,0,0,0|1,0,1]=4 3306 B12R1.121 C=Cc1ccccc1COCC 7a_200010883148_100000210202 [1,1,0,0,0,0|1,0,1]=4 3307 B12R1.121 CCCCc1ccccc1CO 271570a_100020621405_100000187465 [1,1,0,0,0,0|1,0,1]=4 3308 B12R1.121 CCCCc1ccccc1OC 271570a_100020621405_100000174000 [1,1,0,0,0,0|1,0,1]=4 3309 B12R1.121 CCCNc1ccccc1CO 34a_100000212039_100000210303 [1,1,0,0,0,0|2,0,0]=4 3310 B12R1.121 CCCNc1ccccc1OC 34a_100000210025_100000210303 [1,1,0,0,0,0|2,0,0]=4 3311 B12R1.121 CCCOc1ccccc1CO 34a_100011216872_100000210303 [1,1,0,0,0,0|2,0,0]=4 3312 B12R1.121 CCCOc1ccccc1OC 34a_100000180214_200000210301 [1,1,0,0,0,0|2,0,0]=4 3313 B12R1.121 CCCOc1ccccc1OC 34a_100000210385_100000210303 [1,1,0,0,0,0|2,0,0]=4 3314 B12R1.121 CCCOc1ccccc1OC 7a_100000180214_200000210301 [1,1,0,0,0,0|2,0,0]=4 3315 B12R1.121 CCCOc1ccccc1O[13CH3] 34a_100000180214_200025704644 [1,1,0,0,0,0|2,0,0]=4 3316 B12R1.121 CCCOc1ccccc1O[13CH3] 7a_100000180214_200025704644 [1,1,0,0,0,0|2,0,0]=4 3317 B12R1.121 CCCSc1ccccc1CO 62a_100000187465_100000210303 [1,1,0,0,0,0|2,0,0]=4 3318 B12R1.121 CCCSc1ccccc1CO 62a_100000210303_100000187465 [1,1,0,0,0,0|2,0,0]=4 3319 B12R1.121 CCCSc1ccccc1OC 62a_100000210303_100000210334 [1,1,0,0,0,0|2,0,0]=4 3320 B12R1.121 CCCSc1ccccc1OC 62a_100000210334_100000210303 [1,1,0,0,0,0|2,0,0]=4 3321 B12R1.121 CCNCc1ccccc1CO 2230a_100015525214_100009816955 [1,1,0,0,0,0|1,0,1]=4 3322 B12R1.121 CCNCc1ccccc1OC 207a_100015525214_100000169842 [1,1,0,0,0,0|1,0,1]=4 3323 B12R1.121 CCNCc1ccccc1OC 2230a_100015525214_100000210004 [1,1,0,0,0,0|1,0,1]=4 3324 B12R1.121 CCNCc1ccccc1OC 270004a_100015525214_100000169842 [1,1,0,0,0,0|1,0,1]=4 3325 B12R1.121 CCNCc1ccccc1OC 34a_100000188900_100000210202 [1,1,0,0,0,0|1,0,1]=4 3326 B12R1.121 CCOCc1ccccc1C#N 34a_100121572206_100000181865 [1,1,0,0,0,0|1,0,1]=4 3327 B12R1.121 CCOCc1ccccc1C#N 34a_200011269968_100000210202 [1,1,0,0,0,0|1,0,1]=4 3328 B12R1.121 CCOCc1ccccc1C#N 7a_200011269968_100000210202 [1,1,0,0,0,0|1,0,1]=4 3329 B12R1.121 CCOCc1ccccc1C=O 34a_100121572206_200009853537 [1,1,0,0,0,0|0,0,2]=4 3330 B12R1.121 CCOCc1ccccc1CBr 34a_100009816955_100000210202 [1,1,0,0,0,0|1,0,1]=4 3331 B12R1.121 CCOCc1ccccc1CBr 7a_100009816955_100000210202 [1,1,0,0,0,0|1,0,1]=4 3332 B12R1.121 CCOCc1ccccc1CC 34a_100011663872_100000210202 [1,1,0,0,0,0|1,0,1]=4 3333 B12R1.121 CCOCc1ccccc1CC 7a_100011663872_100000210202 [1,1,0,0,0,0|1,0,1]=4 3334 B12R1.121 CCOCc1ccccc1CN 34a_100000743596_100000210202 [1,1,0,0,0,0|1,0,1]=4 3335 B12R1.121 CCOCc1ccccc1CO 34a_100121572206_100009816955 [1,1,0,0,0,0|0,0,1]=3 3336 B12R1.121 CCOCc1ccccc1OC 34a_100000211301_100000210202 [1,1,0,0,0,0|0,0,1]=3 3337 B12R1.121 CCOCc1ccccc1OC 34a_100121572206_100000210004 [1,1,0,0,0,0|0,0,1]=3 3338 B12R1.121 CCOCc1ccccc1SC 34a_100000699167_100000210202 [1,1,0,0,0,0|0,1,1]=4 3339 B12R1.121 CCOCc1ccccc1SC 34a_100121572206_100000699184 [1,1,0,0,0,0|0,1,1]=4 3340 B12R1.121 CCOCc1ccccc1SC 62a_200000210301_200011493690 [1,1,0,0,0,0|0,1,1]=4 3341 B12R1.121 CCOCc1ccccc1SC 62a_200011493690_200000210301 [1,1,0,0,0,0|0,1,1]=4 3342 B12R1.121 CCOCc1ccccc1S[13CH3] 62a_200011493690_200025704644 [1,1,0,0,0,0|0,1,1]=4 3343 B12R1.121 CCOCc1ccccc1S[13CH3] 62a_200025704644_200011493690 [1,1,0,0,0,0|0,1,1]=4 3344 B12R1.121 CCOCc1cccnc1OC 34a_100000717863_100000210202 [1,1,0,0,0,0|1,0,1]=4 3345 B12R1.121 CCOCc1cccnc1OC 34a_100121572206_100020631285 [1,1,0,0,0,0|1,0,1]=4 3346 B12R1.121 CCOCc1ncccc1OC 34a_100011998681_100000210202 [1,1,0,0,0,0|1,0,1]=4 3347 B12R1.121 CCSCc1ccccc1CO 62a_100000210202_100009816955 [1,1,0,0,0,0|0,1,1]=4 3348 B12R1.121 CCSCc1ccccc1CO 62a_100009816955_100000210202 [1,1,0,0,0,0|0,1,1]=4 3349 B12R1.121 CCSCc1ccccc1OC 62a_100000210004_100000210202 [1,1,0,0,0,0|0,1,1]=4 3350 B12R1.121 CCSCc1ccccc1OC 62a_100000210202_100000210004 [1,1,0,0,0,0|0,1,1]=4 3351 B12R1.121 COc1ccccc1COCF 34a_100000211301_100015361967 [1,1,0,0,0,0|1,0,1]=4 3352 B12R1.125 CC(=O)C=Cc1ccccc1O 1458a_100016263591_200000210301 [1,1,0,0,0,0|1,0,1]=4 3353 B12R1.125 CC(C)C=Cc1ccccc1Br 271570a_100016257149_100000695589 [1,1,0,0,0,0|2,0,0]=4 3354 B12R1.125 CC(C)C=Cc1ccccc1Cl 271570a_100016257149_100000764095 [1,1,0,0,0,0|2,0,0]=4 3355 B12R1.125 CC(C)C=Cc1ccccc1F 271570a_100016257149_100011215700 [1,1,0,0,0,0|2,0,0]=4 3356 B12R1.125 CC(C)C=Cc1ccccc1N 271570a_100016257149_100000210017 [1,1,0,0,0,0|2,0,0]=4 3357 B12R1.125 CC(C)C=Cc1ccccc1O 271570a_100016257149_100000739446 [1,1,0,0,0,0|1,0,0]=3 3358 B12R1.125 CC(C)C=Cc1ccncc1O 271570a_100016257149_100009817591 [1,1,0,0,0,0|2,0,0]=4 3359 B12R1.125 CC(C)C=Cc1ncccc1O 271570a_100016257149_100000034122 [1,1,0,0,0,0|2,0,0]=4 3360 B12R1.125 CC(C)CNc1ccccc1O 34a_100000185747_100000210624 [1,1,0,0,0,0|2,0,0]=4 3361 B12R1.125 CC(C)CSc1ccccc1O 62a_100000210624_100000739446 [1,1,0,0,0,0|2,0,0]=4 3362 B12R1.125 CC(C)CSc1ccccc1O 62a_100000739446_100000210760 [1,1,0,0,0,0|2,0,0]=4 3363 B12R1.125 CC(C)NCc1ccccc1O 271570a_203496583355_100000195800 [1,1,0,0,0,0|1,0,1]=4 3364 B12R1.125 CC(C)NCc1ccccc1O 34a_100000185550_100000210206 [1,1,0,0,0,0|1,0,1]=4 3365 B12R1.125 CC(C)OCc1ccccc1Br 34a_100000212225_100000184730 [1,1,0,0,0,0|1,0,1]=4 3366 B12R1.125 CC(C)OCc1ccccc1Br 34a_100000756307_100000210206 [1,1,0,0,0,0|1,0,1]=4 3367 B12R1.125 CC(C)OCc1ccccc1Br 7a_100000756307_100000210206 [1,1,0,0,0,0|1,0,1]=4 3368 B12R1.125 CC(C)OCc1ccccc1Cl 34a_100000210847_100000210206 [1,1,0,0,0,0|1,0,1]=4 3369 B12R1.125 CC(C)OCc1ccccc1Cl 34a_100000212225_100000187162 [1,1,0,0,0,0|1,0,1]=4 3370 B12R1.125 CC(C)OCc1ccccc1Cl 7a_100000210847_100000210206 [1,1,0,0,0,0|1,0,1]=4 3371 B12R1.125 CC(C)OCc1ccccc1F 34a_100000211962_100000210206 [1,1,0,0,0,0|1,0,1]=4 3372 B12R1.125 CC(C)OCc1ccccc1F 34a_100000212225_100000211605 [1,1,0,0,0,0|1,0,1]=4 3373 B12R1.125 CC(C)OCc1ccccc1F 7a_100000211962_100000210206 [1,1,0,0,0,0|1,0,1]=4 3374 B12R1.125 CC(C)OCc1ccccc1I 34a_100000187465_100000210206 [1,1,0,0,0,0|1,0,1]=4 3375 B12R1.125 CC(C)OCc1ccccc1I 34a_100000212225_100011215278 [1,1,0,0,0,0|1,0,1]=4 3376 B12R1.125 CC(C)OCc1ccccc1I 7a_100000187465_100000210206 [1,1,0,0,0,0|1,0,1]=4 3377 B12R1.125 CC(C)OCc1ccccc1N 34a_100000212039_100000210206 [1,1,0,0,0,0|1,0,1]=4 3378 B12R1.125 CC(C)OCc1ncccc1O 34a_100000212225_200020655725 [1,1,0,0,0,0|1,0,1]=4 3379 B12R1.125 CC(C)SCc1ccccc1O 271570a_203496583355_200000173093 [1,1,0,0,0,0|0,1,1]=4 3380 B12R1.125 CC(O)C=Cc1ccccc1Br 271570a_200011019289_100000695589 [1,1,0,0,0,0|2,0,0]=4 3381 B12R1.125 CC(O)C=Cc1ccccc1Cl 271570a_200011019289_100000764095 [1,1,0,0,0,0|2,0,0]=4 3382 B12R1.125 CC(O)C=Cc1ccccc1F 271570a_200011019289_100011215700 [1,1,0,0,0,0|2,0,0]=4 3383 B12R1.125 CC(O)C=Cc1ccccc1N 271570a_200011019289_100000210017 [1,1,0,0,0,0|2,0,0]=4 3384 B12R1.125 CC(O)C=Cc1ccccc1O 271570a_200011019289_100000739446 [1,1,0,0,0,0|1,0,0]=3 3385 B12R1.125 CC(O)C=Cc1ccncc1O 271570a_200011019289_100009817591 [1,1,0,0,0,0|2,0,0]=4 3386 B12R1.125 CC(O)C=Cc1ncccc1O 271570a_200011019289_100000034122 [1,1,0,0,0,0|2,0,0]=4 3387 B12R1.125 CC(O)CNc1ccccc1O 34a_100000185747_100011218427 [1,1,0,0,0,0|2,0,0]=4 3388 B12R1.125 CC(O)CSc1ccccc1O 62a_100000739446_100011218427 [1,1,0,0,0,0|2,0,0]=4 3389 B12R1.125 CC(O)CSc1ccccc1O 62a_100011218427_100000739446 [1,1,0,0,0,0|2,0,0]=4 3390 B12R1.125 C[C@@H](O)CNc1ccccc1O 34a_100000185747_100009817552 [1,1,0,0,0,0|2,0,0]=4 3391 B12R1.125 C[C@@H](O)CSc1ccccc1O 62a_100000739446_100009817552 [1,1,0,0,0,0|2,0,0]=4 3392 B12R1.125 C[C@@H](O)CSc1ccccc1O 62a_100009817552_100000739446 [1,1,0,0,0,0|2,0,0]=4 3393 B12R1.125 Cc1ccccc1C=CC(C)C 271570a_100016257149_100000210755 [1,1,0,0,0,0|2,0,0]=4 3394 B12R1.125 Cc1ccccc1C=CC(C)O 271570a_200011019289_100000210755 [1,1,0,0,0,0|2,0,0]=4 3395 B12R1.125 Cc1ccccc1COC(C)C 34a_100000212225_100000211839 [1,1,0,0,0,0|1,0,1]=4 3396 B12R1.125 Cc1ccccc1COC(C)C 34a_100000698903_100000210206 [1,1,0,0,0,0|1,0,1]=4 3397 B12R1.125 Cc1ccccc1COC(C)C 7a_100000698903_100000210206 [1,1,0,0,0,0|1,0,1]=4 3398 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1O 1458a_100016263591_200025704644 [1,1,0,0,0,0|1,0,1]=4 3399 B12R1.267 BrCCOCc1ccccc1Br 34a_100000211926_100000184730 [1,1,0,0,0,0|1,0,1]=4 3400 B12R1.267 BrCCOCc1ccccc1I 34a_100000211926_100011215278 [1,1,0,0,0,0|1,0,1]=4 3401 B12R1.267 CCCC=Cc1ccccc1Br 271570a_100016258520_100000695589 [1,1,0,0,0,0|2,0,0]=4 3402 B12R1.267 CCCC=Cc1ccccc1C 271570a_100016258520_100000210755 [1,1,0,0,0,0|2,0,0]=4 3403 B12R1.267 CCCC=Cc1ccccc1Cl 271570a_100016258520_100000764095 [1,1,0,0,0,0|2,0,0]=4 3404 B12R1.267 CCCC=Cc1ccccc1F 271570a_100016258520_100011215700 [1,1,0,0,0,0|2,0,0]=4 3405 B12R1.267 CCCC=Cc1ccccc1N 271570a_100016258520_100000210017 [1,1,0,0,0,0|2,0,0]=4 3406 B12R1.267 CCCC=Cc1ccccc1O 271570a_100016258520_100000739446 [1,1,0,0,0,0|1,0,0]=3 3407 B12R1.267 CCCC=Cc1ccncc1O 271570a_100016258520_100009817591 [1,1,0,0,0,0|2,0,0]=4 3408 B12R1.267 CCCC=Cc1ncccc1O 271570a_100016258520_100000034122 [1,1,0,0,0,0|2,0,0]=4 3409 B12R1.267 CCCCNc1ccccc1O 34a_100000185747_100000210210 [1,1,0,0,0,0|1,0,1]=4 3410 B12R1.267 CCCCOc1ccccc1O 271570a_203496583355_100000230755 [1,1,0,0,0,0|1,0,1]=4 3411 B12R1.267 CCCCSc1ccccc1O 62a_100000210211_100000739446 [1,1,0,0,0,0|1,0,1]=4 3412 B12R1.267 CCCCSc1ccccc1O 62a_100000739446_100000210210 [1,1,0,0,0,0|1,0,1]=4 3413 B12R1.267 CCCNCc1ccccc1O 271570a_203496583355_100000196483 [1,1,0,0,0,0|1,0,1]=4 3414 B12R1.267 CCCNCc1ccccc1O 34a_100000185550_100000210303 [1,1,0,0,0,0|1,0,1]=4 3415 B12R1.267 CCCOCc1ccccc1Br 34a_100000210258_100000184730 [1,1,0,0,0,0|1,0,1]=4 3416 B12R1.267 CCCOCc1ccccc1Br 34a_100000756307_100000210303 [1,1,0,0,0,0|1,0,1]=4 3417 B12R1.267 CCCOCc1ccccc1Br 7a_100000756307_100000210303 [1,1,0,0,0,0|1,0,1]=4 3418 B12R1.267 CCCOCc1ccccc1C 34a_100000210258_100000211839 [1,1,0,0,0,0|1,0,1]=4 3419 B12R1.267 CCCOCc1ccccc1C 34a_100000698903_100000210303 [1,1,0,0,0,0|1,0,1]=4 3420 B12R1.267 CCCOCc1ccccc1C 7a_100000698903_100000210303 [1,1,0,0,0,0|1,0,1]=4 3421 B12R1.267 CCCOCc1ccccc1Cl 34a_100000210258_100000187162 [1,1,0,0,0,0|1,0,1]=4 3422 B12R1.267 CCCOCc1ccccc1Cl 34a_100000210847_100000210303 [1,1,0,0,0,0|1,0,1]=4 3423 B12R1.267 CCCOCc1ccccc1Cl 7a_100000210847_100000210303 [1,1,0,0,0,0|1,0,1]=4 3424 B12R1.267 CCCOCc1ccccc1F 34a_100000210258_100000211605 [1,1,0,0,0,0|1,0,1]=4 3425 B12R1.267 CCCOCc1ccccc1F 34a_100000211962_100000210303 [1,1,0,0,0,0|1,0,1]=4 3426 B12R1.267 CCCOCc1ccccc1F 7a_100000211962_100000210303 [1,1,0,0,0,0|1,0,1]=4 3427 B12R1.267 CCCOCc1ccccc1I 34a_100000187465_100000210303 [1,1,0,0,0,0|1,0,1]=4 3428 B12R1.267 CCCOCc1ccccc1I 34a_100000210258_100011215278 [1,1,0,0,0,0|1,0,1]=4 3429 B12R1.267 CCCOCc1ccccc1I 7a_100000187465_100000210303 [1,1,0,0,0,0|1,0,1]=4 3430 B12R1.267 CCCOCc1ccccc1N 34a_100000212039_100000210303 [1,1,0,0,0,0|1,0,1]=4 3431 B12R1.267 CCCOCc1ncccc1O 34a_100000210258_200020655725 [1,1,0,0,0,0|1,0,1]=4 3432 B12R1.267 CCCSCc1ccccc1O 271570a_203496583355_200000173363 [1,1,0,0,0,0|0,1,1]=4 3433 B12R1.267 CCNCCc1ccccc1O 34a_100011207237_100000210202 [1,1,0,0,0,0|1,0,1]=4 3434 B12R1.267 CCNN=Cc1ccccc1Br 4a_100000756455_100000211189 [1,1,0,0,0,0|2,0,0]=4 3435 B12R1.267 CCNN=Cc1ccccc1C 4a_100000756455_100000211143 [1,1,0,0,0,0|2,0,0]=4 3436 B12R1.267 CCNN=Cc1ccccc1Cl 4a_100000756455_100000210073 [1,1,0,0,0,0|2,0,0]=4 3437 B12R1.267 CCNN=Cc1ccccc1F 4a_100000756455_100000210811 [1,1,0,0,0,0|2,0,0]=4 3438 B12R1.267 CCNN=Cc1ccccc1I 4a_100000756455_100000010305 [1,1,0,0,0,0|2,0,0]=4 3439 B12R1.267 CCNN=Cc1ccccc1O 4a_100000756455_100000185834 [1,1,0,0,0,0|1,0,0]=3 3440 B12R1.267 CCNN=Cc1cccnc1O 4a_100000756455_100011998315 [1,1,0,0,0,0|2,0,0]=4 3441 B12R1.267 CCNN=Cc1ccncc1O 4a_100000756455_100000077405 [1,1,0,0,0,0|2,0,0]=4 3442 B12R1.267 CCNN=Cc1ncccc1O 4a_100000756455_100000042352 [1,1,0,0,0,0|2,0,0]=4 3443 B12R1.267 CCOC=Cc1c[nH]ccc1=O 271570a_100016256518_100009998708 [1,1,0,0,0,0|1,0,1]=4 3444 B12R1.267 CCOC=Cc1c[nH]ccc1=S 271570a_100016256518_200012280681 [1,1,0,0,0,0|1,1,0]=4 3445 B12R1.267 CCOC=Cc1ccc[nH]c1=O 271570a_100016256518_100000050042 [1,1,0,0,0,0|1,0,1]=4 3446 B12R1.267 CCOC=Cc1cccc[n+]1C 271570a_100016256518_100000212160 [1,1,0,0,0,0|2,0,0]=4 3447 B12R1.267 CCOC=Cc1cccc[n+]1[O-] 271570a_100016256518_200000042595 [1,1,0,0,0,0|1,0,1]=4 3448 B12R1.267 CCOC=Cc1ccccc1Br 271570a_100016256518_100000695589 [1,1,0,0,0,0|1,0,0]=3 3449 B12R1.267 CCOC=Cc1ccccc1C 271570a_100016256518_100000210755 [1,1,0,0,0,0|1,0,0]=3 3450 B12R1.267 CCOC=Cc1ccccc1Cl 271570a_100016256518_100000764095 [1,1,0,0,0,0|1,0,0]=3 3451 B12R1.267 CCOC=Cc1ccccc1F 271570a_100016256518_100011215700 [1,1,0,0,0,0|1,0,0]=3 3452 B12R1.267 CCOC=Cc1ccccc1N 271570a_100016256518_100000210017 [1,1,0,0,0,0|1,0,0]=3 3453 B12R1.267 CCOC=Cc1ccccc1O 271570a_100016256518_100000739446 [1,1,0,0,0,0|0,0,0]=2 3454 B12R1.267 CCOC=Cc1cccnc1Br 271570a_100016256518_100010202626 [1,1,0,0,0,0|2,0,0]=4 3455 B12R1.267 CCOC=Cc1cccnc1C 271570a_100016256518_100000751574 [1,1,0,0,0,0|2,0,0]=4 3456 B12R1.267 CCOC=Cc1cccnc1Cl 271570a_100016256518_100000036424 [1,1,0,0,0,0|2,0,0]=4 3457 B12R1.267 CCOC=Cc1cccnc1F 271570a_100016256518_100009816115 [1,1,0,0,0,0|2,0,0]=4 3458 B12R1.267 CCOC=Cc1cccnc1N 271570a_100016256518_100000045569 [1,1,0,0,0,0|2,0,0]=4 3459 B12R1.267 CCOC=Cc1ccncc1Br 271570a_100016256518_100000726257 [1,1,0,0,0,0|2,0,0]=4 3460 B12R1.267 CCOC=Cc1ccncc1C 271570a_100016256518_100015191297 [1,1,0,0,0,0|2,0,0]=4 3461 B12R1.267 CCOC=Cc1ccncc1Cl 271570a_100016256518_100000708259 [1,1,0,0,0,0|2,0,0]=4 3462 B12R1.267 CCOC=Cc1ccncc1F 271570a_100016256518_100000047030 [1,1,0,0,0,0|2,0,0]=4 3463 B12R1.267 CCOC=Cc1ccncc1N 271570a_100016256518_100009815883 [1,1,0,0,0,0|2,0,0]=4 3464 B12R1.267 CCOC=Cc1ccncc1O 271570a_100016256518_100009817591 [1,1,0,0,0,0|1,0,0]=3 3465 B12R1.267 CCOC=Cc1cnccc1Br 271570a_100016256518_100010138639 [1,1,0,0,0,0|2,0,0]=4 3466 B12R1.267 CCOC=Cc1cnccc1C 271570a_100016256518_100000761580 [1,1,0,0,0,0|2,0,0]=4 3467 B12R1.267 CCOC=Cc1cnccc1Cl 271570a_100016256518_100009995489 [1,1,0,0,0,0|2,0,0]=4 3468 B12R1.267 CCOC=Cc1cnccc1F 271570a_100016256518_100009820683 [1,1,0,0,0,0|2,0,0]=4 3469 B12R1.267 CCOC=Cc1cnccc1N 271570a_100016256518_100000047001 [1,1,0,0,0,0|2,0,0]=4 3470 B12R1.267 CCOC=Cc1cncnc1O 271570a_100016256518_100000751107 [1,1,0,0,0,0|2,0,0]=4 3471 B12R1.267 CCOC=Cc1ncccc1Br 271570a_100016256518_100000696092 [1,1,0,0,0,0|2,0,0]=4 3472 B12R1.267 CCOC=Cc1ncccc1C 271570a_100016256518_100000751373 [1,1,0,0,0,0|2,0,0]=4 3473 B12R1.267 CCOC=Cc1ncccc1Cl 271570a_100016256518_100011356963 [1,1,0,0,0,0|2,0,0]=4 3474 B12R1.267 CCOC=Cc1ncccc1F 271570a_100016256518_100000685392 [1,1,0,0,0,0|2,0,0]=4 3475 B12R1.267 CCOC=Cc1ncccc1N 271570a_100016256518_100000688686 [1,1,0,0,0,0|2,0,0]=4 3476 B12R1.267 CCOC=Cc1ncccc1O 271570a_100016256518_100000034122 [1,1,0,0,0,0|1,0,0]=3 3477 B12R1.267 CCOCCc1ccccc1Br 34a_100000731337_100000210202 [1,1,0,0,0,0|1,0,1]=4 3478 B12R1.267 CCOCCc1ccccc1Br 34a_100121572206_100012161201 [1,1,0,0,0,0|1,0,1]=4 3479 B12R1.267 CCOCCc1ccccc1Br 7a_100000731337_100000210202 [1,1,0,0,0,0|1,0,1]=4 3480 B12R1.267 CCOCCc1ccccc1C 34a_100011220023_100000210202 [1,1,0,0,0,0|1,0,1]=4 3481 B12R1.267 CCOCCc1ccccc1C 34a_100121572206_100011713688 [1,1,0,0,0,0|1,0,1]=4 3482 B12R1.267 CCOCCc1ccccc1C 7a_100011220023_100000210202 [1,1,0,0,0,0|1,0,1]=4 3483 B12R1.267 CCOCCc1ccccc1Cl 34a_100011215284_100000210202 [1,1,0,0,0,0|1,0,1]=4 3484 B12R1.267 CCOCCc1ccccc1Cl 34a_100121572206_100011713703 [1,1,0,0,0,0|1,0,1]=4 3485 B12R1.267 CCOCCc1ccccc1Cl 7a_100011215284_100000210202 [1,1,0,0,0,0|1,0,1]=4 3486 B12R1.267 CCOCCc1ccccc1F 34a_100000753711_100000210202 [1,1,0,0,0,0|1,0,1]=4 3487 B12R1.267 CCOCCc1ccccc1F 34a_100121572206_100000720011 [1,1,0,0,0,0|1,0,1]=4 3488 B12R1.267 CCOCCc1ccccc1F 7a_100000753711_100000210202 [1,1,0,0,0,0|1,0,1]=4 3489 B12R1.267 CCOCCc1ccccc1I 34a_100010255290_100000210202 [1,1,0,0,0,0|1,0,1]=4 3490 B12R1.267 CCOCCc1ccccc1I 7a_100010255290_100000210202 [1,1,0,0,0,0|1,0,1]=4 3491 B12R1.267 CCOCCc1ccccc1N 34a_100011215289_100000210202 [1,1,0,0,0,0|1,0,1]=4 3492 B12R1.267 CCOCCc1ccccc1O 34a_100121572206_100000722297 [1,1,0,0,0,0|0,0,1]=3 3493 B12R1.267 CCOCSc1ccccc1Br 62a_100000695589_100000739092 [1,1,0,0,0,0|1,0,1]=4 3494 B12R1.267 CCOCSc1ccccc1Br 62a_100000739092_100000695589 [1,1,0,0,0,0|1,0,1]=4 3495 B12R1.267 CCOCSc1ccccc1C 62a_100000210755_100000739092 [1,1,0,0,0,0|1,0,1]=4 3496 B12R1.267 CCOCSc1ccccc1C 62a_100000739092_100000210755 [1,1,0,0,0,0|1,0,1]=4 3497 B12R1.267 CCOCSc1ccccc1Cl 62a_100000739092_100000764095 [1,1,0,0,0,0|1,0,1]=4 3498 B12R1.267 CCOCSc1ccccc1Cl 62a_100000764095_100000739092 [1,1,0,0,0,0|1,0,1]=4 3499 B12R1.267 CCOCSc1ccccc1F 62a_100000739092_100011215700 [1,1,0,0,0,0|1,0,1]=4 3500 B12R1.267 CCOCSc1ccccc1F 62a_100011215700_100000739092 [1,1,0,0,0,0|1,0,1]=4 3501 B12R1.267 CCOCSc1ccccc1N 62a_100000210017_100000739092 [1,1,0,0,0,0|1,0,1]=4 3502 B12R1.267 CCOCSc1ccccc1N 62a_100000739092_100000210017 [1,1,0,0,0,0|1,0,1]=4 3503 B12R1.267 CCOCSc1ccccc1O 62a_100000739092_100000739446 [1,1,0,0,0,0|0,0,1]=3 3504 B12R1.267 CCOCSc1ccccc1O 62a_100000739446_100000739092 [1,1,0,0,0,0|0,0,1]=3 3505 B12R1.267 CCOCSc1cccnc1O 62a_100000739092_100000760158 [1,1,0,0,0,0|1,0,1]=4 3506 B12R1.267 CCOCSc1cccnc1O 62a_100000760158_100000739092 [1,1,0,0,0,0|1,0,1]=4 3507 B12R1.267 CCOCSc1ccncc1O 62a_100000739092_100009817591 [1,1,0,0,0,0|1,0,1]=4 3508 B12R1.267 CCOCSc1ccncc1O 62a_100009817591_100000739092 [1,1,0,0,0,0|1,0,1]=4 3509 B12R1.267 CCOCSc1ncccc1O 62a_100000034122_100000739092 [1,1,0,0,0,0|1,0,1]=4 3510 B12R1.267 CCOCSc1ncccc1O 62a_100000739092_100000034122 [1,1,0,0,0,0|1,0,1]=4 3511 B12R1.267 CCSCCc1ccccc1O 62a_100000210202_100000722297 [1,1,0,0,0,0|0,1,1]=4 3512 B12R1.267 CCSCCc1ccccc1O 62a_100000722297_100000210202 [1,1,0,0,0,0|0,1,1]=4 3513 B12R1.267 CNCC=Cc1ccccc1Br 270004a_106832991635_200016268969 [1,1,0,0,0,0|2,0,0]=4 3514 B12R1.267 CNCC=Cc1ccccc1Cl 270004a_106832991635_200102525841 [1,1,0,0,0,0|2,0,0]=4 3515 B12R1.267 CNCC=Cc1ccccc1F 270004a_106832991635_200102525844 [1,1,0,0,0,0|2,0,0]=4 3516 B12R1.267 COCC=Cc1ccccc1Br 271570a_100016286323_100000695589 [1,1,0,0,0,0|2,0,0]=4 3517 B12R1.267 COCC=Cc1ccccc1C 271570a_100016286323_100000210755 [1,1,0,0,0,0|2,0,0]=4 3518 B12R1.267 COCC=Cc1ccccc1Cl 271570a_100016286323_100000764095 [1,1,0,0,0,0|2,0,0]=4 3519 B12R1.267 COCC=Cc1ccccc1F 271570a_100016286323_100011215700 [1,1,0,0,0,0|2,0,0]=4 3520 B12R1.267 COCC=Cc1ccccc1N 271570a_100016286323_100000210017 [1,1,0,0,0,0|2,0,0]=4 3521 B12R1.267 COCC=Cc1ccccc1O 271570a_100016286323_100000739446 [1,1,0,0,0,0|1,0,0]=3 3522 B12R1.267 COCC=Cc1ccncc1O 271570a_100016286323_100009817591 [1,1,0,0,0,0|2,0,0]=4 3523 B12R1.267 COCC=Cc1ncccc1O 271570a_100016286323_100000034122 [1,1,0,0,0,0|2,0,0]=4 3524 B12R1.267 COCCNc1ccccc1O 34a_100000185747_100011201679 [1,1,0,0,0,0|2,0,0]=4 3525 B12R1.267 COCCOc1ccccc1O 271570a_203496583355_100000234100 [1,1,0,0,0,0|2,0,0]=4 3526 B12R1.267 COCCSc1ccccc1O 271570a_203496583355_200016336083 [1,1,0,0,0,0|2,0,0]=4 3527 B12R1.267 COCCSc1ccccc1O 62a_100000233755_100000739446 [1,1,0,0,0,0|2,0,0]=4 3528 B12R1.267 COCCSc1ccccc1O 62a_100000739446_100000233755 [1,1,0,0,0,0|2,0,0]=4 3529 B12R1.267 CSCCNc1ccccc1O 34a_100000185747_100000212216 [1,1,0,0,0,0|2,0,0]=4 3530 B12R1.267 CSCCSc1ccccc1O 62a_100000212216_100000739446 [1,1,0,0,0,0|2,0,0]=4 3531 B12R1.267 CSCCSc1ccccc1O 62a_100000739446_100000751147 [1,1,0,0,0,0|2,0,0]=4 3532 B12R1.267 CSCNCc1ccccc1O 34a_100000185550_100011218213 [1,1,0,0,0,0|1,0,1]=4 3533 B12R1.267 CSCOCc1ccccc1Br 34a_100000756307_100011218213 [1,1,0,0,0,0|1,0,1]=4 3534 B12R1.267 CSCOCc1ccccc1C 34a_100000698903_100011218213 [1,1,0,0,0,0|1,0,1]=4 3535 B12R1.267 CSCOCc1ccccc1Cl 34a_100000210847_100011218213 [1,1,0,0,0,0|1,0,1]=4 3536 B12R1.267 CSCOCc1ccccc1F 34a_100000211962_100011218213 [1,1,0,0,0,0|1,0,1]=4 3537 B12R1.267 CSCOCc1ccccc1I 34a_100000187465_100011218213 [1,1,0,0,0,0|1,0,1]=4 3538 B12R1.267 CSCOCc1ccccc1N 34a_100000212039_100011218213 [1,1,0,0,0,0|1,0,1]=4 3539 B12R1.267 Cc1ccccc1COCCBr 34a_100000211926_100000211839 [1,1,0,0,0,0|1,0,1]=4 3540 B12R1.267 Cc1ccccc1COCCF 34a_100000698903_100011217306 [1,1,0,0,0,0|1,0,1]=4 3541 B12R1.267 Cc1ccccc1COCCF 7a_100000698903_100011217306 [1,1,0,0,0,0|1,0,1]=4 3542 B12R1.267 Cc1ccccc1COCCN 34a_100000210304_100000211839 [1,1,0,0,0,0|1,0,1]=4 3543 B12R1.267 Cc1ccccc1COCCO 34a_100000698903_100000211926 [1,1,0,0,0,0|1,0,1]=4 3544 B12R1.267 Cc1ccccc1COCCO 7a_100000698903_100000211926 [1,1,0,0,0,0|1,0,1]=4 3545 B12R1.267 Clc1ccccc1COCCBr 34a_100000211926_100000187162 [1,1,0,0,0,0|1,0,1]=4 3546 B12R1.267 FCCOCc1ccccc1Br 34a_100000756307_100011217306 [1,1,0,0,0,0|1,0,1]=4 3547 B12R1.267 FCCOCc1ccccc1Br 7a_100000756307_100011217306 [1,1,0,0,0,0|1,0,1]=4 3548 B12R1.267 FCCOCc1ccccc1Cl 34a_100000210847_100011217306 [1,1,0,0,0,0|1,0,1]=4 3549 B12R1.267 FCCOCc1ccccc1Cl 7a_100000210847_100011217306 [1,1,0,0,0,0|1,0,1]=4 3550 B12R1.267 FCCOCc1ccccc1F 34a_100000211962_100011217306 [1,1,0,0,0,0|1,0,1]=4 3551 B12R1.267 FCCOCc1ccccc1F 7a_100000211962_100011217306 [1,1,0,0,0,0|1,0,1]=4 3552 B12R1.267 FCCOCc1ccccc1I 34a_100000187465_100011217306 [1,1,0,0,0,0|1,0,1]=4 3553 B12R1.267 FCCOCc1ccccc1I 7a_100000187465_100011217306 [1,1,0,0,0,0|1,0,1]=4 3554 B12R1.267 Fc1ccccc1COCCBr 34a_100000211926_100000211605 [1,1,0,0,0,0|1,0,1]=4 3555 B12R1.267 NCCOCc1ccccc1Br 34a_100000210304_100000184730 [1,1,0,0,0,0|1,0,1]=4 3556 B12R1.267 NCCOCc1ccccc1Cl 34a_100000210304_100000187162 [1,1,0,0,0,0|1,0,1]=4 3557 B12R1.267 NCCOCc1ccccc1F 34a_100000210304_100000211605 [1,1,0,0,0,0|1,0,1]=4 3558 B12R1.267 NCCOCc1ccccc1I 34a_100000210304_100011215278 [1,1,0,0,0,0|1,0,1]=4 3559 B12R1.267 NCCOCc1ncccc1O 34a_100000210304_200020655725 [1,1,0,0,0,0|1,0,1]=4 3560 B12R1.267 Nc1ccccc1COCCF 34a_100000212039_100011217306 [1,1,0,0,0,0|1,0,1]=4 3561 B12R1.267 Nc1ccccc1COCCO 34a_100000212039_100000211926 [1,1,0,0,0,0|1,0,1]=4 3562 B12R1.267 OCCCCc1ccccc1O 271570a_203496583355_100012092669 [1,1,0,0,0,0|1,0,1]=4 3563 B12R1.267 OCCCNc1ccccc1O 34a_100000185747_100000230001 [1,1,0,0,0,0|2,0,0]=4 3564 B12R1.267 OCCCSc1ccccc1O 62a_100000739446_100011215043 [1,1,0,0,0,0|2,0,0]=4 3565 B12R1.267 OCCCSc1ccccc1O 62a_100011215043_100000739446 [1,1,0,0,0,0|2,0,0]=4 3566 B12R1.267 OCCNCc1ccccc1O 271570a_203496583355_106744479749 [1,1,0,0,0,0|1,0,1]=4 3567 B12R1.267 OCCNCc1ccccc1O 34a_100000185550_100000211926 [1,1,0,0,0,0|1,0,1]=4 3568 B12R1.267 OCCOCc1ccccc1Br 34a_100000756307_100000211926 [1,1,0,0,0,0|1,0,1]=4 3569 B12R1.267 OCCOCc1ccccc1Br 7a_100000756307_100000211926 [1,1,0,0,0,0|1,0,1]=4 3570 B12R1.267 OCCOCc1ccccc1Cl 34a_100000210847_100000211926 [1,1,0,0,0,0|1,0,1]=4 3571 B12R1.267 OCCOCc1ccccc1Cl 7a_100000210847_100000211926 [1,1,0,0,0,0|1,0,1]=4 3572 B12R1.267 OCCOCc1ccccc1F 34a_100000211962_100000211926 [1,1,0,0,0,0|1,0,1]=4 3573 B12R1.267 OCCOCc1ccccc1F 7a_100000211962_100000211926 [1,1,0,0,0,0|1,0,1]=4 3574 B12R1.267 OCCOCc1ccccc1I 34a_100000187465_100000211926 [1,1,0,0,0,0|1,0,1]=4 3575 B12R1.267 OCCOCc1ccccc1I 7a_100000187465_100000211926 [1,1,0,0,0,0|1,0,1]=4 3576 B12R1.267 Oc1ccccc1CNCCF 34a_100000185550_100011217306 [1,1,0,0,0,0|1,0,1]=4 3577 B12R1.267 Oc1ccccc1NCCCF 34a_100000185747_100011934791 [1,1,0,0,0,0|2,0,0]=4 3578 B12R1.267 Oc1ccccc1SCCCF 62a_100000739446_100011934791 [1,1,0,0,0,0|2,0,0]=4 3579 B12R1.267 Oc1ccccc1SCCCF 62a_100011934791_100000739446 [1,1,0,0,0,0|2,0,0]=4 3580 B12R1.267 Oc1cccnc1COCCBr 34a_100000211926_200020655725 [1,1,0,0,0,0|1,0,1]=4 3581 B12R1.371 CCC(=O)Cc1ccccc1O 1458a_100000743006_100000210202 [1,1,0,0,0,0|1,0,1]=4 3582 B12R1.371 CCC(=O)Nc1ccccc1O 22a_100000185747_100000210414 [1,1,0,0,0,0|2,0,0]=4 3583 B12R1.371 CCC(=O)Nc1ccccc1O 271570a_203496583355_100000153536 [1,1,0,0,0,0|2,0,0]=4 3584 B12R1.371 CCC(=O)Nc1ccccc1O 527a_100000185747_100000210414 [1,1,0,0,0,0|2,0,0]=4 3585 B12R1.371 CCC(C)Nc1ccccc1O 34a_100000185747_100011215416 [1,1,0,0,0,0|2,0,0]=4 3586 B12R1.371 CCC(C)Sc1ccccc1O 62a_100000739446_100000758301 [1,1,0,0,0,0|2,0,0]=4 3587 B12R1.371 CCC(C)Sc1ccccc1O 62a_100000758301_100000739446 [1,1,0,0,0,0|2,0,0]=4 3588 B12R1.371 CCN(C)Cc1ccccc1O 2230a_100011223546_200000210301 [1,1,0,0,0,0|1,0,1]=4 3589 B12R1.371 CCN(C)Cc1ccccc1O 2230a_100015189988_100000210202 [1,1,0,0,0,0|1,0,1]=4 3590 B12R1.371 CCN(C)Cc1ccccc1O 269982a_100011223546_200000210301 [1,1,0,0,0,0|1,0,1]=4 3591 B12R1.371 CCN(C)Cc1ccccc1O 269982a_100015189988_100000204670 [1,1,0,0,0,0|1,0,1]=4 3592 B12R1.371 CCN([13CH3])Cc1ccccc1O 2230a_100011223546_200025704644 [1,1,0,0,0,0|1,0,1]=4 3593 B12R1.371 CCN([13CH3])Cc1ccccc1O 269982a_100011223546_200025704644 [1,1,0,0,0,0|1,0,1]=4 3594 B12R1.374 CCCCc1cc(ccc1O)Br 271570a_100020621405_100012355227 [1,1,0,0,0,0|1,0,1]=4 3595 B12R1.374 CCCCc1cc(ccc1O)C 271570a_100020621405_100000765521 [1,1,0,0,0,0|1,0,1]=4 3596 B12R1.374 CCCCc1cc(ccc1O)Cl 271570a_100020621405_100011356953 [1,1,0,0,0,0|1,0,1]=4 3597 B12R1.374 CCCCc1cc(ccc1O)F 271570a_100020621405_100000211999 [1,1,0,0,0,0|1,0,1]=4 3598 B12R1.374 CCCCc1cc(ccc1O)N 271570a_100020621405_100011534360 [1,1,0,0,0,0|1,0,1]=4 3599 B12R1.374 CCCCc1cc(ccc1O)O 271570a_100020621405_100009813629 [1,1,0,0,0,0|1,0,1]=4 3600 B12R1.374 CCCNc1cc(ccc1O)Br 34a_100000752626_100000210303 [1,1,0,0,0,0|2,0,0]=4 3601 B12R1.374 CCCNc1cc(ccc1O)C 34a_100011215204_100000210303 [1,1,0,0,0,0|2,0,0]=4 3602 B12R1.374 CCCNc1cc(ccc1O)Cl 34a_100000210500_100000210303 [1,1,0,0,0,0|2,0,0]=4 3603 B12R1.374 CCCNc1cc(ccc1O)F 34a_100000759472_100000210303 [1,1,0,0,0,0|2,0,0]=4 3604 B12R1.374 CCCOc1cc(ccc1O)F 271570a_203496583355_200012344540 [1,1,0,0,0,0|2,0,0]=4 3605 B12R1.374 CCCSc1cc(ccc1O)Br 62a_100000210303_100012355227 [1,1,0,0,0,0|2,0,0]=4 3606 B12R1.374 CCCSc1cc(ccc1O)Br 62a_100012355227_100000210303 [1,1,0,0,0,0|2,0,0]=4 3607 B12R1.374 CCCSc1cc(ccc1O)C 62a_100000210303_100000765521 [1,1,0,0,0,0|2,0,0]=4 3608 B12R1.374 CCCSc1cc(ccc1O)C 62a_100000765521_100000210303 [1,1,0,0,0,0|2,0,0]=4 3609 B12R1.374 CCCSc1cc(ccc1O)Cl 62a_100000210303_100011356953 [1,1,0,0,0,0|2,0,0]=4 3610 B12R1.374 CCCSc1cc(ccc1O)Cl 62a_100011356953_100000210303 [1,1,0,0,0,0|2,0,0]=4 3611 B12R1.374 CCCSc1cc(ccc1O)F 62a_100000210303_100000211999 [1,1,0,0,0,0|2,0,0]=4 3612 B12R1.374 CCCSc1cc(ccc1O)F 62a_100000211999_100000210303 [1,1,0,0,0,0|2,0,0]=4 3613 B12R1.374 CCCSc1cc(ccc1O)N 62a_100000210303_100011534360 [1,1,0,0,0,0|2,0,0]=4 3614 B12R1.374 CCCSc1cc(ccc1O)N 62a_100011534360_100000210303 [1,1,0,0,0,0|2,0,0]=4 3615 B12R1.374 CCCSc1cc(ccc1O)O 62a_100000210303_100009813629 [1,1,0,0,0,0|2,0,0]=4 3616 B12R1.374 CCNCc1cc(ccc1O)Br 34a_100000730032_100000210202 [1,1,0,0,0,0|1,0,1]=4 3617 B12R1.374 CCNCc1cc(ccc1O)Cl 34a_100000238540_100000210202 [1,1,0,0,0,0|1,0,1]=4 3618 B12R1.374 CCNCc1cc(ccc1O)O 271570a_203496583355_100000765307 [1,1,0,0,0,0|1,0,1]=4 3619 B12R1.374 CCOCc1cc(ccc1Br)Br 34a_100011266457_100000210202 [1,1,0,0,0,0|1,0,1]=4 3620 B12R1.374 CCOCc1cc(ccc1Br)Br 34a_100121572206_100011982794 [1,1,0,0,0,0|1,0,1]=4 3621 B12R1.374 CCOCc1cc(ccc1Br)Br 7a_100011266457_100000210202 [1,1,0,0,0,0|1,0,1]=4 3622 B12R1.374 CCOCc1cc(ccc1Br)C 34a_100012361352_100000210202 [1,1,0,0,0,0|1,0,1]=4 3623 B12R1.374 CCOCc1cc(ccc1Br)C 7a_100012361352_100000210202 [1,1,0,0,0,0|1,0,1]=4 3624 B12R1.374 CCOCc1cc(ccc1Br)Cl 34a_100012355668_100000210202 [1,1,0,0,0,0|1,0,1]=4 3625 B12R1.374 CCOCc1cc(ccc1Br)Cl 34a_100121572206_100000733903 [1,1,0,0,0,0|1,0,1]=4 3626 B12R1.374 CCOCc1cc(ccc1Br)Cl 7a_100012355668_100000210202 [1,1,0,0,0,0|1,0,1]=4 3627 B12R1.374 CCOCc1cc(ccc1Br)F 34a_100011217561_100000210202 [1,1,0,0,0,0|1,0,1]=4 3628 B12R1.374 CCOCc1cc(ccc1Br)F 34a_100121572206_100000736370 [1,1,0,0,0,0|1,0,1]=4 3629 B12R1.374 CCOCc1cc(ccc1Br)F 7a_100011217561_100000210202 [1,1,0,0,0,0|1,0,1]=4 3630 B12R1.374 CCOCc1cc(ccc1Br)I 34a_100121572206_100012355412 [1,1,0,0,0,0|1,0,1]=4 3631 B12R1.374 CCOCc1cc(ccc1Br)I 7a_100012359683_100000210202 [1,1,0,0,0,0|1,0,1]=4 3632 B12R1.374 CCOCc1cc(ccc1Br)N 34a_100012347228_100000210202 [1,1,0,0,0,0|1,0,1]=4 3633 B12R1.374 CCOCc1cc(ccc1C)Br 34a_100000700630_100000210202 [1,1,0,0,0,0|1,0,1]=4 3634 B12R1.374 CCOCc1cc(ccc1C)Br 7a_100000700630_100000210202 [1,1,0,0,0,0|1,0,1]=4 3635 B12R1.374 CCOCc1cc(ccc1C)C 34a_100121572206_100000184699 [1,1,0,0,0,0|1,0,1]=4 3636 B12R1.374 CCOCc1cc(ccc1C)C 34a_200011215349_100000210202 [1,1,0,0,0,0|1,0,1]=4 3637 B12R1.374 CCOCc1cc(ccc1C)C 7a_200011215349_100000210202 [1,1,0,0,0,0|1,0,1]=4 3638 B12R1.374 CCOCc1cc(ccc1C)Cl 34a_100012002407_100000210202 [1,1,0,0,0,0|1,0,1]=4 3639 B12R1.374 CCOCc1cc(ccc1C)Cl 34a_100121572206_100012186985 [1,1,0,0,0,0|1,0,1]=4 3640 B12R1.374 CCOCc1cc(ccc1C)Cl 7a_100012002407_100000210202 [1,1,0,0,0,0|1,0,1]=4 3641 B12R1.374 CCOCc1cc(ccc1C)F 34a_100011219218_100000210202 [1,1,0,0,0,0|1,0,1]=4 3642 B12R1.374 CCOCc1cc(ccc1C)F 34a_100121572206_100000709795 [1,1,0,0,0,0|1,0,1]=4 3643 B12R1.374 CCOCc1cc(ccc1C)F 7a_100011219218_100000210202 [1,1,0,0,0,0|1,0,1]=4 3644 B12R1.374 CCOCc1cc(ccc1C)I 34a_100010150140_100000210202 [1,1,0,0,0,0|1,0,1]=4 3645 B12R1.374 CCOCc1cc(ccc1C)I 7a_100010150140_100000210202 [1,1,0,0,0,0|1,0,1]=4 3646 B12R1.374 CCOCc1cc(ccc1Cl)Br 34a_100011215897_100000210202 [1,1,0,0,0,0|1,0,1]=4 3647 B12R1.374 CCOCc1cc(ccc1Cl)Br 34a_100121572206_100000763347 [1,1,0,0,0,0|1,0,1]=4 3648 B12R1.374 CCOCc1cc(ccc1Cl)Br 7a_100011215897_100000210202 [1,1,0,0,0,0|1,0,1]=4 3649 B12R1.374 CCOCc1cc(ccc1Cl)C 34a_100009878994_100000210202 [1,1,0,0,0,0|1,0,1]=4 3650 B12R1.374 CCOCc1cc(ccc1Cl)C 34a_100121572206_100009871730 [1,1,0,0,0,0|1,0,1]=4 3651 B12R1.374 CCOCc1cc(ccc1Cl)C 7a_100009878994_100000210202 [1,1,0,0,0,0|1,0,1]=4 3652 B12R1.374 CCOCc1cc(ccc1Cl)Cl 34a_100000698905_100000210202 [1,1,0,0,0,0|1,0,1]=4 3653 B12R1.374 CCOCc1cc(ccc1Cl)Cl 34a_100121572206_100000756322 [1,1,0,0,0,0|1,0,1]=4 3654 B12R1.374 CCOCc1cc(ccc1Cl)Cl 7a_100000698905_100000210202 [1,1,0,0,0,0|1,0,1]=4 3655 B12R1.374 CCOCc1cc(ccc1Cl)F 34a_100011218361_100000210202 [1,1,0,0,0,0|1,0,1]=4 3656 B12R1.374 CCOCc1cc(ccc1Cl)F 34a_100121572206_100000709952 [1,1,0,0,0,0|1,0,1]=4 3657 B12R1.374 CCOCc1cc(ccc1Cl)F 7a_100011218361_100000210202 [1,1,0,0,0,0|1,0,1]=4 3658 B12R1.374 CCOCc1cc(ccc1Cl)I 34a_100010128486_100000210202 [1,1,0,0,0,0|1,0,1]=4 3659 B12R1.374 CCOCc1cc(ccc1Cl)I 34a_100121572206_100010188191 [1,1,0,0,0,0|1,0,1]=4 3660 B12R1.374 CCOCc1cc(ccc1Cl)I 7a_100010128486_100000210202 [1,1,0,0,0,0|1,0,1]=4 3661 B12R1.374 CCOCc1cc(ccc1Cl)N 34a_100011273577_100000210202 [1,1,0,0,0,0|1,0,1]=4 3662 B12R1.374 CCOCc1cc(ccc1F)Br 34a_100000246282_100000210202 [1,1,0,0,0,0|1,0,1]=4 3663 B12R1.374 CCOCc1cc(ccc1F)Br 34a_100121572206_100000736399 [1,1,0,0,0,0|1,0,1]=4 3664 B12R1.374 CCOCc1cc(ccc1F)Br 7a_100000246282_100000210202 [1,1,0,0,0,0|1,0,1]=4 3665 B12R1.374 CCOCc1cc(ccc1F)C 34a_100011692775_100000210202 [1,1,0,0,0,0|1,0,1]=4 3666 B12R1.374 CCOCc1cc(ccc1F)C 34a_100121572206_100011260760 [1,1,0,0,0,0|1,0,1]=4 3667 B12R1.374 CCOCc1cc(ccc1F)C 7a_100011692775_100000210202 [1,1,0,0,0,0|1,0,1]=4 3668 B12R1.374 CCOCc1cc(ccc1F)Cl 34a_100011217248_100000210202 [1,1,0,0,0,0|1,0,1]=4 3669 B12R1.374 CCOCc1cc(ccc1F)Cl 34a_100121572206_100000716957 [1,1,0,0,0,0|1,0,1]=4 3670 B12R1.374 CCOCc1cc(ccc1F)Cl 7a_100011217248_100000210202 [1,1,0,0,0,0|1,0,1]=4 3671 B12R1.374 CCOCc1cc(ccc1F)F 34a_100011217725_100000210202 [1,1,0,0,0,0|1,0,1]=4 3672 B12R1.374 CCOCc1cc(ccc1F)F 34a_100121572206_100000741279 [1,1,0,0,0,0|1,0,1]=4 3673 B12R1.374 CCOCc1cc(ccc1F)F 7a_100011217725_100000210202 [1,1,0,0,0,0|1,0,1]=4 3674 B12R1.374 CCOCc1cc(ccc1F)I 34a_100000049604_100000210202 [1,1,0,0,0,0|1,0,1]=4 3675 B12R1.374 CCOCc1cc(ccc1F)I 34a_100121572206_200010149601 [1,1,0,0,0,0|1,0,1]=4 3676 B12R1.374 CCOCc1cc(ccc1F)I 7a_100000049604_100000210202 [1,1,0,0,0,0|1,0,1]=4 3677 B12R1.374 CCOCc1cc(ccc1F)N 34a_100011218011_100000210202 [1,1,0,0,0,0|1,0,1]=4 3678 B12R1.374 CCOCc1cc(ccc1I)Br 34a_100011356890_100000210202 [1,1,0,0,0,0|1,0,1]=4 3679 B12R1.374 CCOCc1cc(ccc1I)Br 34a_100121572206_100012362523 [1,1,0,0,0,0|1,0,1]=4 3680 B12R1.374 CCOCc1cc(ccc1I)Br 7a_100011356890_100000210202 [1,1,0,0,0,0|1,0,1]=4 3681 B12R1.374 CCOCc1cc(ccc1I)Cl 34a_100121572206_100012348826 [1,1,0,0,0,0|1,0,1]=4 3682 B12R1.374 CCOCc1cc(ccc1I)F 34a_100010255287_100000210202 [1,1,0,0,0,0|1,0,1]=4 3683 B12R1.374 CCOCc1cc(ccc1I)F 34a_100121572206_100010149606 [1,1,0,0,0,0|1,0,1]=4 3684 B12R1.374 CCOCc1cc(ccc1I)F 7a_100010255287_100000210202 [1,1,0,0,0,0|1,0,1]=4 3685 B12R1.374 CCOCc1cc(ccc1N)Br 34a_100012353972_100000210202 [1,1,0,0,0,0|1,0,1]=4 3686 B12R1.374 CCOCc1cc(ccc1N)Br 7a_100012353972_100000210202 [1,1,0,0,0,0|1,0,1]=4 3687 B12R1.374 CCOCc1cc(ccc1N)C 34a_100011215565_100000210202 [1,1,0,0,0,0|1,0,1]=4 3688 B12R1.374 CCOCc1cc(ccc1N)C 7a_100011215565_100000210202 [1,1,0,0,0,0|1,0,1]=4 3689 B12R1.374 CCOCc1cc(ccc1N)Cl 34a_100011214999_100000210202 [1,1,0,0,0,0|1,0,1]=4 3690 B12R1.374 CCOCc1cc(ccc1N)Cl 7a_100011214999_100000210202 [1,1,0,0,0,0|1,0,1]=4 3691 B12R1.374 CCOCc1cc(ccc1N)F 34a_100011296978_100000210202 [1,1,0,0,0,0|1,0,1]=4 3692 B12R1.374 CCOCc1cc(ccc1N)F 7a_100011296978_100000210202 [1,1,0,0,0,0|1,0,1]=4 3693 B12R1.374 CCOCc1cc(ccc1O)F 34a_100121572206_100010161318 [1,1,0,0,0,0|0,0,1]=3 3694 B12R1.374 CCOCc1nc(ccc1O)C 34a_100121572206_100020630696 [1,1,0,0,0,0|1,0,1]=4 3695 B12R1.374 CCSCc1cc(ccc1O)F 62a_100000210202_100010161318 [1,1,0,0,0,0|0,1,1]=4 3696 B12R1.374 CCSCc1cc(ccc1O)F 62a_100010161318_100000210202 [1,1,0,0,0,0|0,1,1]=4 3697 B12R1.1631 CCCCc1c(cccc1Br)O 271570a_100020621405_100010187912 [1,1,0,0,0,0|1,0,1]=4 3698 B12R1.1631 CCCCc1c(cccc1Cl)O 271570a_100020621405_100000050174 [1,1,0,0,0,0|1,0,1]=4 3699 B12R1.1631 CCCCc1c(cccc1F)O 271570a_100020621405_100009820682 [1,1,0,0,0,0|1,0,1]=4 3700 B12R1.1631 CCCCc1c(cccc1O)C 271570a_100020621405_100000686692 [1,1,0,0,0,0|1,0,1]=4 3701 B12R1.1631 CCCCc1c(cccc1O)N 271570a_100020621405_100012183704 [1,1,0,0,0,0|1,0,1]=4 3702 B12R1.1631 CCCCc1c(cccc1O)O 271570a_100020621405_100010205330 [1,1,0,0,0,0|1,0,1]=4 3703 B12R1.1631 CCCNc1c(cccc1Br)O 34a_100011934926_100000210303 [1,1,0,0,0,0|2,0,0]=4 3704 B12R1.1631 CCCNc1c(cccc1Cl)O 34a_100012022510_100000210303 [1,1,0,0,0,0|2,0,0]=4 3705 B12R1.1631 CCCNc1c(cccc1F)O 34a_100020591140_100000210303 [1,1,0,0,0,0|2,0,0]=4 3706 B12R1.1631 CCCNc1c(cccc1O)C 34a_100000743429_100000210303 [1,1,0,0,0,0|2,0,0]=4 3707 B12R1.1631 CCCSc1c(cccc1Br)O 62a_100000210303_100010187912 [1,1,0,0,0,0|2,0,0]=4 3708 B12R1.1631 CCCSc1c(cccc1Br)O 62a_100010187912_100000210303 [1,1,0,0,0,0|2,0,0]=4 3709 B12R1.1631 CCCSc1c(cccc1Cl)O 62a_100000210303_100000050174 [1,1,0,0,0,0|2,0,0]=4 3710 B12R1.1631 CCCSc1c(cccc1F)O 62a_100000210303_100009820682 [1,1,0,0,0,0|2,0,0]=4 3711 B12R1.1631 CCCSc1c(cccc1F)O 62a_100009820682_100000210303 [1,1,0,0,0,0|2,0,0]=4 3712 B12R1.1631 CCCSc1c(cccc1O)C 62a_100000210303_100000686692 [1,1,0,0,0,0|2,0,0]=4 3713 B12R1.1631 CCCSc1c(cccc1O)C 62a_100000686692_100000210303 [1,1,0,0,0,0|2,0,0]=4 3714 B12R1.1631 CCCSc1c(cccc1O)N 62a_100000210303_100012183704 [1,1,0,0,0,0|2,0,0]=4 3715 B12R1.1631 CCCSc1c(cccc1O)N 62a_100012183704_100000210303 [1,1,0,0,0,0|2,0,0]=4 3716 B12R1.1631 CCCSc1c(cccc1O)O 62a_100000210303_100010205330 [1,1,0,0,0,0|2,0,0]=4 3717 B12R1.1631 CCOCc1c(cccc1Br)Br 34a_100010172814_100000210202 [1,1,0,0,0,0|1,0,1]=4 3718 B12R1.1631 CCOCc1c(cccc1Br)Br 7a_100010172814_100000210202 [1,1,0,0,0,0|1,0,1]=4 3719 B12R1.1631 CCOCc1c(cccc1Br)C 34a_100121572206_100010146847 [1,1,0,0,0,0|1,0,1]=4 3720 B12R1.1631 CCOCc1c(cccc1Br)Cl 34a_100121572206_100010138402 [1,1,0,0,0,0|1,0,1]=4 3721 B12R1.1631 CCOCc1c(cccc1Br)F 34a_100012355691_100000210202 [1,1,0,0,0,0|1,0,1]=4 3722 B12R1.1631 CCOCc1c(cccc1Br)F 34a_100121572206_100012145669 [1,1,0,0,0,0|1,0,1]=4 3723 B12R1.1631 CCOCc1c(cccc1Br)F 7a_100012355691_100000210202 [1,1,0,0,0,0|1,0,1]=4 3724 B12R1.1631 CCOCc1c(cccc1Br)N 34a_100000747656_100000210202 [1,1,0,0,0,0|1,0,1]=4 3725 B12R1.1631 CCOCc1c(cccc1C)C 34a_100011933981_100000210202 [1,1,0,0,0,0|1,0,1]=4 3726 B12R1.1631 CCOCc1c(cccc1C)C 34a_100121572206_100000758300 [1,1,0,0,0,0|1,0,1]=4 3727 B12R1.1631 CCOCc1c(cccc1C)C 7a_100011933981_100000210202 [1,1,0,0,0,0|1,0,1]=4 3728 B12R1.1631 CCOCc1c(cccc1Cl)C 34a_100000082531_100000210202 [1,1,0,0,0,0|1,0,1]=4 3729 B12R1.1631 CCOCc1c(cccc1Cl)C 7a_100000082531_100000210202 [1,1,0,0,0,0|1,0,1]=4 3730 B12R1.1631 CCOCc1c(cccc1Cl)Cl 34a_100000215722_100000210202 [1,1,0,0,0,0|1,0,1]=4 3731 B12R1.1631 CCOCc1c(cccc1Cl)Cl 34a_100121572206_100000187851 [1,1,0,0,0,0|1,0,1]=4 3732 B12R1.1631 CCOCc1c(cccc1Cl)Cl 7a_100000215722_100000210202 [1,1,0,0,0,0|1,0,1]=4 3733 B12R1.1631 CCOCc1c(cccc1Cl)F 34a_100000215723_100000210202 [1,1,0,0,0,0|1,0,1]=4 3734 B12R1.1631 CCOCc1c(cccc1Cl)F 34a_100121572206_100000187852 [1,1,0,0,0,0|1,0,1]=4 3735 B12R1.1631 CCOCc1c(cccc1Cl)F 7a_100000215723_100000210202 [1,1,0,0,0,0|1,0,1]=4 3736 B12R1.1631 CCOCc1c(cccc1Cl)N 34a_100011916388_100000210202 [1,1,0,0,0,0|1,0,1]=4 3737 B12R1.1631 CCOCc1c(cccc1F)C 34a_100000057874_100000210202 [1,1,0,0,0,0|1,0,1]=4 3738 B12R1.1631 CCOCc1c(cccc1F)C 34a_100121572206_100009814554 [1,1,0,0,0,0|1,0,1]=4 3739 B12R1.1631 CCOCc1c(cccc1F)C 7a_100000057874_100000210202 [1,1,0,0,0,0|1,0,1]=4 3740 B12R1.1631 CCOCc1c(cccc1F)F 34a_100000698215_100000210202 [1,1,0,0,0,0|1,0,1]=4 3741 B12R1.1631 CCOCc1c(cccc1F)F 34a_100121572206_100000698325 [1,1,0,0,0,0|1,0,1]=4 3742 B12R1.1631 CCOCc1c(cccc1F)F 7a_100000698215_100000210202 [1,1,0,0,0,0|1,0,1]=4 3743 B12R1.1631 CCOCc1c(cccc1F)N 34a_100011846719_100000210202 [1,1,0,0,0,0|1,0,1]=4 3744 B12R1.1631 CCOCc1c(cccc1I)Br 34a_100121572206_100010146611 [1,1,0,0,0,0|1,0,1]=4 3745 B12R1.1631 CCOCc1c(cccc1I)C 34a_100121572206_100010150146 [1,1,0,0,0,0|1,0,1]=4 3746 B12R1.1631 CCOCc1c(cccc1I)F 34a_100010214973_100000210202 [1,1,0,0,0,0|1,0,1]=4 3747 B12R1.1631 CCOCc1c(cccc1I)F 34a_100121572206_100010149602 [1,1,0,0,0,0|1,0,1]=4 3748 B12R1.1631 CCOCc1c(cccc1I)F 7a_100010214973_100000210202 [1,1,0,0,0,0|1,0,1]=4 3749 B12R1.24 CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210202 [1,1,0,0,0,0|1,0,0]=3 3750 B12R1.24 CCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210202 [1,1,0,0,0,0|1,0,0]=3 3751 B12R1.24 CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210202 [1,1,0,0,0,0|1,0,0]=3 3752 B12R1.24 CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210202 [1,1,0,0,0,0|1,0,0]=3 3753 B12R1.24 CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210202 [1,1,0,0,0,0|1,0,0]=3 3754 B12R1.24 CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210202 [1,1,0,0,0,0|1,0,0]=3 3755 B12R1.24 CCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210202 [1,1,0,0,0,0|1,0,0]=3 3756 B12R1.24 CCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210202 [1,1,0,0,0,0|1,0,0]=3 3757 B12R1.24 CCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210202 [1,1,0,0,0,0|1,0,0]=3 3758 B12R1.24 CCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210202 [1,1,0,0,0,0|1,0,0]=3 3759 B12R1.24 CCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210202 [1,1,0,0,0,0|1,0,0]=3 3760 B12R1.24 CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210202 [1,1,0,0,0,0|1,0,0]=3 3761 B12R1.24 CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210202 [1,1,0,0,0,0|1,0,0]=3 3762 B12R1.24 CCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210202 [1,1,0,0,0,0|1,0,0]=3 3763 B12R1.24 CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210202 [1,1,0,0,0,0|1,0,0]=3 3764 B12R1.24 CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210202 [1,1,0,0,0,0|1,0,0]=3 3765 B12R1.24 CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210202 [1,1,0,0,0,0|1,0,0]=3 3766 B12R1.24 CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210202 [1,1,0,0,0,0|1,0,0]=3 3767 B12R1.24 CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210202 [1,1,0,0,0,0|1,0,0]=3 3768 B12R1.24 CCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210202 [1,1,0,0,0,0|1,0,0]=3 3769 B12R1.24 CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210202 [1,1,0,0,0,0|1,0,0]=3 3770 B12R1.24 CCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210202 [1,1,0,0,0,0|1,0,0]=3 3771 B12R1.24 CCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210202 [1,1,0,0,0,0|1,0,0]=3 3772 B12R1.24 CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210202 [1,1,0,0,0,0|1,0,0]=3 3773 B12R1.24 CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210202 [1,1,0,0,0,0|1,0,0]=3 3774 B12R1.24 CCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210202 [1,1,0,0,0,0|1,0,0]=3 3775 B12R1.24 CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210202 [1,1,0,0,0,0|1,0,0]=3 3776 B12R1.24 CCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210202 [1,1,0,0,0,0|1,0,0]=3 3777 B12R1.24 CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210202 [1,1,0,0,0,0|1,0,0]=3 3778 B12R1.24 CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210202 [1,1,0,0,0,0|0,0,0]=2 3779 B12R1.24 CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210202 [1,1,0,0,0,0|0,0,0]=2 3780 B12R1.24 CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210202 [1,1,0,0,0,0|0,0,0]=2 3781 B12R1.24 CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210202 [1,1,0,0,0,0|0,0,0]=2 3782 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [1,1,0,0,0,0|0,0,0]=2 3783 B12R1.24 CNC(=O)c1cccc(c1Br)Br 11a_106832991635_100012360534 [1,1,0,0,0,0|2,0,0]=4 3784 B12R1.24 CNC(=O)c1cccc(c1Br)Br 1626a_100102657272_100012360534 [1,1,0,0,0,0|2,0,0]=4 3785 B12R1.24 CNC(=O)c1cccc(c1Br)Br 240690a_100102657272_100012360534 [1,1,0,0,0,0|2,0,0]=4 3786 B12R1.24 CNC(=O)c1cccc(c1Br)Br 527a_100102657272_100012360534 [1,1,0,0,0,0|2,0,0]=4 3787 B12R1.24 CNC(=O)c1cccc(c1Br)C 11a_106832991635_100000692419 [1,1,0,0,0,0|2,0,0]=4 3788 B12R1.24 CNC(=O)c1cccc(c1Br)C 1626a_100102657272_100000692419 [1,1,0,0,0,0|2,0,0]=4 3789 B12R1.24 CNC(=O)c1cccc(c1Br)C 240690a_100102657272_100000692419 [1,1,0,0,0,0|2,0,0]=4 3790 B12R1.24 CNC(=O)c1cccc(c1Br)C 527a_100102657272_100000692419 [1,1,0,0,0,0|2,0,0]=4 3791 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 11a_106832991635_100012339722 [1,1,0,0,0,0|2,0,0]=4 3792 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 1626a_100102657272_100012339722 [1,1,0,0,0,0|2,0,0]=4 3793 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 240690a_100102657272_100012339722 [1,1,0,0,0,0|2,0,0]=4 3794 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 527a_100102657272_100012339722 [1,1,0,0,0,0|2,0,0]=4 3795 B12R1.24 CNC(=O)c1cccc(c1Br)F 11a_106832991635_100011217547 [1,1,0,0,0,0|2,0,0]=4 3796 B12R1.24 CNC(=O)c1cccc(c1Br)F 1626a_100102657272_100011217547 [1,1,0,0,0,0|2,0,0]=4 3797 B12R1.24 CNC(=O)c1cccc(c1Br)F 240690a_100102657272_100011217547 [1,1,0,0,0,0|2,0,0]=4 3798 B12R1.24 CNC(=O)c1cccc(c1Br)F 527a_100102657272_100011217547 [1,1,0,0,0,0|2,0,0]=4 3799 B12R1.24 CNC(=O)c1cccc(c1Br)I 11a_106832991635_100010232522 [1,1,0,0,0,0|2,0,0]=4 3800 B12R1.24 CNC(=O)c1cccc(c1Br)I 1626a_100102657272_100010232522 [1,1,0,0,0,0|2,0,0]=4 3801 B12R1.24 CNC(=O)c1cccc(c1Br)I 240690a_100102657272_100010232522 [1,1,0,0,0,0|2,0,0]=4 3802 B12R1.24 CNC(=O)c1cccc(c1Br)I 527a_100102657272_100010232522 [1,1,0,0,0,0|2,0,0]=4 3803 B12R1.24 CNC(=O)c1cccc(c1Br)O 240690a_100102657272_100010230362 [1,1,0,0,0,0|2,0,0]=4 3804 B12R1.24 CNC(=O)c1cccc(c1Br)O 527a_100102657272_100010230362 [1,1,0,0,0,0|2,0,0]=4 3805 B12R1.24 CNC(=O)c1cccc(c1C)Br 11a_106832991635_100000760464 [1,1,0,0,0,0|2,0,0]=4 3806 B12R1.24 CNC(=O)c1cccc(c1C)Br 1626a_100102657272_100000760464 [1,1,0,0,0,0|2,0,0]=4 3807 B12R1.24 CNC(=O)c1cccc(c1C)Br 240690a_100102657272_100000760464 [1,1,0,0,0,0|2,0,0]=4 3808 B12R1.24 CNC(=O)c1cccc(c1C)Br 527a_100102657272_100000760464 [1,1,0,0,0,0|2,0,0]=4 3809 B12R1.24 CNC(=O)c1cccc(c1C)C 11a_106832991635_100000183679 [1,1,0,0,0,0|2,0,0]=4 3810 B12R1.24 CNC(=O)c1cccc(c1C)C 1626a_100102657272_100000183679 [1,1,0,0,0,0|2,0,0]=4 3811 B12R1.24 CNC(=O)c1cccc(c1C)C 240690a_100102657272_100000183679 [1,1,0,0,0,0|2,0,0]=4 3812 B12R1.24 CNC(=O)c1cccc(c1C)C 527a_100102657272_100000183679 [1,1,0,0,0,0|2,0,0]=4 3813 B12R1.24 CNC(=O)c1cccc(c1C)Cl 11a_106832991635_100000690184 [1,1,0,0,0,0|2,0,0]=4 3814 B12R1.24 CNC(=O)c1cccc(c1C)Cl 1626a_100102657272_100000690184 [1,1,0,0,0,0|2,0,0]=4 3815 B12R1.24 CNC(=O)c1cccc(c1C)Cl 240690a_100102657272_100000690184 [1,1,0,0,0,0|2,0,0]=4 3816 B12R1.24 CNC(=O)c1cccc(c1C)Cl 527a_100102657272_100000690184 [1,1,0,0,0,0|2,0,0]=4 3817 B12R1.24 CNC(=O)c1cccc(c1C)F 11a_106832991635_100011218272 [1,1,0,0,0,0|2,0,0]=4 3818 B12R1.24 CNC(=O)c1cccc(c1C)F 1626a_100102657272_100011218272 [1,1,0,0,0,0|2,0,0]=4 3819 B12R1.24 CNC(=O)c1cccc(c1C)F 240690a_100102657272_100011218272 [1,1,0,0,0,0|2,0,0]=4 3820 B12R1.24 CNC(=O)c1cccc(c1C)F 527a_100102657272_100011218272 [1,1,0,0,0,0|2,0,0]=4 3821 B12R1.24 CNC(=O)c1cccc(c1C)I 11a_106832991635_100000751865 [1,1,0,0,0,0|2,0,0]=4 3822 B12R1.24 CNC(=O)c1cccc(c1C)I 1626a_100102657272_100000751865 [1,1,0,0,0,0|2,0,0]=4 3823 B12R1.24 CNC(=O)c1cccc(c1C)I 240690a_100102657272_100000751865 [1,1,0,0,0,0|2,0,0]=4 3824 B12R1.24 CNC(=O)c1cccc(c1C)I 527a_100102657272_100000751865 [1,1,0,0,0,0|2,0,0]=4 3825 B12R1.24 CNC(=O)c1cccc(c1C)O 240690a_100102657272_100000766327 [1,1,0,0,0,0|2,0,0]=4 3826 B12R1.24 CNC(=O)c1cccc(c1C)O 527a_100102657272_100000766327 [1,1,0,0,0,0|2,0,0]=4 3827 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 11a_106832991635_100000760540 [1,1,0,0,0,0|2,0,0]=4 3828 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 1626a_100102657272_100000760540 [1,1,0,0,0,0|2,0,0]=4 3829 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 240690a_100102657272_100000760540 [1,1,0,0,0,0|2,0,0]=4 3830 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 527a_100102657272_100000760540 [1,1,0,0,0,0|2,0,0]=4 3831 B12R1.24 CNC(=O)c1cccc(c1Cl)C 11a_106832991635_100000693142 [1,1,0,0,0,0|2,0,0]=4 3832 B12R1.24 CNC(=O)c1cccc(c1Cl)C 1626a_100102657272_100000693142 [1,1,0,0,0,0|2,0,0]=4 3833 B12R1.24 CNC(=O)c1cccc(c1Cl)C 240690a_100102657272_100000693142 [1,1,0,0,0,0|2,0,0]=4 3834 B12R1.24 CNC(=O)c1cccc(c1Cl)C 527a_100102657272_100000693142 [1,1,0,0,0,0|2,0,0]=4 3835 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 11a_106832991635_100000183631 [1,1,0,0,0,0|2,0,0]=4 3836 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 1626a_100102657272_100000183631 [1,1,0,0,0,0|2,0,0]=4 3837 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 240690a_100102657272_100000183631 [1,1,0,0,0,0|2,0,0]=4 3838 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 527a_100102657272_100000183631 [1,1,0,0,0,0|2,0,0]=4 3839 B12R1.24 CNC(=O)c1cccc(c1Cl)F 11a_106832991635_100000759904 [1,1,0,0,0,0|2,0,0]=4 3840 B12R1.24 CNC(=O)c1cccc(c1Cl)F 1626a_100102657272_100000759904 [1,1,0,0,0,0|2,0,0]=4 3841 B12R1.24 CNC(=O)c1cccc(c1Cl)F 240690a_100102657272_100000759904 [1,1,0,0,0,0|2,0,0]=4 3842 B12R1.24 CNC(=O)c1cccc(c1Cl)F 527a_100102657272_100000759904 [1,1,0,0,0,0|2,0,0]=4 3843 B12R1.24 CNC(=O)c1cccc(c1Cl)I 11a_106832991635_100010176783 [1,1,0,0,0,0|2,0,0]=4 3844 B12R1.24 CNC(=O)c1cccc(c1Cl)I 1626a_100102657272_100010176783 [1,1,0,0,0,0|2,0,0]=4 3845 B12R1.24 CNC(=O)c1cccc(c1Cl)I 240690a_100102657272_100010176783 [1,1,0,0,0,0|2,0,0]=4 3846 B12R1.24 CNC(=O)c1cccc(c1Cl)I 527a_100102657272_100010176783 [1,1,0,0,0,0|2,0,0]=4 3847 B12R1.24 CNC(=O)c1cccc(c1Cl)O 240690a_100102657272_100000092362 [1,1,0,0,0,0|2,0,0]=4 3848 B12R1.24 CNC(=O)c1cccc(c1Cl)O 527a_100102657272_100000092362 [1,1,0,0,0,0|2,0,0]=4 3849 B12R1.24 CNC(=O)c1cccc(c1F)Br 11a_106832991635_100000756403 [1,1,0,0,0,0|2,0,0]=4 3850 B12R1.24 CNC(=O)c1cccc(c1F)Br 1626a_100102657272_100000756403 [1,1,0,0,0,0|2,0,0]=4 3851 B12R1.24 CNC(=O)c1cccc(c1F)Br 240690a_100102657272_100000756403 [1,1,0,0,0,0|2,0,0]=4 3852 B12R1.24 CNC(=O)c1cccc(c1F)Br 527a_100102657272_100000756403 [1,1,0,0,0,0|2,0,0]=4 3853 B12R1.24 CNC(=O)c1cccc(c1F)C 11a_106832991635_100000766181 [1,1,0,0,0,0|2,0,0]=4 3854 B12R1.24 CNC(=O)c1cccc(c1F)C 1626a_100102657272_100000766181 [1,1,0,0,0,0|2,0,0]=4 3855 B12R1.24 CNC(=O)c1cccc(c1F)C 240690a_100102657272_100000766181 [1,1,0,0,0,0|2,0,0]=4 3856 B12R1.24 CNC(=O)c1cccc(c1F)C 527a_100102657272_100000766181 [1,1,0,0,0,0|2,0,0]=4 3857 B12R1.24 CNC(=O)c1cccc(c1F)Cl 11a_106832991635_100000688816 [1,1,0,0,0,0|2,0,0]=4 3858 B12R1.24 CNC(=O)c1cccc(c1F)Cl 1626a_100102657272_100000688816 [1,1,0,0,0,0|2,0,0]=4 3859 B12R1.24 CNC(=O)c1cccc(c1F)Cl 240690a_100102657272_100000688816 [1,1,0,0,0,0|2,0,0]=4 3860 B12R1.24 CNC(=O)c1cccc(c1F)Cl 527a_100102657272_100000688816 [1,1,0,0,0,0|2,0,0]=4 3861 B12R1.24 CNC(=O)c1cccc(c1F)F 11a_106832991635_100000748134 [1,1,0,0,0,0|2,0,0]=4 3862 B12R1.24 CNC(=O)c1cccc(c1F)F 1626a_100102657272_100000748134 [1,1,0,0,0,0|2,0,0]=4 3863 B12R1.24 CNC(=O)c1cccc(c1F)F 240690a_100102657272_100000748134 [1,1,0,0,0,0|2,0,0]=4 3864 B12R1.24 CNC(=O)c1cccc(c1F)F 527a_100102657272_100000748134 [1,1,0,0,0,0|2,0,0]=4 3865 B12R1.24 CNC(=O)c1cccc(c1F)I 11a_106832991635_100010185205 [1,1,0,0,0,0|2,0,0]=4 3866 B12R1.24 CNC(=O)c1cccc(c1F)I 1626a_100102657272_100010185205 [1,1,0,0,0,0|2,0,0]=4 3867 B12R1.24 CNC(=O)c1cccc(c1F)I 240690a_100102657272_100010185205 [1,1,0,0,0,0|2,0,0]=4 3868 B12R1.24 CNC(=O)c1cccc(c1F)I 527a_100102657272_100010185205 [1,1,0,0,0,0|2,0,0]=4 3869 B12R1.24 CNC(=O)c1cccc(c1F)O 240690a_100102657272_100000037433 [1,1,0,0,0,0|2,0,0]=4 3870 B12R1.24 CNC(=O)c1cccc(c1F)O 527a_100102657272_100000037433 [1,1,0,0,0,0|2,0,0]=4 3871 B12R1.24 CNC(=O)c1cccc(c1I)Br 11a_106832991635_100000688019 [1,1,0,0,0,0|2,0,0]=4 3872 B12R1.24 CNC(=O)c1cccc(c1I)Br 1626a_100102657272_100000688019 [1,1,0,0,0,0|2,0,0]=4 3873 B12R1.24 CNC(=O)c1cccc(c1I)Br 240690a_100102657272_100000688019 [1,1,0,0,0,0|2,0,0]=4 3874 B12R1.24 CNC(=O)c1cccc(c1I)Br 527a_100102657272_100000688019 [1,1,0,0,0,0|2,0,0]=4 3875 B12R1.24 CNC(=O)c1cccc(c1I)C 11a_106832991635_100000739377 [1,1,0,0,0,0|2,0,0]=4 3876 B12R1.24 CNC(=O)c1cccc(c1I)C 1626a_100102657272_100000739377 [1,1,0,0,0,0|2,0,0]=4 3877 B12R1.24 CNC(=O)c1cccc(c1I)C 240690a_100102657272_100000739377 [1,1,0,0,0,0|2,0,0]=4 3878 B12R1.24 CNC(=O)c1cccc(c1I)C 527a_100102657272_100000739377 [1,1,0,0,0,0|2,0,0]=4 3879 B12R1.24 CNC(=O)c1cccc(c1I)Cl 11a_106832991635_100010176784 [1,1,0,0,0,0|2,0,0]=4 3880 B12R1.24 CNC(=O)c1cccc(c1I)Cl 1626a_100102657272_100010176784 [1,1,0,0,0,0|2,0,0]=4 3881 B12R1.24 CNC(=O)c1cccc(c1I)Cl 240690a_100102657272_100010176784 [1,1,0,0,0,0|2,0,0]=4 3882 B12R1.24 CNC(=O)c1cccc(c1I)Cl 527a_100102657272_100010176784 [1,1,0,0,0,0|2,0,0]=4 3883 B12R1.24 CNC(=O)c1cccc(c1I)F 11a_106832991635_100000690930 [1,1,0,0,0,0|2,0,0]=4 3884 B12R1.24 CNC(=O)c1cccc(c1I)F 1626a_100102657272_100000690930 [1,1,0,0,0,0|2,0,0]=4 3885 B12R1.24 CNC(=O)c1cccc(c1I)F 240690a_100102657272_100000690930 [1,1,0,0,0,0|2,0,0]=4 3886 B12R1.24 CNC(=O)c1cccc(c1I)F 527a_100102657272_100000690930 [1,1,0,0,0,0|2,0,0]=4 3887 B12R1.24 CNC(=O)c1cccc(c1I)O 527a_100102657272_100010084636 [1,1,0,0,0,0|2,0,0]=4 3888 B12R1.24 CNC(=O)c1cccc(c1O)Br 240690a_100102657272_100000752940 [1,1,0,0,0,0|1,0,0]=3 3889 B12R1.24 CNC(=O)c1cccc(c1O)Br 527a_100102657272_100000752940 [1,1,0,0,0,0|1,0,0]=3 3890 B12R1.24 CNC(=O)c1cccc(c1O)C 240690a_100102657272_100000183896 [1,1,0,0,0,0|1,0,0]=3 3891 B12R1.24 CNC(=O)c1cccc(c1O)C 527a_100102657272_100000183896 [1,1,0,0,0,0|1,0,0]=3 3892 B12R1.24 CNC(=O)c1cccc(c1O)Cl 240690a_100102657272_100000742801 [1,1,0,0,0,0|1,0,0]=3 3893 B12R1.24 CNC(=O)c1cccc(c1O)Cl 527a_100102657272_100000742801 [1,1,0,0,0,0|1,0,0]=3 3894 B12R1.24 CNC(=O)c1cccc(c1O)F 240690a_100102657272_100011217230 [1,1,0,0,0,0|1,0,0]=3 3895 B12R1.24 CNC(=O)c1cccc(c1O)F 527a_100102657272_100011217230 [1,1,0,0,0,0|1,0,0]=3 3896 B12R1.24 CNC(=O)c1cccc(c1O)O 527a_100102657272_100000690420 [1,1,0,0,0,0|1,0,0]=3 3897 B12R1.24 COC(=O)c1c[nH]cc(c1=O)O 271570a_203496583355_100010873956 [1,1,0,0,0,0|1,0,1]=4 3898 B12R1.24 COC(=O)c1cccc(c1Br)O 271570a_203496583355_100010240208 [1,1,0,0,0,0|1,0,0]=3 3899 B12R1.24 COC(=O)c1cccc(c1C)O 271570a_203496583355_100012298220 [1,1,0,0,0,0|1,0,0]=3 3900 B12R1.24 COC(=O)c1cccc(c1F)O 271570a_203496583355_100012355674 [1,1,0,0,0,0|1,0,0]=3 3901 B12R1.24 COC(=O)c1cccc(c1N)O 271570a_203496583355_100011356556 [1,1,0,0,0,0|1,0,0]=3 3902 B12R1.24 COC(=O)c1cccc(c1O)Br 271570a_203496583355_100010150843 [1,1,0,0,0,0|0,0,0]=2 3903 B12R1.24 COC(=O)c1cccc(c1O)C 271570a_203496583355_100012002529 [1,1,0,0,0,0|0,0,0]=2 3904 B12R1.24 COC(=O)c1cccc(c1O)F 271570a_203496583355_100012357630 [1,1,0,0,0,0|0,0,0]=2 3905 B12R1.24 COC(=O)c1cccc(c1O)N 271570a_203496583355_100000719424 [1,1,0,0,0,0|0,0,0]=2 3906 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_100009816214 [1,1,0,0,0,0|0,0,0]=2 3907 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_200010230364 [1,1,0,0,0,0|0,0,0]=2 3908 B12R1.24 COC(=O)c1ccnc(c1C)O 271570a_203496583355_100000087782 [1,1,0,0,0,0|2,0,0]=4 3909 B12R1.24 COC(=O)c1ccnc(c1F)O 271570a_203496583355_100000081818 [1,1,0,0,0,0|2,0,0]=4 3910 B12R1.24 COC(=O)c1ccnc(c1N)O 271570a_203496583355_100000067308 [1,1,0,0,0,0|2,0,0]=4 3911 B12R1.24 COC(=O)c1cncc(c1C)O 271570a_203496583355_100010713144 [1,1,0,0,0,0|2,0,0]=4 3912 B12R1.24 COC(=O)c1nccc(c1C)O 271570a_203496583355_100000094583 [1,1,0,0,0,0|2,0,0]=4 3913 B12R1.24 COC(=O)c1nccc(c1F)O 271570a_203496583355_100000687924 [1,1,0,0,0,0|2,0,0]=4 3914 B12R1.24 Cc1c(cccc1C(=O)CF)Br 1458a_100000760464_100015361967 [1,1,0,0,0,0|2,0,0]=4 3915 B12R1.24 Cc1c(cccc1C(=O)CF)Cl 1458a_100000690184_100015361967 [1,1,0,0,0,0|2,0,0]=4 3916 B12R1.24 Cc1c(cccc1C(=O)CF)F 1458a_100011218272_100015361967 [1,1,0,0,0,0|2,0,0]=4 3917 B12R1.24 Cc1c(cccc1C(=O)CF)I 1458a_100000751865_100015361967 [1,1,0,0,0,0|2,0,0]=4 3918 B12R1.24 Cc1c(cccc1C(=O)CF)O 1458a_100000766327_100015361967 [1,1,0,0,0,0|2,0,0]=4 3919 B12R1.24 Cc1cccc(c1Br)C(=O)CF 1458a_100000692419_100015361967 [1,1,0,0,0,0|2,0,0]=4 3920 B12R1.24 Cc1cccc(c1C)C(=O)CF 1458a_100000183679_100015361967 [1,1,0,0,0,0|2,0,0]=4 3921 B12R1.24 Cc1cccc(c1Cl)C(=O)CF 1458a_100000693142_100015361967 [1,1,0,0,0,0|2,0,0]=4 3922 B12R1.24 Cc1cccc(c1F)C(=O)CF 1458a_100000766181_100015361967 [1,1,0,0,0,0|2,0,0]=4 3923 B12R1.24 Cc1cccc(c1I)C(=O)CF 1458a_100000739377_100015361967 [1,1,0,0,0,0|2,0,0]=4 3924 B12R1.24 Cc1cccc(c1O)C(=O)CF 1458a_100000183896_100015361967 [1,1,0,0,0,0|1,0,0]=3 3925 B12R1.24 O=C(CF)c1cccc(c1Br)Br 1458a_100012360534_100015361967 [1,1,0,0,0,0|2,0,0]=4 3926 B12R1.24 O=C(CF)c1cccc(c1Br)Cl 1458a_100012339722_100015361967 [1,1,0,0,0,0|2,0,0]=4 3927 B12R1.24 O=C(CF)c1cccc(c1Br)F 1458a_100011217547_100015361967 [1,1,0,0,0,0|2,0,0]=4 3928 B12R1.24 O=C(CF)c1cccc(c1Br)I 1458a_100010232522_100015361967 [1,1,0,0,0,0|2,0,0]=4 3929 B12R1.24 O=C(CF)c1cccc(c1Br)O 1458a_100010230362_100015361967 [1,1,0,0,0,0|2,0,0]=4 3930 B12R1.24 O=C(CF)c1cccc(c1Cl)Br 1458a_100000760540_100015361967 [1,1,0,0,0,0|2,0,0]=4 3931 B12R1.24 O=C(CF)c1cccc(c1Cl)Cl 1458a_100000183631_100015361967 [1,1,0,0,0,0|2,0,0]=4 3932 B12R1.24 O=C(CF)c1cccc(c1Cl)F 1458a_100000759904_100015361967 [1,1,0,0,0,0|2,0,0]=4 3933 B12R1.24 O=C(CF)c1cccc(c1Cl)I 1458a_100010176783_100015361967 [1,1,0,0,0,0|2,0,0]=4 3934 B12R1.24 O=C(CF)c1cccc(c1Cl)O 1458a_100000092362_100015361967 [1,1,0,0,0,0|2,0,0]=4 3935 B12R1.24 O=C(CF)c1cccc(c1F)Br 1458a_100000756403_100015361967 [1,1,0,0,0,0|2,0,0]=4 3936 B12R1.24 O=C(CF)c1cccc(c1F)Cl 1458a_100000688816_100015361967 [1,1,0,0,0,0|2,0,0]=4 3937 B12R1.24 O=C(CF)c1cccc(c1F)F 1458a_100000748134_100015361967 [1,1,0,0,0,0|2,0,0]=4 3938 B12R1.24 O=C(CF)c1cccc(c1F)I 1458a_100010185205_100015361967 [1,1,0,0,0,0|2,0,0]=4 3939 B12R1.24 O=C(CF)c1cccc(c1F)O 1458a_100000037433_100015361967 [1,1,0,0,0,0|2,0,0]=4 3940 B12R1.24 O=C(CF)c1cccc(c1I)Br 1458a_100000688019_100015361967 [1,1,0,0,0,0|2,0,0]=4 3941 B12R1.24 O=C(CF)c1cccc(c1I)Cl 1458a_100010176784_100015361967 [1,1,0,0,0,0|2,0,0]=4 3942 B12R1.24 O=C(CF)c1cccc(c1I)F 1458a_100000690930_100015361967 [1,1,0,0,0,0|2,0,0]=4 3943 B12R1.24 O=C(CF)c1cccc(c1I)O 1458a_100010084636_100015361967 [1,1,0,0,0,0|2,0,0]=4 3944 B12R1.24 O=C(CF)c1cccc(c1O)Br 1458a_100000752940_100015361967 [1,1,0,0,0,0|1,0,0]=3 3945 B12R1.24 O=C(CF)c1cccc(c1O)Cl 1458a_100000742801_100015361967 [1,1,0,0,0,0|1,0,0]=3 3946 B12R1.24 O=C(CF)c1cccc(c1O)F 1458a_100011217230_100015361967 [1,1,0,0,0,0|1,0,0]=3 3947 B12R1.24 O=C(CF)c1cccc(c1O)O 1458a_100000690420_100015361967 [1,1,0,0,0,0|1,0,0]=3 3948 B12R1.77 C#Cc1ccccc1C(=O)CC 1458a_100011243808_100000210202 [1,1,0,0,0,0|1,0,0]=3 3949 B12R1.77 C#Cc1ccccc1C(=O)CF 1458a_100011243808_100015361967 [1,1,0,0,0,0|2,0,0]=4 3950 B12R1.77 C#Cc1ccccc1C(=O)NC 527a_100102657272_100011243808 [1,1,0,0,0,0|2,0,0]=4 3951 B12R1.77 C=Cc1ccccc1C(=O)CC 1458a_100011830265_100000210202 [1,1,0,0,0,0|1,0,0]=3 3952 B12R1.77 C=Cc1ccccc1C(=O)CF 1458a_100011830265_100015361967 [1,1,0,0,0,0|2,0,0]=4 3953 B12R1.77 C=Cc1ccccc1C(=O)NC 1626a_100102657272_100011830265 [1,1,0,0,0,0|2,0,0]=4 3954 B12R1.77 C=Cc1ccccc1C(=O)NC 271570a_100011290941_100000155073 [1,1,0,0,0,0|2,0,0]=4 3955 B12R1.77 C=Cc1ccccc1C(=O)OC 271570a_100011290941_100000148710 [1,1,0,0,0,0|1,0,0]=3 3956 B12R1.77 C=Cc1cccnc1C(=O)OC 271570a_100011290941_100011935214 [1,1,0,0,0,0|2,0,0]=4 3957 B12R1.77 C=Cc1ccncc1C(=O)OC 271570a_100011290941_100020629055 [1,1,0,0,0,0|2,0,0]=4 3958 B12R1.77 C=Cc1cnccc1C(=O)OC 271570a_100011290941_100010008606 [1,1,0,0,0,0|2,0,0]=4 3959 B12R1.77 C=Cc1ncccc1C(=O)OC 271570a_100011290941_100000150852 [1,1,0,0,0,0|2,0,0]=4 3960 B12R1.77 CCC(=O)c1ccccc1C#N 1458a_100000742908_100000210202 [1,1,0,0,0,0|1,0,0]=3 3961 B12R1.77 CCC(=O)c1ccccc1CC 1458a_100000689120_100000210202 [1,1,0,0,0,0|1,0,0]=3 3962 B12R1.77 CCC(=O)c1ccccc1CO 1458a_100011301526_100000210202 [1,1,0,0,0,0|0,0,0]=2 3963 B12R1.77 CCC(=O)c1ccccc1I=O 1458a_100000032414_100000210202 [1,1,0,0,0,0|0,0,1]=3 3964 B12R1.77 CCC(=O)c1ccccc1OC 1458a_100000185835_100000210202 [1,1,0,0,0,0|0,0,0]=2 3965 B12R1.77 CCC(=O)c1ccccc1OC 7a_100000184720_200000210301 [1,1,0,0,0,0|0,0,0]=2 3966 B12R1.77 CCC(=O)c1ccccc1O[13CH3] 7a_100000184720_200025704644 [1,1,0,0,0,0|0,0,0]=2 3967 B12R1.77 CCC(=O)c1ccccc1SC 1458a_100000183967_100000210202 [1,1,0,0,0,0|0,1,0]=3 3968 B12R1.77 CCC(C)c1ccccc1OC 7a_100000211618_200000210301 [1,1,0,0,0,0|1,0,1]=4 3969 B12R1.77 CCC(C)c1ccccc1O[13CH3] 7a_100000211618_200025704644 [1,1,0,0,0,0|1,0,1]=4 3970 B12R1.77 CCN(C)c1ccccc1OC 2230a_100000219746_100000210202 [1,1,0,0,0,0|2,0,0]=4 3971 B12R1.77 CCN(C)c1ccccc1OC 2230a_100020603010_200000210301 [1,1,0,0,0,0|2,0,0]=4 3972 B12R1.77 CCN(C)c1ccccc1OC 269982a_100000219746_100000204670 [1,1,0,0,0,0|2,0,0]=4 3973 B12R1.77 CCN(C)c1ccccc1OC 269982a_100020603010_200000210301 [1,1,0,0,0,0|2,0,0]=4 3974 B12R1.77 CCN(C)c1ccccc1OC 34a_100000219746_100000210202 [1,1,0,0,0,0|2,0,0]=4 3975 B12R1.77 CCN([13CH3])c1ccccc1OC 2230a_100020603010_200025704644 [1,1,0,0,0,0|2,0,0]=4 3976 B12R1.77 CCN([13CH3])c1ccccc1OC 269982a_100020603010_200025704644 [1,1,0,0,0,0|2,0,0]=4 3977 B12R1.77 CCc1ccccc1C(=O)CF 1458a_100000689120_100015361967 [1,1,0,0,0,0|2,0,0]=4 3978 B12R1.77 CCc1ccccc1C(=O)NC 11a_106832991635_100000689120 [1,1,0,0,0,0|2,0,0]=4 3979 B12R1.77 CCc1ccccc1C(=O)NC 1626a_100102657272_100000689120 [1,1,0,0,0,0|2,0,0]=4 3980 B12R1.77 CCc1ccccc1C(=O)NC 240690a_100102657272_100000689120 [1,1,0,0,0,0|2,0,0]=4 3981 B12R1.77 CCc1ccccc1C(=O)NC 527a_100102657272_100000689120 [1,1,0,0,0,0|2,0,0]=4 3982 B12R1.77 CNC(=O)c1ccccc1C#N 11a_106832991635_100000742908 [1,1,0,0,0,0|2,0,0]=4 3983 B12R1.77 CNC(=O)c1ccccc1C#N 1626a_100102657272_100000742908 [1,1,0,0,0,0|2,0,0]=4 3984 B12R1.77 CNC(=O)c1ccccc1C#N 527a_100102657272_100000742908 [1,1,0,0,0,0|2,0,0]=4 3985 B12R1.77 CNC(=O)c1ccccc1I=O 1626a_100102657272_100000032414 [1,1,0,0,0,0|1,0,1]=4 3986 B12R1.77 CNC(=O)c1ccccc1I=O 240690a_100102657272_100000032414 [1,1,0,0,0,0|1,0,1]=4 3987 B12R1.77 CNC(=O)c1ccccc1I=O 527a_100102657272_100000032414 [1,1,0,0,0,0|1,0,1]=4 3988 B12R1.77 CNC(=O)c1ccccc1NC 27a_100102657272_100000155073 [1,1,0,0,0,0|2,0,0]=4 3989 B12R1.77 CNC(=O)c1ccccc1NC 34a_100000185696_200000210301 [1,1,0,0,0,0|2,0,0]=4 3990 B12R1.77 CNC(=O)c1ccccc1N[13CH3] 34a_100000185696_200025704644 [1,1,0,0,0,0|2,0,0]=4 3991 B12R1.77 CNC(=O)c1ccccc1OC 11a_106832991635_100000185835 [1,1,0,0,0,0|1,0,0]=3 3992 B12R1.77 CNC(=O)c1ccccc1OC 1626a_100102657272_100000185835 [1,1,0,0,0,0|1,0,0]=3 3993 B12R1.77 CNC(=O)c1ccccc1OC 240690a_100102657272_100000185835 [1,1,0,0,0,0|1,0,0]=3 3994 B12R1.77 CNC(=O)c1ccccc1OC 34a_100000185920_200000210301 [1,1,0,0,0,0|1,0,0]=3 3995 B12R1.77 CNC(=O)c1ccccc1OC 527a_100102657272_100000185835 [1,1,0,0,0,0|1,0,0]=3 3996 B12R1.77 CNC(=O)c1ccccc1OC 7a_100000185920_200000210301 [1,1,0,0,0,0|1,0,0]=3 3997 B12R1.77 CNC(=O)c1ccccc1O[13CH3] 34a_100000185920_200025704644 [1,1,0,0,0,0|1,0,0]=3 3998 B12R1.77 CNC(=O)c1ccccc1O[13CH3] 7a_100000185920_200025704644 [1,1,0,0,0,0|1,0,0]=3 3999 B12R1.77 CNC(=O)c1ccccc1SC 11a_106832991635_100000183967 [1,1,0,0,0,0|1,1,0]=4 4000 B12R1.77 CNC(=O)c1ccccc1SC 1626a_100102657272_100000183967 [1,1,0,0,0,0|1,1,0]=4 4001 B12R1.77 CNC(=O)c1ccccc1SC 240690a_100102657272_100000183967 [1,1,0,0,0,0|1,1,0]=4 4002 B12R1.77 CNC(=O)c1ccccc1SC 527a_100102657272_100000183967 [1,1,0,0,0,0|1,1,0]=4 4003 B12R1.77 CNC(=O)c1ccccc1SC 62a_100000155073_200000210301 [1,1,0,0,0,0|1,1,0]=4 4004 B12R1.77 CNC(=O)c1ccccc1SC 62a_200000210301_100000155073 [1,1,0,0,0,0|1,1,0]=4 4005 B12R1.77 CNC(=O)c1ccccc1S[13CH3] 62a_100000155073_200025704644 [1,1,0,0,0,0|1,1,0]=4 4006 B12R1.77 CNC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000155073 [1,1,0,0,0,0|1,1,0]=4 4007 B12R1.77 CNC(=O)c1ncccc1OC 34a_100011376092_200000210301 [1,1,0,0,0,0|2,0,0]=4 4008 B12R1.77 CNC(=O)c1ncccc1OC 7a_100011376092_200000210301 [1,1,0,0,0,0|2,0,0]=4 4009 B12R1.77 CNC(=O)c1ncccc1O[13CH3] 34a_100011376092_200025704644 [1,1,0,0,0,0|2,0,0]=4 4010 B12R1.77 CNC(=O)c1ncccc1O[13CH3] 7a_100011376092_200025704644 [1,1,0,0,0,0|2,0,0]=4 4011 B12R1.77 CNc1ncccc1C(=O)OC 27a_100102657272_100000150852 [1,1,0,0,0,0|2,0,0]=4 4012 B12R1.77 COC(=O)c1ccccc1OC 7a_100000150335_200000210301 [1,1,0,0,0,0|0,0,0]=2 4013 B12R1.77 COC(=O)c1ccccc1O[13CH3] 7a_100000150335_200025704644 [1,1,0,0,0,0|0,0,0]=2 4014 B12R1.77 COC(=O)c1ccccc1SC 62a_100000148710_200000210301 [1,1,0,0,0,0|0,1,0]=3 4015 B12R1.77 COC(=O)c1ccccc1SC 62a_200000210301_100000148710 [1,1,0,0,0,0|0,1,0]=3 4016 B12R1.77 COC(=O)c1ccccc1S[13CH3] 62a_100000148710_200025704644 [1,1,0,0,0,0|0,1,0]=3 4017 B12R1.77 COC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000148710 [1,1,0,0,0,0|0,1,0]=3 4018 B12R1.77 COC(=O)c1cccnc1SC 62a_100011587185_200000210301 [1,1,0,0,0,0|1,1,0]=4 4019 B12R1.77 COC(=O)c1cccnc1SC 62a_200000210301_100000150852 [1,1,0,0,0,0|1,1,0]=4 4020 B12R1.77 COC(=O)c1cccnc1S[13CH3] 62a_100011587185_200025704644 [1,1,0,0,0,0|1,1,0]=4 4021 B12R1.77 COC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000150852 [1,1,0,0,0,0|1,1,0]=4 4022 B12R1.77 COC(=O)c1ccncc1SC 62a_100010008606_200000210301 [1,1,0,0,0,0|1,1,0]=4 4023 B12R1.77 COC(=O)c1ccncc1SC 62a_200000210301_100010008606 [1,1,0,0,0,0|1,1,0]=4 4024 B12R1.77 COC(=O)c1ccncc1S[13CH3] 62a_100010008606_200025704644 [1,1,0,0,0,0|1,1,0]=4 4025 B12R1.77 COC(=O)c1ccncc1S[13CH3] 62a_200025704644_100010008606 [1,1,0,0,0,0|1,1,0]=4 4026 B12R1.77 COC(=O)c1cnccc1SC 62a_100020629055_200000210301 [1,1,0,0,0,0|1,1,0]=4 4027 B12R1.77 COC(=O)c1cnccc1SC 62a_200000210301_100020629055 [1,1,0,0,0,0|1,1,0]=4 4028 B12R1.77 COC(=O)c1cnccc1S[13CH3] 62a_100020629055_200025704644 [1,1,0,0,0,0|1,1,0]=4 4029 B12R1.77 COC(=O)c1cnccc1S[13CH3] 62a_200025704644_100020629055 [1,1,0,0,0,0|1,1,0]=4 4030 B12R1.77 COC(=O)c1ncccc1OC 34a_100000744052_200000210301 [1,1,0,0,0,0|1,0,0]=3 4031 B12R1.77 COC(=O)c1ncccc1OC 7a_100000744052_200000210301 [1,1,0,0,0,0|1,0,0]=3 4032 B12R1.77 COC(=O)c1ncccc1O[13CH3] 34a_100000744052_200025704644 [1,1,0,0,0,0|1,0,0]=3 4033 B12R1.77 COC(=O)c1ncccc1O[13CH3] 7a_100000744052_200025704644 [1,1,0,0,0,0|1,0,0]=3 4034 B12R1.77 COC(=O)c1ncccc1SC 62a_100011935214_200000210301 [1,1,0,0,0,0|1,1,0]=4 4035 B12R1.77 COC(=O)c1ncccc1SC 62a_200000210301_100011935214 [1,1,0,0,0,0|1,1,0]=4 4036 B12R1.77 COC(=O)c1ncccc1S[13CH3] 62a_100011935214_200025704644 [1,1,0,0,0,0|1,1,0]=4 4037 B12R1.77 COC(=O)c1ncccc1S[13CH3] 62a_200025704644_100011935214 [1,1,0,0,0,0|1,1,0]=4 4038 B12R1.77 COc1ccccc1C(=O)CBr 7a_100000188908_200000210301 [1,1,0,0,0,0|1,0,0]=3 4039 B12R1.77 COc1ccccc1C(=O)CF 1458a_100000185835_100015361967 [1,1,0,0,0,0|1,0,0]=3 4040 B12R1.77 COc1ccccc1C(=O)NN 34a_100000186518_200000210301 [1,1,0,0,0,0|2,0,0]=4 4041 B12R1.77 COc1ccccc1C(=O)NO 34a_100000188472_200000210301 [1,1,0,0,0,0|2,0,0]=4 4042 B12R1.77 COc1ccccc1C(C)OC 7a_100000742714_200000210301 [1,1,0,0,0,0|1,0,1]=4 4043 B12R1.77 COc1ccccc1C(C)O[13CH3] 7a_100000742714_200025704644 [1,1,0,0,0,0|1,0,1]=4 4044 B12R1.77 CSc1ccccc1C(=O)CF 1458a_100000183967_100015361967 [1,1,0,0,0,0|1,1,0]=4 4045 B12R1.77 CSc1ccccc1C(=O)O[Na] 62a_200000210301_114855342371 [1,1,0,0,0,0|1,1,0]=4 4046 B12R1.77 N#Cc1ccccc1C(=O)CF 1458a_100000742908_100015361967 [1,1,0,0,0,0|2,0,0]=4 4047 B12R1.77 O=C(CF)c1ccccc1CO 1458a_100011301526_100015361967 [1,1,0,0,0,0|1,0,0]=3 4048 B12R1.77 O=Ic1ccccc1C(=O)CF 1458a_100000032414_100015361967 [1,1,0,0,0,0|1,0,1]=4 4049 B12R1.77 [13CH3]Oc1ccccc1C(=O)CBr 7a_100000188908_200025704644 [1,1,0,0,0,0|1,0,0]=3 4050 B12R1.77 [13CH3]Oc1ccccc1C(=O)NN 34a_100000186518_200025704644 [1,1,0,0,0,0|2,0,0]=4 4051 B12R1.77 [13CH3]Oc1ccccc1C(=O)NO 34a_100000188472_200025704644 [1,1,0,0,0,0|2,0,0]=4 4052 B12R1.77 [13CH3]Sc1ccccc1C(=O)O[Na] 62a_200025704644_114855342371 [1,1,0,0,0,0|1,1,0]=4 4053 B12R1.124 CC(=C(C)c1ccccc1O)C 271570a_200000049429_100000739446 [1,1,0,0,0,0|1,0,1]=4 4054 B12R1.124 CC(C)C(=O)c1ccccc1Br 1458a_100000188424_100000210206 [1,1,0,0,0,0|1,0,0]=3 4055 B12R1.124 CC(C)C(=O)c1ccccc1Cl 1458a_100000185844_100000210206 [1,1,0,0,0,0|1,0,0]=3 4056 B12R1.124 CC(C)C(=O)c1ccccc1F 1458a_100000188656_100000210206 [1,1,0,0,0,0|1,0,0]=3 4057 B12R1.124 CC(C)C(=O)c1ccccc1I 1458a_100000187884_100000210206 [1,1,0,0,0,0|1,0,0]=3 4058 B12R1.124 CC(C)C(=O)c1ccccc1O 1458a_100015234032_100000210206 [1,1,0,0,0,0|0,0,0]=2 4059 B12R1.124 CC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100000210206 [1,1,0,0,0,0|0,0,1]=3 4060 B12R1.124 CC(C)N(C)c1ccccc1O 269982a_100000033821_100000210206 [1,1,0,0,0,0|2,0,0]=4 4061 B12R1.124 CN(C)C(=O)c1ccccc1Br 11a_100102631434_100000188424 [1,1,0,0,0,0|2,0,0]=4 4062 B12R1.124 CN(C)C(=O)c1ccccc1Br 1626a_100102631434_100000188424 [1,1,0,0,0,0|2,0,0]=4 4063 B12R1.124 CN(C)C(=O)c1ccccc1Br 240690a_100102631434_100000188424 [1,1,0,0,0,0|2,0,0]=4 4064 B12R1.124 CN(C)C(=O)c1ccccc1Br 527a_100102631434_100000188424 [1,1,0,0,0,0|2,0,0]=4 4065 B12R1.124 CN(C)C(=O)c1ccccc1Cl 11a_100102631434_100000185844 [1,1,0,0,0,0|2,0,0]=4 4066 B12R1.124 CN(C)C(=O)c1ccccc1Cl 1626a_100102631434_100000185844 [1,1,0,0,0,0|2,0,0]=4 4067 B12R1.124 CN(C)C(=O)c1ccccc1Cl 240690a_100102631434_100000185844 [1,1,0,0,0,0|2,0,0]=4 4068 B12R1.124 CN(C)C(=O)c1ccccc1Cl 527a_100102631434_100000185844 [1,1,0,0,0,0|2,0,0]=4 4069 B12R1.124 CN(C)C(=O)c1ccccc1F 11a_100102631434_100000188656 [1,1,0,0,0,0|2,0,0]=4 4070 B12R1.124 CN(C)C(=O)c1ccccc1F 1626a_100102631434_100000188656 [1,1,0,0,0,0|2,0,0]=4 4071 B12R1.124 CN(C)C(=O)c1ccccc1F 240690a_100102631434_100000188656 [1,1,0,0,0,0|2,0,0]=4 4072 B12R1.124 CN(C)C(=O)c1ccccc1F 527a_100102631434_100000188656 [1,1,0,0,0,0|2,0,0]=4 4073 B12R1.124 CN(C)C(=O)c1ccccc1I 11a_100102631434_100000187884 [1,1,0,0,0,0|2,0,0]=4 4074 B12R1.124 CN(C)C(=O)c1ccccc1I 1626a_100102631434_100000187884 [1,1,0,0,0,0|2,0,0]=4 4075 B12R1.124 CN(C)C(=O)c1ccccc1I 240690a_100102631434_100000187884 [1,1,0,0,0,0|2,0,0]=4 4076 B12R1.124 CN(C)C(=O)c1ccccc1I 527a_100102631434_100000187884 [1,1,0,0,0,0|2,0,0]=4 4077 B12R1.124 CN(C)C(=O)c1ccccc1O 240690a_100102631434_100015234032 [1,1,0,0,0,0|1,0,0]=3 4078 B12R1.124 CN(C)C(=O)c1ccccc1O 271570a_203496583355_100000159526 [1,1,0,0,0,0|1,0,0]=3 4079 B12R1.124 CN(C)C(=O)c1ccccc1[O-] 1626a_100102631434_100009911694 [1,1,0,0,0,0|1,0,1]=4 4080 B12R1.124 CN(C)C(=O)c1ccccc1[O-] 240690a_100102631434_100009911694 [1,1,0,0,0,0|1,0,1]=4 4081 B12R1.124 CN(C)C(=O)c1ccccc1[O-] 527a_100102631434_100009911694 [1,1,0,0,0,0|1,0,1]=4 4082 B12R1.124 CN(C)C(=O)c1cccnc1O 271570a_203496583355_100000159563 [1,1,0,0,0,0|2,0,0]=4 4083 B12R1.124 Cc1ccccc1C(=O)C(C)C 1458a_100000212026_100000210206 [1,1,0,0,0,0|1,0,0]=3 4084 B12R1.124 Cc1ccccc1C(=O)N(C)C 11a_100102631434_100000212026 [1,1,0,0,0,0|2,0,0]=4 4085 B12R1.124 Cc1ccccc1C(=O)N(C)C 1626a_100102631434_100000212026 [1,1,0,0,0,0|2,0,0]=4 4086 B12R1.124 Cc1ccccc1C(=O)N(C)C 240690a_100102631434_100000212026 [1,1,0,0,0,0|2,0,0]=4 4087 B12R1.124 Cc1ccccc1C(=O)N(C)C 527a_100102631434_100000212026 [1,1,0,0,0,0|2,0,0]=4 4088 B12R1.195 CCS(=O)(=O)c1cccnc1O 271570a_203496583355_100000702504 [1,1,0,0,0,0|2,0,0]=4 4089 B12R1.195 CNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000165157 [1,1,0,0,0,0|2,0,0]=4 4090 B12R1.243 CCN(CC)c1ccccc1O 269982a_103624766699_100000204670 [1,1,0,0,0,0|2,0,0]=4 4091 B12R1.243 CCN(CF)c1ccccc1O 269982a_103624766699_100015361967 [1,1,0,0,0,0|2,0,0]=4 4092 B12R1.243 COC(OC)c1ccccc1O 271570a_203496583355_100010185899 [1,1,0,0,0,0|0,0,2]=4 4093 B12R1.354 CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210202 [1,1,0,0,0,0|1,0,0]=3 4094 B12R1.354 CCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210202 [1,1,0,0,0,0|1,0,0]=3 4095 B12R1.354 CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210202 [1,1,0,0,0,0|1,0,0]=3 4096 B12R1.354 CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210202 [1,1,0,0,0,0|1,0,0]=3 4097 B12R1.354 CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210202 [1,1,0,0,0,0|1,0,0]=3 4098 B12R1.354 CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210202 [1,1,0,0,0,0|1,0,0]=3 4099 B12R1.354 CCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210202 [1,1,0,0,0,0|1,0,0]=3 4100 B12R1.354 CCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210202 [1,1,0,0,0,0|1,0,0]=3 4101 B12R1.354 CCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210202 [1,1,0,0,0,0|1,0,0]=3 4102 B12R1.354 CCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210202 [1,1,0,0,0,0|1,0,0]=3 4103 B12R1.354 CCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210202 [1,1,0,0,0,0|1,0,0]=3 4104 B12R1.354 CCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210202 [1,1,0,0,0,0|1,0,0]=3 4105 B12R1.354 CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210202 [1,1,0,0,0,0|1,0,0]=3 4106 B12R1.354 CCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210202 [1,1,0,0,0,0|1,0,0]=3 4107 B12R1.354 CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210202 [1,1,0,0,0,0|1,0,0]=3 4108 B12R1.354 CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210202 [1,1,0,0,0,0|1,0,0]=3 4109 B12R1.354 CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210202 [1,1,0,0,0,0|1,0,0]=3 4110 B12R1.354 CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210202 [1,1,0,0,0,0|1,0,0]=3 4111 B12R1.354 CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210202 [1,1,0,0,0,0|1,0,0]=3 4112 B12R1.354 CCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210202 [1,1,0,0,0,0|1,0,0]=3 4113 B12R1.354 CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210202 [1,1,0,0,0,0|1,0,0]=3 4114 B12R1.354 CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210202 [1,1,0,0,0,0|1,0,0]=3 4115 B12R1.354 CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210202 [1,1,0,0,0,0|1,0,0]=3 4116 B12R1.354 CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210202 [1,1,0,0,0,0|1,0,0]=3 4117 B12R1.354 CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210202 [1,1,0,0,0,0|1,0,0]=3 4118 B12R1.354 CCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210202 [1,1,0,0,0,0|1,0,0]=3 4119 B12R1.354 CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210202 [1,1,0,0,0,0|1,0,0]=3 4120 B12R1.354 CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210202 [1,1,0,0,0,0|1,0,0]=3 4121 B12R1.354 CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210202 [1,1,0,0,0,0|1,0,0]=3 4122 B12R1.354 CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210202 [1,1,0,0,0,0|1,0,0]=3 4123 B12R1.354 CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210202 [1,1,0,0,0,0|0,0,0]=2 4124 B12R1.354 CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210202 [1,1,0,0,0,0|0,0,0]=2 4125 B12R1.354 CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210202 [1,1,0,0,0,0|0,0,0]=2 4126 B12R1.354 CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210202 [1,1,0,0,0,0|0,0,0]=2 4127 B12R1.354 CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210202 [1,1,0,0,0,0|0,0,0]=2 4128 B12R1.354 CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210202 [1,1,0,0,0,0|0,0,0]=2 4129 B12R1.354 CCC(=O)c1cc(ccc1O)O 271570a_203496583355_100000183607 [1,1,0,0,0,0|0,0,0]=2 4130 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 11a_106832991635_100000690610 [1,1,0,0,0,0|2,0,0]=4 4131 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 1626a_100102657272_100000690610 [1,1,0,0,0,0|2,0,0]=4 4132 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 240690a_100102657272_100000690610 [1,1,0,0,0,0|2,0,0]=4 4133 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 527a_100102657272_100000690610 [1,1,0,0,0,0|2,0,0]=4 4134 B12R1.354 CNC(=O)c1cc(ccc1Br)C 11a_106832991635_100000689033 [1,1,0,0,0,0|2,0,0]=4 4135 B12R1.354 CNC(=O)c1cc(ccc1Br)C 1626a_100102657272_100000689033 [1,1,0,0,0,0|2,0,0]=4 4136 B12R1.354 CNC(=O)c1cc(ccc1Br)C 240690a_100102657272_100000689033 [1,1,0,0,0,0|2,0,0]=4 4137 B12R1.354 CNC(=O)c1cc(ccc1Br)C 527a_100102657272_100000689033 [1,1,0,0,0,0|2,0,0]=4 4138 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 11a_106832991635_100000736951 [1,1,0,0,0,0|2,0,0]=4 4139 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 1626a_100102657272_100000736951 [1,1,0,0,0,0|2,0,0]=4 4140 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 240690a_100102657272_100000736951 [1,1,0,0,0,0|2,0,0]=4 4141 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 527a_100102657272_100000736951 [1,1,0,0,0,0|2,0,0]=4 4142 B12R1.354 CNC(=O)c1cc(ccc1Br)F 11a_106832991635_100000212315 [1,1,0,0,0,0|2,0,0]=4 4143 B12R1.354 CNC(=O)c1cc(ccc1Br)F 1626a_100102657272_100000212315 [1,1,0,0,0,0|2,0,0]=4 4144 B12R1.354 CNC(=O)c1cc(ccc1Br)F 240690a_100102657272_100000212315 [1,1,0,0,0,0|2,0,0]=4 4145 B12R1.354 CNC(=O)c1cc(ccc1Br)F 527a_100102657272_100000212315 [1,1,0,0,0,0|2,0,0]=4 4146 B12R1.354 CNC(=O)c1cc(ccc1Br)I 11a_106832991635_100000698340 [1,1,0,0,0,0|2,0,0]=4 4147 B12R1.354 CNC(=O)c1cc(ccc1Br)I 1626a_100102657272_100000698340 [1,1,0,0,0,0|2,0,0]=4 4148 B12R1.354 CNC(=O)c1cc(ccc1Br)I 240690a_100102657272_100000698340 [1,1,0,0,0,0|2,0,0]=4 4149 B12R1.354 CNC(=O)c1cc(ccc1Br)I 527a_100102657272_100000698340 [1,1,0,0,0,0|2,0,0]=4 4150 B12R1.354 CNC(=O)c1cc(ccc1Br)O 240690a_100102657272_100012352043 [1,1,0,0,0,0|2,0,0]=4 4151 B12R1.354 CNC(=O)c1cc(ccc1Br)O 527a_100102657272_100012352043 [1,1,0,0,0,0|2,0,0]=4 4152 B12R1.354 CNC(=O)c1cc(ccc1C)Br 11a_106832991635_100000759961 [1,1,0,0,0,0|2,0,0]=4 4153 B12R1.354 CNC(=O)c1cc(ccc1C)Br 1626a_100102657272_100000759961 [1,1,0,0,0,0|2,0,0]=4 4154 B12R1.354 CNC(=O)c1cc(ccc1C)Br 240690a_100102657272_100000759961 [1,1,0,0,0,0|2,0,0]=4 4155 B12R1.354 CNC(=O)c1cc(ccc1C)Br 527a_100102657272_100000759961 [1,1,0,0,0,0|2,0,0]=4 4156 B12R1.354 CNC(=O)c1cc(ccc1C)C 11a_106832991635_100000195421 [1,1,0,0,0,0|2,0,0]=4 4157 B12R1.354 CNC(=O)c1cc(ccc1C)C 1626a_100102657272_100000195421 [1,1,0,0,0,0|2,0,0]=4 4158 B12R1.354 CNC(=O)c1cc(ccc1C)C 240690a_100102657272_100000195421 [1,1,0,0,0,0|2,0,0]=4 4159 B12R1.354 CNC(=O)c1cc(ccc1C)C 527a_100102657272_100000195421 [1,1,0,0,0,0|2,0,0]=4 4160 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 11a_106832991635_100000692595 [1,1,0,0,0,0|2,0,0]=4 4161 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 1626a_100102657272_100000692595 [1,1,0,0,0,0|2,0,0]=4 4162 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 240690a_100102657272_100000692595 [1,1,0,0,0,0|2,0,0]=4 4163 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 527a_100102657272_100000692595 [1,1,0,0,0,0|2,0,0]=4 4164 B12R1.354 CNC(=O)c1cc(ccc1C)F 11a_106832991635_100000240043 [1,1,0,0,0,0|2,0,0]=4 4165 B12R1.354 CNC(=O)c1cc(ccc1C)F 1626a_100102657272_100000240043 [1,1,0,0,0,0|2,0,0]=4 4166 B12R1.354 CNC(=O)c1cc(ccc1C)F 240690a_100102657272_100000240043 [1,1,0,0,0,0|2,0,0]=4 4167 B12R1.354 CNC(=O)c1cc(ccc1C)F 527a_100102657272_100000240043 [1,1,0,0,0,0|2,0,0]=4 4168 B12R1.354 CNC(=O)c1cc(ccc1C)I 11a_106832991635_100000688012 [1,1,0,0,0,0|2,0,0]=4 4169 B12R1.354 CNC(=O)c1cc(ccc1C)I 1626a_100102657272_100000688012 [1,1,0,0,0,0|2,0,0]=4 4170 B12R1.354 CNC(=O)c1cc(ccc1C)I 240690a_100102657272_100000688012 [1,1,0,0,0,0|2,0,0]=4 4171 B12R1.354 CNC(=O)c1cc(ccc1C)I 527a_100102657272_100000688012 [1,1,0,0,0,0|2,0,0]=4 4172 B12R1.354 CNC(=O)c1cc(ccc1C)O 240690a_100102657272_100000687834 [1,1,0,0,0,0|2,0,0]=4 4173 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 11a_106832991635_100000211212 [1,1,0,0,0,0|2,0,0]=4 4174 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 1626a_100102657272_100000211212 [1,1,0,0,0,0|2,0,0]=4 4175 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 240690a_100102657272_100000211212 [1,1,0,0,0,0|2,0,0]=4 4176 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 527a_100102657272_100000211212 [1,1,0,0,0,0|2,0,0]=4 4177 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 11a_106832991635_100011290873 [1,1,0,0,0,0|2,0,0]=4 4178 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 1626a_100102657272_100011290873 [1,1,0,0,0,0|2,0,0]=4 4179 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 240690a_100102657272_100011290873 [1,1,0,0,0,0|2,0,0]=4 4180 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 527a_100102657272_100011290873 [1,1,0,0,0,0|2,0,0]=4 4181 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 11a_106832991635_100000210642 [1,1,0,0,0,0|2,0,0]=4 4182 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 1626a_100102657272_100000210642 [1,1,0,0,0,0|2,0,0]=4 4183 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 240690a_100102657272_100000210642 [1,1,0,0,0,0|2,0,0]=4 4184 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 527a_100102657272_100000210642 [1,1,0,0,0,0|2,0,0]=4 4185 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 11a_106832991635_100011219680 [1,1,0,0,0,0|2,0,0]=4 4186 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 1626a_100102657272_100011219680 [1,1,0,0,0,0|2,0,0]=4 4187 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 240690a_100102657272_100011219680 [1,1,0,0,0,0|2,0,0]=4 4188 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 527a_100102657272_100011219680 [1,1,0,0,0,0|2,0,0]=4 4189 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 11a_106832991635_100000688013 [1,1,0,0,0,0|2,0,0]=4 4190 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 1626a_100102657272_100000688013 [1,1,0,0,0,0|2,0,0]=4 4191 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 240690a_100102657272_100000688013 [1,1,0,0,0,0|2,0,0]=4 4192 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 527a_100102657272_100000688013 [1,1,0,0,0,0|2,0,0]=4 4193 B12R1.354 CNC(=O)c1cc(ccc1Cl)O 240690a_100102657272_100000719527 [1,1,0,0,0,0|2,0,0]=4 4194 B12R1.354 CNC(=O)c1cc(ccc1Cl)O 527a_100102657272_100000719527 [1,1,0,0,0,0|2,0,0]=4 4195 B12R1.354 CNC(=O)c1cc(ccc1F)Br 11a_106832991635_100000212322 [1,1,0,0,0,0|2,0,0]=4 4196 B12R1.354 CNC(=O)c1cc(ccc1F)Br 1626a_100102657272_100000212322 [1,1,0,0,0,0|2,0,0]=4 4197 B12R1.354 CNC(=O)c1cc(ccc1F)Br 240690a_100102657272_100000212322 [1,1,0,0,0,0|2,0,0]=4 4198 B12R1.354 CNC(=O)c1cc(ccc1F)Br 527a_100102657272_100000212322 [1,1,0,0,0,0|2,0,0]=4 4199 B12R1.354 CNC(=O)c1cc(ccc1F)C 11a_106832991635_100000749327 [1,1,0,0,0,0|2,0,0]=4 4200 B12R1.354 CNC(=O)c1cc(ccc1F)C 1626a_100102657272_100000749327 [1,1,0,0,0,0|2,0,0]=4 4201 B12R1.354 CNC(=O)c1cc(ccc1F)C 240690a_100102657272_100000749327 [1,1,0,0,0,0|2,0,0]=4 4202 B12R1.354 CNC(=O)c1cc(ccc1F)C 527a_100102657272_100000749327 [1,1,0,0,0,0|2,0,0]=4 4203 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 11a_106832991635_100000214954 [1,1,0,0,0,0|2,0,0]=4 4204 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 1626a_100102657272_100000214954 [1,1,0,0,0,0|2,0,0]=4 4205 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 240690a_100102657272_100000214954 [1,1,0,0,0,0|2,0,0]=4 4206 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 527a_100102657272_100000214954 [1,1,0,0,0,0|2,0,0]=4 4207 B12R1.354 CNC(=O)c1cc(ccc1F)F 11a_106832991635_100000198512 [1,1,0,0,0,0|2,0,0]=4 4208 B12R1.354 CNC(=O)c1cc(ccc1F)F 1626a_100102657272_100000198512 [1,1,0,0,0,0|2,0,0]=4 4209 B12R1.354 CNC(=O)c1cc(ccc1F)F 240690a_100102657272_100000198512 [1,1,0,0,0,0|2,0,0]=4 4210 B12R1.354 CNC(=O)c1cc(ccc1F)F 527a_100102657272_100000198512 [1,1,0,0,0,0|2,0,0]=4 4211 B12R1.354 CNC(=O)c1cc(ccc1F)I 11a_106832991635_100000688014 [1,1,0,0,0,0|2,0,0]=4 4212 B12R1.354 CNC(=O)c1cc(ccc1F)I 1626a_100102657272_100000688014 [1,1,0,0,0,0|2,0,0]=4 4213 B12R1.354 CNC(=O)c1cc(ccc1F)I 240690a_100102657272_100000688014 [1,1,0,0,0,0|2,0,0]=4 4214 B12R1.354 CNC(=O)c1cc(ccc1F)I 527a_100102657272_100000688014 [1,1,0,0,0,0|2,0,0]=4 4215 B12R1.354 CNC(=O)c1cc(ccc1F)O 240690a_100102657272_100000037260 [1,1,0,0,0,0|2,0,0]=4 4216 B12R1.354 CNC(=O)c1cc(ccc1F)O 271570a_203496583355_100000155058 [1,1,0,0,0,0|2,0,0]=4 4217 B12R1.354 CNC(=O)c1cc(ccc1F)O 527a_100102657272_100000037260 [1,1,0,0,0,0|2,0,0]=4 4218 B12R1.354 CNC(=O)c1cc(ccc1I)Br 11a_106832991635_100000183945 [1,1,0,0,0,0|2,0,0]=4 4219 B12R1.354 CNC(=O)c1cc(ccc1I)Br 1626a_100102657272_100000183945 [1,1,0,0,0,0|2,0,0]=4 4220 B12R1.354 CNC(=O)c1cc(ccc1I)Br 240690a_100102657272_100000183945 [1,1,0,0,0,0|2,0,0]=4 4221 B12R1.354 CNC(=O)c1cc(ccc1I)C 11a_106832991635_100000057929 [1,1,0,0,0,0|2,0,0]=4 4222 B12R1.354 CNC(=O)c1cc(ccc1I)C 1626a_100102657272_100000057929 [1,1,0,0,0,0|2,0,0]=4 4223 B12R1.354 CNC(=O)c1cc(ccc1I)C 240690a_100102657272_100000057929 [1,1,0,0,0,0|2,0,0]=4 4224 B12R1.354 CNC(=O)c1cc(ccc1I)C 527a_100102657272_100000057929 [1,1,0,0,0,0|2,0,0]=4 4225 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 11a_106832991635_100000739379 [1,1,0,0,0,0|2,0,0]=4 4226 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 1626a_100102657272_100000739379 [1,1,0,0,0,0|2,0,0]=4 4227 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 240690a_100102657272_100000739379 [1,1,0,0,0,0|2,0,0]=4 4228 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 527a_100102657272_100000739379 [1,1,0,0,0,0|2,0,0]=4 4229 B12R1.354 CNC(=O)c1cc(ccc1I)F 11a_106832991635_100000748905 [1,1,0,0,0,0|2,0,0]=4 4230 B12R1.354 CNC(=O)c1cc(ccc1I)F 1626a_100102657272_100000748905 [1,1,0,0,0,0|2,0,0]=4 4231 B12R1.354 CNC(=O)c1cc(ccc1I)F 240690a_100102657272_100000748905 [1,1,0,0,0,0|2,0,0]=4 4232 B12R1.354 CNC(=O)c1cc(ccc1I)F 527a_100102657272_100000748905 [1,1,0,0,0,0|2,0,0]=4 4233 B12R1.354 CNC(=O)c1cc(ccc1I)I 11a_106832991635_100000750460 [1,1,0,0,0,0|2,0,0]=4 4234 B12R1.354 CNC(=O)c1cc(ccc1I)I 1626a_100102657272_100000750460 [1,1,0,0,0,0|2,0,0]=4 4235 B12R1.354 CNC(=O)c1cc(ccc1I)I 240690a_100102657272_100000750460 [1,1,0,0,0,0|2,0,0]=4 4236 B12R1.354 CNC(=O)c1cc(ccc1I)I 527a_100102657272_100000750460 [1,1,0,0,0,0|2,0,0]=4 4237 B12R1.354 CNC(=O)c1cc(ccc1I)O 1626a_100102657272_200009995701 [1,1,0,0,0,0|2,0,0]=4 4238 B12R1.354 CNC(=O)c1cc(ccc1I)O 240690a_100102657272_200009995701 [1,1,0,0,0,0|2,0,0]=4 4239 B12R1.354 CNC(=O)c1cc(ccc1I)O 527a_100102657272_200009995701 [1,1,0,0,0,0|2,0,0]=4 4240 B12R1.354 CNC(=O)c1cc(ccc1N)O 271570a_203496583355_100000690504 [1,1,0,0,0,0|2,0,0]=4 4241 B12R1.354 CNC(=O)c1cc(ccc1O)Br 1626a_100102657272_100000212140 [1,1,0,0,0,0|1,0,0]=3 4242 B12R1.354 CNC(=O)c1cc(ccc1O)Br 240690a_100102657272_100000212140 [1,1,0,0,0,0|1,0,0]=3 4243 B12R1.354 CNC(=O)c1cc(ccc1O)Br 527a_100102657272_100000212140 [1,1,0,0,0,0|1,0,0]=3 4244 B12R1.354 CNC(=O)c1cc(ccc1O)C 240690a_100102657272_100000229998 [1,1,0,0,0,0|1,0,0]=3 4245 B12R1.354 CNC(=O)c1cc(ccc1O)C 527a_100102657272_100000229998 [1,1,0,0,0,0|1,0,0]=3 4246 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 11a_106832991635_100000212143 [1,1,0,0,0,0|1,0,0]=3 4247 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 1626a_100102657272_100000212143 [1,1,0,0,0,0|1,0,0]=3 4248 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 240690a_100102657272_100000212143 [1,1,0,0,0,0|1,0,0]=3 4249 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 271570a_203496583355_200011279454 [1,1,0,0,0,0|1,0,0]=3 4250 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 527a_100102657272_100000212143 [1,1,0,0,0,0|1,0,0]=3 4251 B12R1.354 CNC(=O)c1cc(ccc1O)F 240690a_100102657272_100000742286 [1,1,0,0,0,0|1,0,0]=3 4252 B12R1.354 CNC(=O)c1cc(ccc1O)F 271570a_203496583355_200000206232 [1,1,0,0,0,0|1,0,0]=3 4253 B12R1.354 CNC(=O)c1cc(ccc1O)F 527a_100102657272_100000742286 [1,1,0,0,0,0|1,0,0]=3 4254 B12R1.354 CNC(=O)c1cc(ccc1O)I 240690a_100102657272_100000212111 [1,1,0,0,0,0|1,0,0]=3 4255 B12R1.354 CNC(=O)c1cc(ccc1O)I 527a_100102657272_100000212111 [1,1,0,0,0,0|1,0,0]=3 4256 B12R1.354 COC(=O)c1cc(c[nH]c1=O)O 271570a_203496583355_100009816710 [1,1,0,0,0,0|1,0,1]=4 4257 B12R1.354 COC(=O)c1cc(ccc1Br)O 271570a_203496583355_100012340073 [1,1,0,0,0,0|1,0,0]=3 4258 B12R1.354 COC(=O)c1cc(ccc1C)O 271570a_203496583355_100012360116 [1,1,0,0,0,0|1,0,0]=3 4259 B12R1.354 COC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100012353682 [1,1,0,0,0,0|1,0,0]=3 4260 B12R1.354 COC(=O)c1cc(ccc1F)O 271570a_203496583355_100000154357 [1,1,0,0,0,0|1,0,0]=3 4261 B12R1.354 COC(=O)c1cc(ccc1N)O 271570a_203496583355_100000212070 [1,1,0,0,0,0|1,0,0]=3 4262 B12R1.354 COC(=O)c1cc(ccc1O)Br 271570a_203496583355_100000148213 [1,1,0,0,0,0|0,0,0]=2 4263 B12R1.354 COC(=O)c1cc(ccc1O)C 271570a_203496583355_100012339458 [1,1,0,0,0,0|0,0,0]=2 4264 B12R1.354 COC(=O)c1cc(ccc1O)Cl 271570a_203496583355_100011294804 [1,1,0,0,0,0|0,0,0]=2 4265 B12R1.354 COC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205820 [1,1,0,0,0,0|0,0,0]=2 4266 B12R1.354 COC(=O)c1cc(ccc1O)N 271570a_203496583355_100000696289 [1,1,0,0,0,0|0,0,0]=2 4267 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100000149868 [1,1,0,0,0,0|0,0,0]=2 4268 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100010230369 [1,1,0,0,0,0|0,0,0]=2 4269 B12R1.354 COC(=O)c1cc(cnc1C)O 271570a_203496583355_100010180201 [1,1,0,0,0,0|2,0,0]=4 4270 B12R1.354 COC(=O)c1cc(cnc1F)O 271570a_203496583355_100010243567 [1,1,0,0,0,0|2,0,0]=4 4271 B12R1.354 COC(=O)c1cc(cnc1N)O 271570a_203496583355_100009816750 [1,1,0,0,0,0|2,0,0]=4 4272 B12R1.354 COC(=O)c1cc(cnc1O)C 271570a_203496583355_100000085774 [1,1,0,0,0,0|1,0,0]=3 4273 B12R1.354 COC(=O)c1cc(cnc1O)F 271570a_203496583355_100012000215 [1,1,0,0,0,0|1,0,0]=3 4274 B12R1.354 COC(=O)c1cc(cnc1O)N 271570a_203496583355_200012182668 [1,1,0,0,0,0|1,0,0]=3 4275 B12R1.354 COC(=O)c1cc(ncc1C)O 271570a_203496583355_100009858526 [1,1,0,0,0,0|2,0,0]=4 4276 B12R1.354 COC(=O)c1cc(ncc1F)O 271570a_203496583355_100010218257 [1,1,0,0,0,0|2,0,0]=4 4277 B12R1.354 COC(=O)c1cc(ncc1N)O 271570a_203496583355_100012180746 [1,1,0,0,0,0|2,0,0]=4 4278 B12R1.354 COC(=O)c1cc(ncc1O)N 271570a_203496583355_100011934820 [1,1,0,0,0,0|1,0,0]=3 4279 B12R1.354 COC(=O)c1cc(ncc1O)O 271570a_203496583355_100009816900 [1,1,0,0,0,0|1,0,0]=3 4280 B12R1.354 COC(=O)c1cc(ncc1O)O 271570a_203496583355_100010136202 [1,1,0,0,0,0|1,0,0]=3 4281 B12R1.354 COC(=O)c1nc(=O)[nH]cc1O 271570a_203496583355_100000093369 [1,1,0,0,0,0|2,0,0]=4 4282 B12R1.354 COC(=O)c1nc(ccc1C)O 271570a_203496583355_100000117997 [1,1,0,0,0,0|2,0,0]=4 4283 B12R1.354 COC(=O)c1nc(ccc1F)O 271570a_203496583355_100000697719 [1,1,0,0,0,0|2,0,0]=4 4284 B12R1.354 COC(=O)c1nc(ccc1N)O 271570a_203496583355_100009860768 [1,1,0,0,0,0|2,0,0]=4 4285 B12R1.354 COC(=O)c1nc(ccc1O)N 271570a_203496583355_100009816986 [1,1,0,0,0,0|1,0,0]=3 4286 B12R1.354 COC(=O)c1nc(ccc1O)O 271570a_203496583355_100000697862 [1,1,0,0,0,0|1,0,0]=3 4287 B12R1.354 COC(=O)c1nc(ccc1O)O 271570a_203496583355_100010189638 [1,1,0,0,0,0|1,0,0]=3 4288 B12R1.354 COC(=O)c1nc(ncc1O)N 271570a_203496583355_100010219261 [1,1,0,0,0,0|2,0,0]=4 4289 B12R1.354 Cc1ccc(c(c1)C(=O)CF)Br 1458a_100000689033_100015361967 [1,1,0,0,0,0|2,0,0]=4 4290 B12R1.354 Cc1ccc(c(c1)C(=O)CF)C 1458a_100000195421_100015361967 [1,1,0,0,0,0|2,0,0]=4 4291 B12R1.354 Cc1ccc(c(c1)C(=O)CF)Cl 1458a_100011290873_100015361967 [1,1,0,0,0,0|2,0,0]=4 4292 B12R1.354 Cc1ccc(c(c1)C(=O)CF)F 1458a_100000749327_100015361967 [1,1,0,0,0,0|2,0,0]=4 4293 B12R1.354 Cc1ccc(c(c1)C(=O)CF)I 1458a_100000057929_100015361967 [1,1,0,0,0,0|2,0,0]=4 4294 B12R1.354 Cc1ccc(c(c1)C(=O)CF)O 1458a_100000229998_100015361967 [1,1,0,0,0,0|1,0,0]=3 4295 B12R1.354 Cc1ccc(cc1C(=O)CF)Br 1458a_100000759961_100015361967 [1,1,0,0,0,0|2,0,0]=4 4296 B12R1.354 Cc1ccc(cc1C(=O)CF)Cl 1458a_100000692595_100015361967 [1,1,0,0,0,0|2,0,0]=4 4297 B12R1.354 Cc1ccc(cc1C(=O)CF)F 1458a_100000240043_100015361967 [1,1,0,0,0,0|2,0,0]=4 4298 B12R1.354 Cc1ccc(cc1C(=O)CF)I 1458a_100000688012_100015361967 [1,1,0,0,0,0|2,0,0]=4 4299 B12R1.354 Cc1ccc(cc1C(=O)CF)O 1458a_100000687834_100015361967 [1,1,0,0,0,0|2,0,0]=4 4300 B12R1.354 NNC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205862 [1,1,0,0,0,0|2,0,0]=4 4301 B12R1.354 NNC(=O)c1cc(ccc1O)O 271570a_203496583355_100000193350 [1,1,0,0,0,0|2,0,0]=4 4302 B12R1.354 O=C(CF)c1cc(ccc1Br)Br 1458a_100000690610_100015361967 [1,1,0,0,0,0|2,0,0]=4 4303 B12R1.354 O=C(CF)c1cc(ccc1Br)Cl 1458a_100000736951_100015361967 [1,1,0,0,0,0|2,0,0]=4 4304 B12R1.354 O=C(CF)c1cc(ccc1Br)F 1458a_100000212315_100015361967 [1,1,0,0,0,0|2,0,0]=4 4305 B12R1.354 O=C(CF)c1cc(ccc1Br)I 1458a_100000698340_100015361967 [1,1,0,0,0,0|2,0,0]=4 4306 B12R1.354 O=C(CF)c1cc(ccc1Br)O 1458a_100012352043_100015361967 [1,1,0,0,0,0|2,0,0]=4 4307 B12R1.354 O=C(CF)c1cc(ccc1Cl)Br 1458a_100000211212_100015361967 [1,1,0,0,0,0|2,0,0]=4 4308 B12R1.354 O=C(CF)c1cc(ccc1Cl)Cl 1458a_100000210642_100015361967 [1,1,0,0,0,0|2,0,0]=4 4309 B12R1.354 O=C(CF)c1cc(ccc1Cl)F 1458a_100011219680_100015361967 [1,1,0,0,0,0|2,0,0]=4 4310 B12R1.354 O=C(CF)c1cc(ccc1Cl)I 1458a_100000688013_100015361967 [1,1,0,0,0,0|2,0,0]=4 4311 B12R1.354 O=C(CF)c1cc(ccc1Cl)O 1458a_100000719527_100015361967 [1,1,0,0,0,0|2,0,0]=4 4312 B12R1.354 O=C(CF)c1cc(ccc1F)Br 1458a_100000212322_100015361967 [1,1,0,0,0,0|2,0,0]=4 4313 B12R1.354 O=C(CF)c1cc(ccc1F)Cl 1458a_100000214954_100015361967 [1,1,0,0,0,0|2,0,0]=4 4314 B12R1.354 O=C(CF)c1cc(ccc1F)F 1458a_100000198512_100015361967 [1,1,0,0,0,0|2,0,0]=4 4315 B12R1.354 O=C(CF)c1cc(ccc1F)I 1458a_100000688014_100015361967 [1,1,0,0,0,0|2,0,0]=4 4316 B12R1.354 O=C(CF)c1cc(ccc1F)O 1458a_100000037260_100015361967 [1,1,0,0,0,0|2,0,0]=4 4317 B12R1.354 O=C(CF)c1cc(ccc1I)Br 1458a_100000183945_100015361967 [1,1,0,0,0,0|2,0,0]=4 4318 B12R1.354 O=C(CF)c1cc(ccc1I)Cl 1458a_100000739379_100015361967 [1,1,0,0,0,0|2,0,0]=4 4319 B12R1.354 O=C(CF)c1cc(ccc1I)F 1458a_100000748905_100015361967 [1,1,0,0,0,0|2,0,0]=4 4320 B12R1.354 O=C(CF)c1cc(ccc1I)I 1458a_100000750460_100015361967 [1,1,0,0,0,0|2,0,0]=4 4321 B12R1.354 O=C(CF)c1cc(ccc1I)O 1458a_200009995701_100015361967 [1,1,0,0,0,0|2,0,0]=4 4322 B12R1.354 O=C(CF)c1cc(ccc1O)Br 1458a_100000212140_100015361967 [1,1,0,0,0,0|1,0,0]=3 4323 B12R1.354 O=C(CF)c1cc(ccc1O)Cl 1458a_100000212143_100015361967 [1,1,0,0,0,0|1,0,0]=3 4324 B12R1.354 O=C(CF)c1cc(ccc1O)F 1458a_100000742286_100015361967 [1,1,0,0,0,0|1,0,0]=3 4325 B12R1.354 O=C(CF)c1cc(ccc1O)I 1458a_100000212111_100015361967 [1,1,0,0,0,0|1,0,0]=3 4326 B12R1.354 O=C(CF)c1cc(ccc1O)O 1458a_100000758025_100015361967 [1,1,0,0,0,0|1,0,0]=3 4327 B12R1.1703 CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210202 [1,1,0,0,0,0|1,0,0]=3 4328 B12R1.1703 CCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210202 [1,1,0,0,0,0|1,0,0]=3 4329 B12R1.1703 CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210202 [1,1,0,0,0,0|1,0,0]=3 4330 B12R1.1703 CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210202 [1,1,0,0,0,0|1,0,0]=3 4331 B12R1.1703 CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210202 [1,1,0,0,0,0|1,0,0]=3 4332 B12R1.1703 CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210202 [1,1,0,0,0,0|1,0,0]=3 4333 B12R1.1703 CCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210202 [1,1,0,0,0,0|1,0,0]=3 4334 B12R1.1703 CCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210202 [1,1,0,0,0,0|1,0,0]=3 4335 B12R1.1703 CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210202 [1,1,0,0,0,0|1,0,0]=3 4336 B12R1.1703 CCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210202 [1,1,0,0,0,0|1,0,0]=3 4337 B12R1.1703 CCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210202 [1,1,0,0,0,0|1,0,0]=3 4338 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210202 [1,1,0,0,0,0|1,0,0]=3 4339 B12R1.1703 CCC(=O)c1ccc(cc1C)O 271570a_203496583355_200012361375 [1,1,0,0,0,0|1,0,0]=3 4340 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210202 [1,1,0,0,0,0|1,0,0]=3 4341 B12R1.1703 CCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210202 [1,1,0,0,0,0|1,0,0]=3 4342 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210202 [1,1,0,0,0,0|1,0,0]=3 4343 B12R1.1703 CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210202 [1,1,0,0,0,0|1,0,0]=3 4344 B12R1.1703 CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210202 [1,1,0,0,0,0|1,0,0]=3 4345 B12R1.1703 CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210202 [1,1,0,0,0,0|1,0,0]=3 4346 B12R1.1703 CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210202 [1,1,0,0,0,0|1,0,0]=3 4347 B12R1.1703 CCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210202 [1,1,0,0,0,0|1,0,0]=3 4348 B12R1.1703 CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210202 [1,1,0,0,0,0|1,0,0]=3 4349 B12R1.1703 CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210202 [1,1,0,0,0,0|1,0,0]=3 4350 B12R1.1703 CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210202 [1,1,0,0,0,0|1,0,0]=3 4351 B12R1.1703 CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210202 [1,1,0,0,0,0|1,0,0]=3 4352 B12R1.1703 CCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012360378 [1,1,0,0,0,0|1,0,0]=3 4353 B12R1.1703 CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210202 [1,1,0,0,0,0|1,0,0]=3 4354 B12R1.1703 CCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210202 [1,1,0,0,0,0|1,0,0]=3 4355 B12R1.1703 CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210202 [1,1,0,0,0,0|1,0,0]=3 4356 B12R1.1703 CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210202 [1,1,0,0,0,0|1,0,0]=3 4357 B12R1.1703 CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210202 [1,1,0,0,0,0|0,0,0]=2 4358 B12R1.1703 CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210202 [1,1,0,0,0,0|0,0,0]=2 4359 B12R1.1703 CCC(=O)c1ccc(cc1O)C 271570a_203496583355_200012349623 [1,1,0,0,0,0|0,0,0]=2 4360 B12R1.1703 CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210202 [1,1,0,0,0,0|0,0,0]=2 4361 B12R1.1703 CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210202 [1,1,0,0,0,0|0,0,0]=2 4362 B12R1.1703 CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210202 [1,1,0,0,0,0|0,0,0]=2 4363 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [1,1,0,0,0,0|0,0,0]=2 4364 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 11a_106832991635_100000762965 [1,1,0,0,0,0|2,0,0]=4 4365 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 1626a_100102657272_100000762965 [1,1,0,0,0,0|2,0,0]=4 4366 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 240690a_100102657272_100000762965 [1,1,0,0,0,0|2,0,0]=4 4367 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 527a_100102657272_100000762965 [1,1,0,0,0,0|2,0,0]=4 4368 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 11a_106832991635_100000685072 [1,1,0,0,0,0|2,0,0]=4 4369 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 1626a_100102657272_100000685072 [1,1,0,0,0,0|2,0,0]=4 4370 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 240690a_100102657272_100000685072 [1,1,0,0,0,0|2,0,0]=4 4371 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 527a_100102657272_100000685072 [1,1,0,0,0,0|2,0,0]=4 4372 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 11a_106832991635_100000766353 [1,1,0,0,0,0|2,0,0]=4 4373 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 1626a_100102657272_100000766353 [1,1,0,0,0,0|2,0,0]=4 4374 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 240690a_100102657272_100000766353 [1,1,0,0,0,0|2,0,0]=4 4375 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 527a_100102657272_100000766353 [1,1,0,0,0,0|2,0,0]=4 4376 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 11a_106832991635_100000212304 [1,1,0,0,0,0|2,0,0]=4 4377 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 1626a_100102657272_100000212304 [1,1,0,0,0,0|2,0,0]=4 4378 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 240690a_100102657272_100000212304 [1,1,0,0,0,0|2,0,0]=4 4379 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 527a_100102657272_100000212304 [1,1,0,0,0,0|2,0,0]=4 4380 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 11a_106832991635_100012360512 [1,1,0,0,0,0|2,0,0]=4 4381 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 1626a_100102657272_100012360512 [1,1,0,0,0,0|2,0,0]=4 4382 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 240690a_100102657272_100012360512 [1,1,0,0,0,0|2,0,0]=4 4383 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 527a_100102657272_100012360512 [1,1,0,0,0,0|2,0,0]=4 4384 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 240690a_100102657272_100012344906 [1,1,0,0,0,0|2,0,0]=4 4385 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 527a_100102657272_100012344906 [1,1,0,0,0,0|2,0,0]=4 4386 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 11a_106832991635_100000741311 [1,1,0,0,0,0|2,0,0]=4 4387 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 1626a_100102657272_100000741311 [1,1,0,0,0,0|2,0,0]=4 4388 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 240690a_100102657272_100000741311 [1,1,0,0,0,0|2,0,0]=4 4389 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 527a_100102657272_100000741311 [1,1,0,0,0,0|2,0,0]=4 4390 B12R1.1703 CNC(=O)c1ccc(cc1C)C 11a_106832991635_100000211164 [1,1,0,0,0,0|2,0,0]=4 4391 B12R1.1703 CNC(=O)c1ccc(cc1C)C 1626a_100102657272_100000211164 [1,1,0,0,0,0|2,0,0]=4 4392 B12R1.1703 CNC(=O)c1ccc(cc1C)C 240690a_100102657272_100000211164 [1,1,0,0,0,0|2,0,0]=4 4393 B12R1.1703 CNC(=O)c1ccc(cc1C)C 527a_100102657272_100000211164 [1,1,0,0,0,0|2,0,0]=4 4394 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 11a_106832991635_100000688705 [1,1,0,0,0,0|2,0,0]=4 4395 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 1626a_100102657272_100000688705 [1,1,0,0,0,0|2,0,0]=4 4396 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 240690a_100102657272_100000688705 [1,1,0,0,0,0|2,0,0]=4 4397 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 527a_100102657272_100000688705 [1,1,0,0,0,0|2,0,0]=4 4398 B12R1.1703 CNC(=O)c1ccc(cc1C)F 11a_106832991635_100000686989 [1,1,0,0,0,0|2,0,0]=4 4399 B12R1.1703 CNC(=O)c1ccc(cc1C)F 1626a_100102657272_100000686989 [1,1,0,0,0,0|2,0,0]=4 4400 B12R1.1703 CNC(=O)c1ccc(cc1C)F 240690a_100102657272_100000686989 [1,1,0,0,0,0|2,0,0]=4 4401 B12R1.1703 CNC(=O)c1ccc(cc1C)F 527a_100102657272_100000686989 [1,1,0,0,0,0|2,0,0]=4 4402 B12R1.1703 CNC(=O)c1ccc(cc1C)I 11a_106832991635_100010189873 [1,1,0,0,0,0|2,0,0]=4 4403 B12R1.1703 CNC(=O)c1ccc(cc1C)I 1626a_100102657272_100010189873 [1,1,0,0,0,0|2,0,0]=4 4404 B12R1.1703 CNC(=O)c1ccc(cc1C)I 240690a_100102657272_100010189873 [1,1,0,0,0,0|2,0,0]=4 4405 B12R1.1703 CNC(=O)c1ccc(cc1C)I 527a_100102657272_100010189873 [1,1,0,0,0,0|2,0,0]=4 4406 B12R1.1703 CNC(=O)c1ccc(cc1C)O 240690a_100102657272_100000692822 [1,1,0,0,0,0|2,0,0]=4 4407 B12R1.1703 CNC(=O)c1ccc(cc1C)O 527a_100102657272_100000692822 [1,1,0,0,0,0|2,0,0]=4 4408 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 11a_106832991635_100000741628 [1,1,0,0,0,0|2,0,0]=4 4409 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 1626a_100102657272_100000741628 [1,1,0,0,0,0|2,0,0]=4 4410 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 240690a_100102657272_100000741628 [1,1,0,0,0,0|2,0,0]=4 4411 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 527a_100102657272_100000741628 [1,1,0,0,0,0|2,0,0]=4 4412 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 11a_106832991635_100000766932 [1,1,0,0,0,0|2,0,0]=4 4413 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 1626a_100102657272_100000766932 [1,1,0,0,0,0|2,0,0]=4 4414 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 240690a_100102657272_100000766932 [1,1,0,0,0,0|2,0,0]=4 4415 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 527a_100102657272_100000766932 [1,1,0,0,0,0|2,0,0]=4 4416 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 11a_106832991635_100000185840 [1,1,0,0,0,0|2,0,0]=4 4417 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 1626a_100102657272_100000185840 [1,1,0,0,0,0|2,0,0]=4 4418 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 240690a_100102657272_100000185840 [1,1,0,0,0,0|2,0,0]=4 4419 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 527a_100102657272_100000185840 [1,1,0,0,0,0|2,0,0]=4 4420 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 11a_106832991635_100000211397 [1,1,0,0,0,0|2,0,0]=4 4421 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 1626a_100102657272_100000211397 [1,1,0,0,0,0|2,0,0]=4 4422 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 240690a_100102657272_100000211397 [1,1,0,0,0,0|2,0,0]=4 4423 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 527a_100102657272_100000211397 [1,1,0,0,0,0|2,0,0]=4 4424 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 11a_106832991635_100000751301 [1,1,0,0,0,0|2,0,0]=4 4425 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 1626a_100102657272_100000751301 [1,1,0,0,0,0|2,0,0]=4 4426 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 240690a_100102657272_100000751301 [1,1,0,0,0,0|2,0,0]=4 4427 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 527a_100102657272_100000751301 [1,1,0,0,0,0|2,0,0]=4 4428 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 240690a_100102657272_100000702456 [1,1,0,0,0,0|2,0,0]=4 4429 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 527a_100102657272_100000702456 [1,1,0,0,0,0|2,0,0]=4 4430 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 11a_106832991635_100000214689 [1,1,0,0,0,0|2,0,0]=4 4431 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 1626a_100102657272_100000214689 [1,1,0,0,0,0|2,0,0]=4 4432 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 240690a_100102657272_100000214689 [1,1,0,0,0,0|2,0,0]=4 4433 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 527a_100102657272_100000214689 [1,1,0,0,0,0|2,0,0]=4 4434 B12R1.1703 CNC(=O)c1ccc(cc1F)C 11a_106832991635_100000766033 [1,1,0,0,0,0|2,0,0]=4 4435 B12R1.1703 CNC(=O)c1ccc(cc1F)C 1626a_100102657272_100000766033 [1,1,0,0,0,0|2,0,0]=4 4436 B12R1.1703 CNC(=O)c1ccc(cc1F)C 240690a_100102657272_100000766033 [1,1,0,0,0,0|2,0,0]=4 4437 B12R1.1703 CNC(=O)c1ccc(cc1F)C 527a_100102657272_100000766033 [1,1,0,0,0,0|2,0,0]=4 4438 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 11a_106832991635_100000212326 [1,1,0,0,0,0|2,0,0]=4 4439 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 1626a_100102657272_100000212326 [1,1,0,0,0,0|2,0,0]=4 4440 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 240690a_100102657272_100000212326 [1,1,0,0,0,0|2,0,0]=4 4441 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 527a_100102657272_100000212326 [1,1,0,0,0,0|2,0,0]=4 4442 B12R1.1703 CNC(=O)c1ccc(cc1F)F 11a_106832991635_100000211022 [1,1,0,0,0,0|2,0,0]=4 4443 B12R1.1703 CNC(=O)c1ccc(cc1F)F 1626a_100102657272_100000211022 [1,1,0,0,0,0|2,0,0]=4 4444 B12R1.1703 CNC(=O)c1ccc(cc1F)F 240690a_100102657272_100000211022 [1,1,0,0,0,0|2,0,0]=4 4445 B12R1.1703 CNC(=O)c1ccc(cc1F)F 527a_100102657272_100000211022 [1,1,0,0,0,0|2,0,0]=4 4446 B12R1.1703 CNC(=O)c1ccc(cc1F)I 11a_106832991635_100000037189 [1,1,0,0,0,0|2,0,0]=4 4447 B12R1.1703 CNC(=O)c1ccc(cc1F)I 1626a_100102657272_100000037189 [1,1,0,0,0,0|2,0,0]=4 4448 B12R1.1703 CNC(=O)c1ccc(cc1F)I 240690a_100102657272_100000037189 [1,1,0,0,0,0|2,0,0]=4 4449 B12R1.1703 CNC(=O)c1ccc(cc1F)I 527a_100102657272_100000037189 [1,1,0,0,0,0|2,0,0]=4 4450 B12R1.1703 CNC(=O)c1ccc(cc1F)O 240690a_100102657272_100000689029 [1,1,0,0,0,0|2,0,0]=4 4451 B12R1.1703 CNC(=O)c1ccc(cc1F)O 271570a_203496583355_100000233932 [1,1,0,0,0,0|2,0,0]=4 4452 B12R1.1703 CNC(=O)c1ccc(cc1F)O 527a_100102657272_100000689029 [1,1,0,0,0,0|2,0,0]=4 4453 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 11a_106832991635_100000751167 [1,1,0,0,0,0|2,0,0]=4 4454 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 1626a_100102657272_100000751167 [1,1,0,0,0,0|2,0,0]=4 4455 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 240690a_100102657272_100000751167 [1,1,0,0,0,0|2,0,0]=4 4456 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 527a_100102657272_100000751167 [1,1,0,0,0,0|2,0,0]=4 4457 B12R1.1703 CNC(=O)c1ccc(cc1I)C 11a_106832991635_100009999607 [1,1,0,0,0,0|2,0,0]=4 4458 B12R1.1703 CNC(=O)c1ccc(cc1I)C 1626a_100102657272_100009999607 [1,1,0,0,0,0|2,0,0]=4 4459 B12R1.1703 CNC(=O)c1ccc(cc1I)C 240690a_100102657272_100009999607 [1,1,0,0,0,0|2,0,0]=4 4460 B12R1.1703 CNC(=O)c1ccc(cc1I)C 527a_100102657272_100009999607 [1,1,0,0,0,0|2,0,0]=4 4461 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 11a_106832991635_100000739380 [1,1,0,0,0,0|2,0,0]=4 4462 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 1626a_100102657272_100000739380 [1,1,0,0,0,0|2,0,0]=4 4463 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 240690a_100102657272_100000739380 [1,1,0,0,0,0|2,0,0]=4 4464 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 527a_100102657272_100000739380 [1,1,0,0,0,0|2,0,0]=4 4465 B12R1.1703 CNC(=O)c1ccc(cc1I)F 11a_106832991635_100000739341 [1,1,0,0,0,0|2,0,0]=4 4466 B12R1.1703 CNC(=O)c1ccc(cc1I)F 1626a_100102657272_100000739341 [1,1,0,0,0,0|2,0,0]=4 4467 B12R1.1703 CNC(=O)c1ccc(cc1I)F 240690a_100102657272_100000739341 [1,1,0,0,0,0|2,0,0]=4 4468 B12R1.1703 CNC(=O)c1ccc(cc1I)F 527a_100102657272_100000739341 [1,1,0,0,0,0|2,0,0]=4 4469 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 240690a_100102657272_100000744433 [1,1,0,0,0,0|1,0,0]=3 4470 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 527a_100102657272_100000744433 [1,1,0,0,0,0|1,0,0]=3 4471 B12R1.1703 CNC(=O)c1ccc(cc1O)C 1626a_100102657272_100000212137 [1,1,0,0,0,0|1,0,0]=3 4472 B12R1.1703 CNC(=O)c1ccc(cc1O)C 240690a_100102657272_100000212137 [1,1,0,0,0,0|1,0,0]=3 4473 B12R1.1703 CNC(=O)c1ccc(cc1O)C 527a_100102657272_100000212137 [1,1,0,0,0,0|1,0,0]=3 4474 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 11a_106832991635_100000188622 [1,1,0,0,0,0|1,0,0]=3 4475 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 240690a_100102657272_100000188622 [1,1,0,0,0,0|1,0,0]=3 4476 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 527a_100102657272_100000188622 [1,1,0,0,0,0|1,0,0]=3 4477 B12R1.1703 CNC(=O)c1ccc(cc1O)F 240690a_100102657272_100000746061 [1,1,0,0,0,0|1,0,0]=3 4478 B12R1.1703 CNC(=O)c1ccc(cc1O)F 271570a_203496583355_200000206206 [1,1,0,0,0,0|1,0,0]=3 4479 B12R1.1703 CNC(=O)c1ccc(cc1O)F 527a_100102657272_100000746061 [1,1,0,0,0,0|1,0,0]=3 4480 B12R1.1703 CNC(=O)c1ccc(cc1O)I 240690a_100102657272_100000091984 [1,1,0,0,0,0|1,0,0]=3 4481 B12R1.1703 CNC(=O)c1ccc(cc1O)I 527a_100102657272_100000091984 [1,1,0,0,0,0|1,0,0]=3 4482 B12R1.1703 COC(=O)c1ccc(c[n+]1[O-])O 271570a_203496583355_100015641791 [1,1,0,0,0,0|1,0,1]=4 4483 B12R1.1703 COC(=O)c1ccc(cc1Br)O 271570a_203496583355_100010247156 [1,1,0,0,0,0|1,0,0]=3 4484 B12R1.1703 COC(=O)c1ccc(cc1C)O 271570a_203496583355_100000747612 [1,1,0,0,0,0|1,0,0]=3 4485 B12R1.1703 COC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060724 [1,1,0,0,0,0|1,0,0]=3 4486 B12R1.1703 COC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216654 [1,1,0,0,0,0|1,0,0]=3 4487 B12R1.1703 COC(=O)c1ccc(cc1N)O 271570a_203496583355_100011373473 [1,1,0,0,0,0|1,0,0]=3 4488 B12R1.1703 COC(=O)c1ccc(cc1O)Br 271570a_203496583355_100000701758 [1,1,0,0,0,0|0,0,0]=2 4489 B12R1.1703 COC(=O)c1ccc(cc1O)C 271570a_203496583355_100012340597 [1,1,0,0,0,0|0,0,0]=2 4490 B12R1.1703 COC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047510 [1,1,0,0,0,0|0,0,0]=2 4491 B12R1.1703 COC(=O)c1ccc(cc1O)F 271570a_203496583355_100000204356 [1,1,0,0,0,0|0,0,0]=2 4492 B12R1.1703 COC(=O)c1ccc(cc1O)N 271570a_203496583355_100009998378 [1,1,0,0,0,0|0,0,0]=2 4493 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100000062286 [1,1,0,0,0,0|0,0,0]=2 4494 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100010150825 [1,1,0,0,0,0|0,0,0]=2 4495 B12R1.1703 COC(=O)c1ccc(nc1C)O 271570a_203496583355_100000692007 [1,1,0,0,0,0|2,0,0]=4 4496 B12R1.1703 COC(=O)c1ccc(nc1F)O 271570a_203496583355_100010189635 [1,1,0,0,0,0|2,0,0]=4 4497 B12R1.1703 COC(=O)c1ccc(nc1N)O 271570a_203496583355_100000142702 [1,1,0,0,0,0|2,0,0]=4 4498 B12R1.1703 COC(=O)c1ccc(nc1O)C 271570a_203496583355_100000054099 [1,1,0,0,0,0|1,0,0]=3 4499 B12R1.1703 COC(=O)c1ccc(nc1O)N 271570a_203496583355_100009865240 [1,1,0,0,0,0|1,0,0]=3 4500 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100015962272 [1,1,0,0,0,0|1,0,0]=3 4501 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100016008356 [1,1,0,0,0,0|1,0,0]=3 4502 B12R1.1703 COC(=O)c1cnc(cc1C)O 271570a_203496583355_100009871181 [1,1,0,0,0,0|2,0,0]=4 4503 B12R1.1703 COC(=O)c1cnc(cc1N)O 271570a_203496583355_100009862510 [1,1,0,0,0,0|2,0,0]=4 4504 B12R1.1703 COC(=O)c1cnc(cc1O)C 271570a_203496583355_100011998247 [1,1,0,0,0,0|1,0,0]=3 4505 B12R1.1703 COC(=O)c1cnc(nc1O)N 271570a_203496583355_100010277515 [1,1,0,0,0,0|2,0,0]=4 4506 B12R1.1703 COC(=O)c1n[nH]c(=O)cc1O 271570a_203496583355_200021564684 [1,1,0,0,0,0|2,0,0]=4 4507 B12R1.1703 COC(=O)c1ncc(cc1C)O 271570a_203496583355_100010178714 [1,1,0,0,0,0|2,0,0]=4 4508 B12R1.1703 COC(=O)c1ncc(cc1F)O 271570a_203496583355_100000695675 [1,1,0,0,0,0|2,0,0]=4 4509 B12R1.1703 COC(=O)c1ncc(cc1N)O 271570a_203496583355_100010090751 [1,1,0,0,0,0|2,0,0]=4 4510 B12R1.1703 COC(=O)c1ncc(cc1O)C 271570a_203496583355_100010167497 [1,1,0,0,0,0|1,0,0]=3 4511 B12R1.1703 COC(=O)c1ncc(cc1O)F 271570a_203496583355_100010189631 [1,1,0,0,0,0|1,0,0]=3 4512 B12R1.1703 COC(=O)c1ncc(cc1O)O 271570a_203496583355_100010071521 [1,1,0,0,0,0|1,0,0]=3 4513 B12R1.1703 COC(=O)c1ncc(nc1O)C 271570a_203496583355_100000099855 [1,1,0,0,0,0|2,0,0]=4 4514 B12R1.1703 Cc1cc(ccc1C(=O)CF)Br 1458a_100000741311_100015361967 [1,1,0,0,0,0|2,0,0]=4 4515 B12R1.1703 Cc1cc(ccc1C(=O)CF)Cl 1458a_100000688705_100015361967 [1,1,0,0,0,0|2,0,0]=4 4516 B12R1.1703 Cc1cc(ccc1C(=O)CF)F 1458a_100000686989_100015361967 [1,1,0,0,0,0|2,0,0]=4 4517 B12R1.1703 Cc1cc(ccc1C(=O)CF)I 1458a_100010189873_100015361967 [1,1,0,0,0,0|2,0,0]=4 4518 B12R1.1703 Cc1cc(ccc1C(=O)CF)O 1458a_100000692822_100015361967 [1,1,0,0,0,0|2,0,0]=4 4519 B12R1.1703 Cc1ccc(c(c1)Br)C(=O)CF 1458a_100000685072_100015361967 [1,1,0,0,0,0|2,0,0]=4 4520 B12R1.1703 Cc1ccc(c(c1)C)C(=O)CF 1458a_100000211164_100015361967 [1,1,0,0,0,0|2,0,0]=4 4521 B12R1.1703 Cc1ccc(c(c1)Cl)C(=O)CF 1458a_100000766932_100015361967 [1,1,0,0,0,0|2,0,0]=4 4522 B12R1.1703 Cc1ccc(c(c1)F)C(=O)CF 1458a_100000766033_100015361967 [1,1,0,0,0,0|2,0,0]=4 4523 B12R1.1703 Cc1ccc(c(c1)I)C(=O)CF 1458a_100009999607_100015361967 [1,1,0,0,0,0|2,0,0]=4 4524 B12R1.1703 Cc1ccc(c(c1)O)C(=O)CF 1458a_100000212137_100015361967 [1,1,0,0,0,0|1,0,0]=3 4525 B12R1.1703 Cc1ccc(c(c1)O)C(=O)NN 271570a_203496583355_200012340525 [1,1,0,0,0,0|2,0,0]=4 4526 B12R1.1703 NNC(=O)c1ccc(cc1O)F 271570a_203496583355_100000203923 [1,1,0,0,0,0|2,0,0]=4 4527 B12R1.1703 O=C(CF)c1ccc(cc1Br)Br 1458a_100000762965_100015361967 [1,1,0,0,0,0|2,0,0]=4 4528 B12R1.1703 O=C(CF)c1ccc(cc1Br)Cl 1458a_100000766353_100015361967 [1,1,0,0,0,0|2,0,0]=4 4529 B12R1.1703 O=C(CF)c1ccc(cc1Br)F 1458a_100000212304_100015361967 [1,1,0,0,0,0|2,0,0]=4 4530 B12R1.1703 O=C(CF)c1ccc(cc1Br)I 1458a_100012360512_100015361967 [1,1,0,0,0,0|2,0,0]=4 4531 B12R1.1703 O=C(CF)c1ccc(cc1Br)O 1458a_100012344906_100015361967 [1,1,0,0,0,0|2,0,0]=4 4532 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Br 1458a_100000741628_100015361967 [1,1,0,0,0,0|2,0,0]=4 4533 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Cl 1458a_100000185840_100015361967 [1,1,0,0,0,0|2,0,0]=4 4534 B12R1.1703 O=C(CF)c1ccc(cc1Cl)F 1458a_100000211397_100015361967 [1,1,0,0,0,0|2,0,0]=4 4535 B12R1.1703 O=C(CF)c1ccc(cc1Cl)I 1458a_100000751301_100015361967 [1,1,0,0,0,0|2,0,0]=4 4536 B12R1.1703 O=C(CF)c1ccc(cc1Cl)O 1458a_100000702456_100015361967 [1,1,0,0,0,0|2,0,0]=4 4537 B12R1.1703 O=C(CF)c1ccc(cc1F)Br 1458a_100000214689_100015361967 [1,1,0,0,0,0|2,0,0]=4 4538 B12R1.1703 O=C(CF)c1ccc(cc1F)Cl 1458a_100000212326_100015361967 [1,1,0,0,0,0|2,0,0]=4 4539 B12R1.1703 O=C(CF)c1ccc(cc1F)F 1458a_100000211022_100015361967 [1,1,0,0,0,0|2,0,0]=4 4540 B12R1.1703 O=C(CF)c1ccc(cc1F)I 1458a_100000037189_100015361967 [1,1,0,0,0,0|2,0,0]=4 4541 B12R1.1703 O=C(CF)c1ccc(cc1F)O 1458a_100000689029_100015361967 [1,1,0,0,0,0|2,0,0]=4 4542 B12R1.1703 O=C(CF)c1ccc(cc1I)Br 1458a_100000751167_100015361967 [1,1,0,0,0,0|2,0,0]=4 4543 B12R1.1703 O=C(CF)c1ccc(cc1I)Cl 1458a_100000739380_100015361967 [1,1,0,0,0,0|2,0,0]=4 4544 B12R1.1703 O=C(CF)c1ccc(cc1I)F 1458a_100000739341_100015361967 [1,1,0,0,0,0|2,0,0]=4 4545 B12R1.1703 O=C(CF)c1ccc(cc1O)Br 1458a_100000744433_100015361967 [1,1,0,0,0,0|1,0,0]=3 4546 B12R1.1703 O=C(CF)c1ccc(cc1O)Cl 1458a_100000188622_100015361967 [1,1,0,0,0,0|1,0,0]=3 4547 B12R1.1703 O=C(CF)c1ccc(cc1O)F 1458a_100000746061_100015361967 [1,1,0,0,0,0|1,0,0]=3 4548 B12R1.1703 O=C(CF)c1ccc(cc1O)I 1458a_100000091984_100015361967 [1,1,0,0,0,0|1,0,0]=3 4549 B12R1.1703 O=C(CF)c1ccc(cc1O)O 1458a_100000212172_100015361967 [1,1,0,0,0,0|1,0,0]=3 4550 B12R1.3441 CCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210202 [1,1,0,0,0,0|1,0,0]=3 4551 B12R1.3441 CCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000210202 [1,1,0,0,0,0|1,0,0]=3 4552 B12R1.3441 CCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210202 [1,1,0,0,0,0|1,0,0]=3 4553 B12R1.3441 CCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210202 [1,1,0,0,0,0|1,0,0]=3 4554 B12R1.3441 CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210202 [1,1,0,0,0,0|0,0,0]=2 4555 B12R1.3441 CCC(=O)c1c(cccc1C)C 1458a_100000758298_100000210202 [1,1,0,0,0,0|1,0,0]=3 4556 B12R1.3441 CCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000210202 [1,1,0,0,0,0|1,0,0]=3 4557 B12R1.3441 CCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210202 [1,1,0,0,0,0|1,0,0]=3 4558 B12R1.3441 CCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210202 [1,1,0,0,0,0|1,0,0]=3 4559 B12R1.3441 CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210202 [1,1,0,0,0,0|0,0,0]=2 4560 B12R1.3441 CCC(=O)c1c(cccc1F)C 1458a_100000762013_100000210202 [1,1,0,0,0,0|1,0,0]=3 4561 B12R1.3441 CCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210202 [1,1,0,0,0,0|1,0,0]=3 4562 B12R1.3441 CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210202 [1,1,0,0,0,0|0,0,0]=2 4563 B12R1.3441 CCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210202 [1,1,0,0,0,0|1,0,0]=3 4564 B12R1.3441 CCC(=O)c1c(cccc1I)C 1458a_100000688020_100000210202 [1,1,0,0,0,0|1,0,0]=3 4565 B12R1.3441 CCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210202 [1,1,0,0,0,0|1,0,0]=3 4566 B12R1.3441 CCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210202 [1,1,0,0,0,0|1,0,0]=3 4567 B12R1.3441 CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210202 [1,1,0,0,0,0|0,0,0]=2 4568 B12R1.3441 CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210202 [1,1,0,0,0,0|0,0,0]=2 4569 B12R1.3441 CNC(=O)c1c(cccc1Br)Br 11a_106832991635_100000690891 [1,1,0,0,0,0|2,0,0]=4 4570 B12R1.3441 CNC(=O)c1c(cccc1Br)Br 1626a_100102657272_100000690891 [1,1,0,0,0,0|2,0,0]=4 4571 B12R1.3441 CNC(=O)c1c(cccc1Br)Br 240690a_100102657272_100000690891 [1,1,0,0,0,0|2,0,0]=4 4572 B12R1.3441 CNC(=O)c1c(cccc1Br)Br 527a_100102657272_100000690891 [1,1,0,0,0,0|2,0,0]=4 4573 B12R1.3441 CNC(=O)c1c(cccc1Br)C 11a_106832991635_100000701904 [1,1,0,0,0,0|2,0,0]=4 4574 B12R1.3441 CNC(=O)c1c(cccc1Br)C 1626a_100102657272_100000701904 [1,1,0,0,0,0|2,0,0]=4 4575 B12R1.3441 CNC(=O)c1c(cccc1Br)C 240690a_100102657272_100000701904 [1,1,0,0,0,0|2,0,0]=4 4576 B12R1.3441 CNC(=O)c1c(cccc1Br)C 527a_100102657272_100000701904 [1,1,0,0,0,0|2,0,0]=4 4577 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl 11a_106832991635_100011253703 [1,1,0,0,0,0|2,0,0]=4 4578 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl 1626a_100102657272_100011253703 [1,1,0,0,0,0|2,0,0]=4 4579 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl 240690a_100102657272_100011253703 [1,1,0,0,0,0|2,0,0]=4 4580 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl 527a_100102657272_100011253703 [1,1,0,0,0,0|2,0,0]=4 4581 B12R1.3441 CNC(=O)c1c(cccc1Br)F 11a_106832991635_100000752694 [1,1,0,0,0,0|2,0,0]=4 4582 B12R1.3441 CNC(=O)c1c(cccc1Br)F 1626a_100102657272_100000752694 [1,1,0,0,0,0|2,0,0]=4 4583 B12R1.3441 CNC(=O)c1c(cccc1Br)F 240690a_100102657272_100000752694 [1,1,0,0,0,0|2,0,0]=4 4584 B12R1.3441 CNC(=O)c1c(cccc1Br)F 527a_100102657272_100000752694 [1,1,0,0,0,0|2,0,0]=4 4585 B12R1.3441 CNC(=O)c1c(cccc1Br)O 240690a_100102657272_100011935254 [1,1,0,0,0,0|1,0,0]=3 4586 B12R1.3441 CNC(=O)c1c(cccc1Br)O 527a_100102657272_100011935254 [1,1,0,0,0,0|1,0,0]=3 4587 B12R1.3441 CNC(=O)c1c(cccc1C)C 11a_106832991635_100000758298 [1,1,0,0,0,0|2,0,0]=4 4588 B12R1.3441 CNC(=O)c1c(cccc1C)C 1626a_100102657272_100000758298 [1,1,0,0,0,0|2,0,0]=4 4589 B12R1.3441 CNC(=O)c1c(cccc1C)C 240690a_100102657272_100000758298 [1,1,0,0,0,0|2,0,0]=4 4590 B12R1.3441 CNC(=O)c1c(cccc1Cl)C 11a_106832991635_100000692601 [1,1,0,0,0,0|2,0,0]=4 4591 B12R1.3441 CNC(=O)c1c(cccc1Cl)C 1626a_100102657272_100000692601 [1,1,0,0,0,0|2,0,0]=4 4592 B12R1.3441 CNC(=O)c1c(cccc1Cl)C 240690a_100102657272_100000692601 [1,1,0,0,0,0|2,0,0]=4 4593 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl 11a_106832991635_100000210656 [1,1,0,0,0,0|2,0,0]=4 4594 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl 1626a_100102657272_100000210656 [1,1,0,0,0,0|2,0,0]=4 4595 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl 240690a_100102657272_100000210656 [1,1,0,0,0,0|2,0,0]=4 4596 B12R1.3441 CNC(=O)c1c(cccc1Cl)F 11a_106832991635_100000210369 [1,1,0,0,0,0|2,0,0]=4 4597 B12R1.3441 CNC(=O)c1c(cccc1Cl)F 1626a_100102657272_100000210369 [1,1,0,0,0,0|2,0,0]=4 4598 B12R1.3441 CNC(=O)c1c(cccc1Cl)F 240690a_100102657272_100000210369 [1,1,0,0,0,0|2,0,0]=4 4599 B12R1.3441 CNC(=O)c1c(cccc1Cl)F 527a_100102657272_100000210369 [1,1,0,0,0,0|2,0,0]=4 4600 B12R1.3441 CNC(=O)c1c(cccc1Cl)O 240690a_100102657272_100000745519 [1,1,0,0,0,0|1,0,0]=3 4601 B12R1.3441 CNC(=O)c1c(cccc1Cl)O 527a_100102657272_100000745519 [1,1,0,0,0,0|1,0,0]=3 4602 B12R1.3441 CNC(=O)c1c(cccc1F)C 11a_106832991635_100000762013 [1,1,0,0,0,0|2,0,0]=4 4603 B12R1.3441 CNC(=O)c1c(cccc1F)C 1626a_100102657272_100000762013 [1,1,0,0,0,0|2,0,0]=4 4604 B12R1.3441 CNC(=O)c1c(cccc1F)C 240690a_100102657272_100000762013 [1,1,0,0,0,0|2,0,0]=4 4605 B12R1.3441 CNC(=O)c1c(cccc1F)C 527a_100102657272_100000762013 [1,1,0,0,0,0|2,0,0]=4 4606 B12R1.3441 CNC(=O)c1c(cccc1F)F 11a_106832991635_100000210804 [1,1,0,0,0,0|2,0,0]=4 4607 B12R1.3441 CNC(=O)c1c(cccc1F)F 1626a_100102657272_100000210804 [1,1,0,0,0,0|2,0,0]=4 4608 B12R1.3441 CNC(=O)c1c(cccc1F)F 240690a_100102657272_100000210804 [1,1,0,0,0,0|2,0,0]=4 4609 B12R1.3441 CNC(=O)c1c(cccc1F)F 527a_100102657272_100000210804 [1,1,0,0,0,0|2,0,0]=4 4610 B12R1.3441 CNC(=O)c1c(cccc1F)O 271570a_203496583355_100012642803 [1,1,0,0,0,0|1,0,0]=3 4611 B12R1.3441 CNC(=O)c1c(cccc1F)O 527a_100102657272_100000763259 [1,1,0,0,0,0|1,0,0]=3 4612 B12R1.3441 CNC(=O)c1c(cccc1I)Br 11a_106832991635_100010232521 [1,1,0,0,0,0|2,0,0]=4 4613 B12R1.3441 CNC(=O)c1c(cccc1I)Br 1626a_100102657272_100010232521 [1,1,0,0,0,0|2,0,0]=4 4614 B12R1.3441 CNC(=O)c1c(cccc1I)Br 240690a_100102657272_100010232521 [1,1,0,0,0,0|2,0,0]=4 4615 B12R1.3441 CNC(=O)c1c(cccc1I)Br 527a_100102657272_100010232521 [1,1,0,0,0,0|2,0,0]=4 4616 B12R1.3441 CNC(=O)c1c(cccc1I)C 11a_106832991635_100000688020 [1,1,0,0,0,0|2,0,0]=4 4617 B12R1.3441 CNC(=O)c1c(cccc1I)C 1626a_100102657272_100000688020 [1,1,0,0,0,0|2,0,0]=4 4618 B12R1.3441 CNC(=O)c1c(cccc1I)C 240690a_100102657272_100000688020 [1,1,0,0,0,0|2,0,0]=4 4619 B12R1.3441 CNC(=O)c1c(cccc1I)Cl 11a_106832991635_100000702859 [1,1,0,0,0,0|2,0,0]=4 4620 B12R1.3441 CNC(=O)c1c(cccc1I)Cl 1626a_100102657272_100000702859 [1,1,0,0,0,0|2,0,0]=4 4621 B12R1.3441 CNC(=O)c1c(cccc1I)Cl 240690a_100102657272_100000702859 [1,1,0,0,0,0|2,0,0]=4 4622 B12R1.3441 CNC(=O)c1c(cccc1I)Cl 527a_100102657272_100000702859 [1,1,0,0,0,0|2,0,0]=4 4623 B12R1.3441 CNC(=O)c1c(cccc1I)F 11a_106832991635_100000023732 [1,1,0,0,0,0|2,0,0]=4 4624 B12R1.3441 CNC(=O)c1c(cccc1I)F 1626a_100102657272_100000023732 [1,1,0,0,0,0|2,0,0]=4 4625 B12R1.3441 CNC(=O)c1c(cccc1I)F 240690a_100102657272_100000023732 [1,1,0,0,0,0|2,0,0]=4 4626 B12R1.3441 CNC(=O)c1c(cccc1O)O 527a_100102657272_100000755285 [1,1,0,0,0,0|1,0,0]=3 4627 B12R1.3441 COC(=O)c1c(cccc1Br)O 271570a_203496583355_100010247157 [1,1,0,0,0,0|0,0,0]=2 4628 B12R1.3441 COC(=O)c1c(cccc1Cl)O 271570a_203496583355_100010150959 [1,1,0,0,0,0|0,0,0]=2 4629 B12R1.3441 COC(=O)c1c(cccc1F)O 271570a_203496583355_100000150693 [1,1,0,0,0,0|0,0,0]=2 4630 B12R1.3441 COC(=O)c1c(cccc1O)C 271570a_203496583355_100010204206 [1,1,0,0,0,0|0,0,0]=2 4631 B12R1.3441 COC(=O)c1c(cccc1O)N 271570a_203496583355_100010253892 [1,1,0,0,0,0|0,0,0]=2 4632 B12R1.3441 COC(=O)c1c(ccnc1Cl)O 271570a_203496583355_100010138530 [1,1,0,0,0,0|1,0,0]=3 4633 B12R1.3441 COC(=O)c1c(ccnc1F)O 271570a_203496583355_100010150474 [1,1,0,0,0,0|1,0,0]=3 4634 B12R1.3441 COC(=O)c1c(ccnc1O)F 271570a_203496583355_100015560809 [1,1,0,0,0,0|1,0,0]=3 4635 B12R1.3441 COC(=O)c1c(ccnc1O)N 271570a_203496583355_100009985557 [1,1,0,0,0,0|1,0,0]=3 4636 B12R1.3441 COC(=O)c1c(cncc1F)O 271570a_203496583355_100010189632 [1,1,0,0,0,0|1,0,0]=3 4637 B12R1.3441 COC(=O)c1c(ncnc1O)N 271570a_203496583355_200021259019 [1,1,0,0,0,0|2,0,0]=4 4638 B12R1.3441 Cc1cccc(c1C(=O)CF)Br 1458a_100000701904_100015361967 [1,1,0,0,0,0|2,0,0]=4 4639 B12R1.3441 Cc1cccc(c1C(=O)CF)C 1458a_100000758298_100015361967 [1,1,0,0,0,0|2,0,0]=4 4640 B12R1.3441 Cc1cccc(c1C(=O)CF)Cl 1458a_100000692601_100015361967 [1,1,0,0,0,0|2,0,0]=4 4641 B12R1.3441 Cc1cccc(c1C(=O)CF)F 1458a_100000762013_100015361967 [1,1,0,0,0,0|2,0,0]=4 4642 B12R1.3441 Cc1cccc(c1C(=O)CF)I 1458a_100000688020_100015361967 [1,1,0,0,0,0|2,0,0]=4 4643 B12R1.3441 Cc1cccc(c1C(=O)CF)O 1458a_100011934116_100015361967 [1,1,0,0,0,0|1,0,0]=3 4644 B12R1.3441 O=C(CF)c1c(cccc1Br)Br 1458a_100000690891_100015361967 [1,1,0,0,0,0|2,0,0]=4 4645 B12R1.3441 O=C(CF)c1c(cccc1Br)Cl 1458a_100011253703_100015361967 [1,1,0,0,0,0|2,0,0]=4 4646 B12R1.3441 O=C(CF)c1c(cccc1Br)F 1458a_100000752694_100015361967 [1,1,0,0,0,0|2,0,0]=4 4647 B12R1.3441 O=C(CF)c1c(cccc1Br)O 1458a_100011935254_100015361967 [1,1,0,0,0,0|1,0,0]=3 4648 B12R1.3441 O=C(CF)c1c(cccc1Cl)Cl 1458a_100000210656_100015361967 [1,1,0,0,0,0|2,0,0]=4 4649 B12R1.3441 O=C(CF)c1c(cccc1Cl)F 1458a_100000210369_100015361967 [1,1,0,0,0,0|2,0,0]=4 4650 B12R1.3441 O=C(CF)c1c(cccc1Cl)O 1458a_100000745519_100015361967 [1,1,0,0,0,0|1,0,0]=3 4651 B12R1.3441 O=C(CF)c1c(cccc1F)F 1458a_100000210804_100015361967 [1,1,0,0,0,0|2,0,0]=4 4652 B12R1.3441 O=C(CF)c1c(cccc1F)O 1458a_100000763259_100015361967 [1,1,0,0,0,0|1,0,0]=3 4653 B12R1.3441 O=C(CF)c1c(cccc1I)Br 1458a_100010232521_100015361967 [1,1,0,0,0,0|2,0,0]=4 4654 B12R1.3441 O=C(CF)c1c(cccc1I)Cl 1458a_100000702859_100015361967 [1,1,0,0,0,0|2,0,0]=4 4655 B12R1.3441 O=C(CF)c1c(cccc1I)F 1458a_100000023732_100015361967 [1,1,0,0,0,0|2,0,0]=4 4656 B12R1.3441 O=C(CF)c1c(cccc1O)O 1458a_100000755285_100015361967 [1,1,0,0,0,0|1,0,0]=3 4657 B12R1.313 CCOC(=O)c1cn(nc1O)C 271570a_203496583355_100010687020 [0,1,0,0,1,0|2,0,0]=4 4658 B12R1.313 CCOC(=O)c1nc(sc1O)C 271570a_203496583355_200011103085 [0,1,0,0,1,0|2,0,0]=4 4659 B12R1.313 CCOC(=O)c1nn(cc1O)C 271570a_203496583355_100010003995 [0,1,0,0,1,0|2,0,0]=4 4660 B12R1.316 C=Cc1cscc1C(=O)OCC 271570a_100011290941_100012353568 [0,1,0,0,1,0|2,0,0]=4 4661 B12R1.316 C=Cc1sccc1C(=O)OCC 271570a_100011290941_100010219215 [0,1,0,0,1,0|2,0,0]=4 4662 B12R1.316 CCOC(=O)c1ccsc1SC 62a_200000210301_100010219215 [0,1,0,0,1,0|1,1,0]=4 4663 B12R1.316 CCOC(=O)c1ccsc1S[13CH3] 62a_200025704644_100010219215 [0,1,0,0,1,0|1,1,0]=4 4664 B12R1.316 CCOC(=O)c1cscc1SC 62a_200000210301_100012353568 [0,1,0,0,1,0|1,1,0]=4 4665 B12R1.316 CCOC(=O)c1cscc1S[13CH3] 62a_200025704644_100012353568 [0,1,0,0,1,0|1,1,0]=4 4666 B12R1.460 CCOCC(=O)c1cccn1C 34a_100121572206_200011262399 [0,1,0,0,1,0|2,0,0]=4 4667 B12R1.460 CCOCC(=O)c1sccc1Br 34a_100121572206_100000740827 [0,1,0,0,1,0|2,0,0]=4 4668 B12R1.1589 CCOC(=O)c1c(cnn1C)O 271570a_203496583355_100012569109 [0,1,0,0,1,0|2,0,0]=4 4669 B12R1.1589 CCOC(=O)c1c(n[nH]c1O)N 271570a_203496583355_100011165294 [0,1,0,0,1,0|2,0,0]=4 4670 B14R1.17 CC#CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000763181 [0,1,0,0,0,1|1,0,1]=4 4671 B14R1.17 CC#CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000763181 [0,1,0,0,0,1|1,0,1]=4 4672 B14R1.17 CC#CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000763181 [0,1,0,0,0,1|1,0,1]=4 4673 B14R1.17 CC#CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000763181 [0,1,0,0,0,1|1,0,1]=4 4674 B14R1.17 CC#CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000763181 [0,1,0,0,0,1|1,0,1]=4 4675 B14R1.17 CC=CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000210699 [0,1,0,0,0,1|1,0,1]=4 4676 B14R1.17 CC=CC(=O)Nc1cccc(c1O)C 11a_100000756359_100000210699 [0,1,0,0,0,1|1,0,1]=4 4677 B14R1.17 CC=CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000210699 [0,1,0,0,0,1|1,0,1]=4 4678 B14R1.17 CC=CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000210699 [0,1,0,0,0,1|1,0,1]=4 4679 B14R1.17 CC=CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000210699 [0,1,0,0,0,1|1,0,1]=4 4680 B14R1.17 CC=CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000210699 [0,1,0,0,0,1|1,0,1]=4 4681 B14R1.17 CC=CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000210699 [0,1,0,0,0,1|1,0,1]=4 4682 B14R1.17 CC=CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000210699 [0,1,0,0,0,1|1,0,1]=4 4683 B14R1.17 CC=CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000210699 [0,1,0,0,0,1|1,0,1]=4 4684 B14R1.17 CCCC(=O)Cc1cccc(c1Br)C 1458a_100000211992_200012349612 [0,1,0,0,0,1|2,0,0]=4 4685 B14R1.17 CCCC(=O)Cc1cccc(c1Br)C 1458a_100010147021_100000210303 [0,1,0,0,0,1|2,0,0]=4 4686 B14R1.17 CCCC(=O)Cc1cccc(c1Br)Cl 1458a_100000211992_100010145525 [0,1,0,0,0,1|2,0,0]=4 4687 B14R1.17 CCCC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_100000210303 [0,1,0,0,0,1|2,0,0]=4 4688 B14R1.17 CCCC(=O)Cc1cccc(c1Br)F 1458a_100000211992_100012351116 [0,1,0,0,0,1|2,0,0]=4 4689 B14R1.17 CCCC(=O)Cc1cccc(c1Br)F 1458a_100012356664_100000210303 [0,1,0,0,0,1|2,0,0]=4 4690 B14R1.17 CCCC(=O)Cc1cccc(c1Br)I 1458a_100000211992_100010254545 [0,1,0,0,0,1|2,0,0]=4 4691 B14R1.17 CCCC(=O)Cc1cccc(c1C)Br 1458a_100000211992_100000694682 [0,1,0,0,0,1|2,0,0]=4 4692 B14R1.17 CCCC(=O)Cc1cccc(c1C)C 1458a_100000211992_100011515928 [0,1,0,0,0,1|2,0,0]=4 4693 B14R1.17 CCCC(=O)Cc1cccc(c1C)C 1458a_100011698479_100000210303 [0,1,0,0,0,1|2,0,0]=4 4694 B14R1.17 CCCC(=O)Cc1cccc(c1C)Cl 1458a_100000211992_100012186920 [0,1,0,0,0,1|2,0,0]=4 4695 B14R1.17 CCCC(=O)Cc1cccc(c1C)F 1458a_100000035905_100000210303 [0,1,0,0,0,1|2,0,0]=4 4696 B14R1.17 CCCC(=O)Cc1cccc(c1C)F 1458a_100000211992_100009813626 [0,1,0,0,0,1|2,0,0]=4 4697 B14R1.17 CCCC(=O)Cc1cccc(c1C)I 1458a_100000211992_100010150147 [0,1,0,0,0,1|2,0,0]=4 4698 B14R1.17 CCCC(=O)Cc1cccc(c1Cl)Br 1458a_100000211992_100012349491 [0,1,0,0,0,1|2,0,0]=4 4699 B14R1.17 CCCC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_100000210303 [0,1,0,0,0,1|2,0,0]=4 4700 B14R1.17 CCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000211992_100000720918 [0,1,0,0,0,1|2,0,0]=4 4701 B14R1.17 CCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_100000210303 [0,1,0,0,0,1|2,0,0]=4 4702 B14R1.17 CCCC(=O)Cc1cccc(c1Cl)F 1458a_100000211992_100000696688 [0,1,0,0,0,1|2,0,0]=4 4703 B14R1.17 CCCC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_100000210303 [0,1,0,0,0,1|2,0,0]=4 4704 B14R1.17 CCCC(=O)Cc1cccc(c1F)Br 1458a_100000211992_100012356507 [0,1,0,0,0,1|2,0,0]=4 4705 B14R1.17 CCCC(=O)Cc1cccc(c1F)Br 1458a_100011935088_100000210303 [0,1,0,0,0,1|2,0,0]=4 4706 B14R1.17 CCCC(=O)Cc1cccc(c1F)C 1458a_100000211992_100011216058 [0,1,0,0,0,1|2,0,0]=4 4707 B14R1.17 CCCC(=O)Cc1cccc(c1F)Cl 1458a_100000211992_100000716733 [0,1,0,0,0,1|2,0,0]=4 4708 B14R1.17 CCCC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_100000210303 [0,1,0,0,0,1|2,0,0]=4 4709 B14R1.17 CCCC(=O)Cc1cccc(c1F)F 1458a_100000211992_100000217499 [0,1,0,0,0,1|2,0,0]=4 4710 B14R1.17 CCCC(=O)Cc1cccc(c1F)F 1458a_100000684727_100000210303 [0,1,0,0,0,1|2,0,0]=4 4711 B14R1.17 CCCC(=O)Cc1cccc(c1I)F 1458a_100000211992_100010149603 [0,1,0,0,0,1|2,0,0]=4 4712 B14R1.17 CCCC(=O)Nc1cccc(c1Br)C 11a_100000684715_100000211992 [0,1,0,0,0,1|2,0,0]=4 4713 B14R1.17 CCCC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100000211992 [0,1,0,0,0,1|2,0,0]=4 4714 B14R1.17 CCCC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000211992 [0,1,0,0,0,1|2,0,0]=4 4715 B14R1.17 CCCC(=O)Nc1cccc(c1Br)Cl 11a_100000687072_100000211992 [0,1,0,0,0,1|2,0,0]=4 4716 B14R1.17 CCCC(=O)Nc1cccc(c1Br)Cl 1626a_100000687072_100000211992 [0,1,0,0,0,1|2,0,0]=4 4717 B14R1.17 CCCC(=O)Nc1cccc(c1Br)F 11a_100011934729_100000211992 [0,1,0,0,0,1|2,0,0]=4 4718 B14R1.17 CCCC(=O)Nc1cccc(c1Br)F 1626a_100011934729_100000211992 [0,1,0,0,0,1|2,0,0]=4 4719 B14R1.17 CCCC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000211992 [0,1,0,0,0,1|2,0,0]=4 4720 B14R1.17 CCCC(=O)Nc1cccc(c1C)Br 11a_100000750434_100000211992 [0,1,0,0,0,1|2,0,0]=4 4721 B14R1.17 CCCC(=O)Nc1cccc(c1C)Br 1626a_100000750434_100000211992 [0,1,0,0,0,1|2,0,0]=4 4722 B14R1.17 CCCC(=O)Nc1cccc(c1C)Br 22a_100000750434_100000211992 [0,1,0,0,0,1|2,0,0]=4 4723 B14R1.17 CCCC(=O)Nc1cccc(c1C)Br 527a_100000750434_100000211992 [0,1,0,0,0,1|2,0,0]=4 4724 B14R1.17 CCCC(=O)Nc1cccc(c1C)C 11a_100000210026_100000211992 [0,1,0,0,0,1|2,0,0]=4 4725 B14R1.17 CCCC(=O)Nc1cccc(c1C)C 1626a_100000210026_100000211992 [0,1,0,0,0,1|2,0,0]=4 4726 B14R1.17 CCCC(=O)Nc1cccc(c1C)C 22a_100000210026_100000211992 [0,1,0,0,0,1|2,0,0]=4 4727 B14R1.17 CCCC(=O)Nc1cccc(c1C)C 527a_100000210026_100000211992 [0,1,0,0,0,1|2,0,0]=4 4728 B14R1.17 CCCC(=O)Nc1cccc(c1C)Cl 11a_100000210441_100000211992 [0,1,0,0,0,1|2,0,0]=4 4729 B14R1.17 CCCC(=O)Nc1cccc(c1C)Cl 1626a_100000210441_100000211992 [0,1,0,0,0,1|2,0,0]=4 4730 B14R1.17 CCCC(=O)Nc1cccc(c1C)Cl 22a_100000210441_100000211992 [0,1,0,0,0,1|2,0,0]=4 4731 B14R1.17 CCCC(=O)Nc1cccc(c1C)Cl 527a_100000210441_100000211992 [0,1,0,0,0,1|2,0,0]=4 4732 B14R1.17 CCCC(=O)Nc1cccc(c1C)F 11a_100000745574_100000211992 [0,1,0,0,0,1|2,0,0]=4 4733 B14R1.17 CCCC(=O)Nc1cccc(c1C)F 1626a_100000745574_100000211992 [0,1,0,0,0,1|2,0,0]=4 4734 B14R1.17 CCCC(=O)Nc1cccc(c1C)F 22a_100000745574_100000211992 [0,1,0,0,0,1|2,0,0]=4 4735 B14R1.17 CCCC(=O)Nc1cccc(c1C)F 527a_100000745574_100000211992 [0,1,0,0,0,1|2,0,0]=4 4736 B14R1.17 CCCC(=O)Nc1cccc(c1C)I 11a_100000761887_100000211992 [0,1,0,0,0,1|2,0,0]=4 4737 B14R1.17 CCCC(=O)Nc1cccc(c1C)I 1626a_100000761887_100000211992 [0,1,0,0,0,1|2,0,0]=4 4738 B14R1.17 CCCC(=O)Nc1cccc(c1C)I 22a_100000761887_100000211992 [0,1,0,0,0,1|2,0,0]=4 4739 B14R1.17 CCCC(=O)Nc1cccc(c1C)I 527a_100000761887_100000211992 [0,1,0,0,0,1|2,0,0]=4 4740 B14R1.17 CCCC(=O)Nc1cccc(c1C)O 11a_100011216573_100000211992 [0,1,0,0,0,1|2,0,0]=4 4741 B14R1.17 CCCC(=O)Nc1cccc(c1C)O 22a_100011216573_100000211992 [0,1,0,0,0,1|2,0,0]=4 4742 B14R1.17 CCCC(=O)Nc1cccc(c1C)O 527a_100011216573_100000211992 [0,1,0,0,0,1|2,0,0]=4 4743 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)Br 11a_100000687075_100000211992 [0,1,0,0,0,1|2,0,0]=4 4744 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)Br 1626a_100000687075_100000211992 [0,1,0,0,0,1|2,0,0]=4 4745 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100000211992 [0,1,0,0,0,1|2,0,0]=4 4746 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100000211992 [0,1,0,0,0,1|2,0,0]=4 4747 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100000211992 [0,1,0,0,0,1|2,0,0]=4 4748 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000211992 [0,1,0,0,0,1|2,0,0]=4 4749 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)Cl 11a_100000185733_100000211992 [0,1,0,0,0,1|2,0,0]=4 4750 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)Cl 1626a_100000185733_100000211992 [0,1,0,0,0,1|2,0,0]=4 4751 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)F 11a_100000692321_100000211992 [0,1,0,0,0,1|2,0,0]=4 4752 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)F 1626a_100000692321_100000211992 [0,1,0,0,0,1|2,0,0]=4 4753 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100000211992 [0,1,0,0,0,1|2,0,0]=4 4754 B14R1.17 CCCC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000211992 [0,1,0,0,0,1|2,0,0]=4 4755 B14R1.17 CCCC(=O)Nc1cccc(c1F)Br 11a_100011935091_100000211992 [0,1,0,0,0,1|2,0,0]=4 4756 B14R1.17 CCCC(=O)Nc1cccc(c1F)Br 1626a_100011935091_100000211992 [0,1,0,0,0,1|2,0,0]=4 4757 B14R1.17 CCCC(=O)Nc1cccc(c1F)Br 22a_100011935091_100000211992 [0,1,0,0,0,1|2,0,0]=4 4758 B14R1.17 CCCC(=O)Nc1cccc(c1F)Br 527a_100011935091_100000211992 [0,1,0,0,0,1|2,0,0]=4 4759 B14R1.17 CCCC(=O)Nc1cccc(c1F)C 11a_100000697159_100000211992 [0,1,0,0,0,1|2,0,0]=4 4760 B14R1.17 CCCC(=O)Nc1cccc(c1F)C 1626a_100000697159_100000211992 [0,1,0,0,0,1|2,0,0]=4 4761 B14R1.17 CCCC(=O)Nc1cccc(c1F)C 527a_100000697159_100000211992 [0,1,0,0,0,1|2,0,0]=4 4762 B14R1.17 CCCC(=O)Nc1cccc(c1F)Cl 11a_100000199060_100000211992 [0,1,0,0,0,1|2,0,0]=4 4763 B14R1.17 CCCC(=O)Nc1cccc(c1F)Cl 1626a_100000199060_100000211992 [0,1,0,0,0,1|2,0,0]=4 4764 B14R1.17 CCCC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100000211992 [0,1,0,0,0,1|2,0,0]=4 4765 B14R1.17 CCCC(=O)Nc1cccc(c1F)F 11a_100000743855_100000211992 [0,1,0,0,0,1|2,0,0]=4 4766 B14R1.17 CCCC(=O)Nc1cccc(c1F)F 1626a_100000743855_100000211992 [0,1,0,0,0,1|2,0,0]=4 4767 B14R1.17 CCCC(=O)Nc1cccc(c1F)F 22a_100000743855_100000211992 [0,1,0,0,0,1|2,0,0]=4 4768 B14R1.17 CCCC(=O)Nc1cccc(c1I)Br 11a_100020590159_100000211992 [0,1,0,0,0,1|2,0,0]=4 4769 B14R1.17 CCCC(=O)Nc1cccc(c1I)Br 1626a_100020590159_100000211992 [0,1,0,0,0,1|2,0,0]=4 4770 B14R1.17 CCCC(=O)Nc1cccc(c1I)C 11a_100000761888_100000211992 [0,1,0,0,0,1|2,0,0]=4 4771 B14R1.17 CCCC(=O)Nc1cccc(c1I)C 1626a_100000761888_100000211992 [0,1,0,0,0,1|2,0,0]=4 4772 B14R1.17 CCCC(=O)Nc1cccc(c1I)Cl 11a_100000049713_100000211992 [0,1,0,0,0,1|2,0,0]=4 4773 B14R1.17 CCCC(=O)Nc1cccc(c1I)Cl 1626a_100000049713_100000211992 [0,1,0,0,0,1|2,0,0]=4 4774 B14R1.17 CCCC(=O)Nc1cccc(c1I)F 11a_100000690935_100000211992 [0,1,0,0,0,1|2,0,0]=4 4775 B14R1.17 CCCC(=O)Nc1cccc(c1I)F 1626a_100000690935_100000211992 [0,1,0,0,0,1|2,0,0]=4 4776 B14R1.17 CCCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000211992 [0,1,0,0,0,1|1,0,0]=3 4777 B14R1.17 CCCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000211992 [0,1,0,0,0,1|1,0,0]=3 4778 B14R1.17 CCCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000211992 [0,1,0,0,0,1|1,0,0]=3 4779 B14R1.17 CCCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000211992 [0,1,0,0,0,1|1,0,0]=3 4780 B14R1.17 CCCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000211992 [0,1,0,0,0,1|1,0,0]=3 4781 B14R1.17 CCCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000211992 [0,1,0,0,0,1|1,0,0]=3 4782 B14R1.17 CCCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000211992 [0,1,0,0,0,1|1,0,0]=3 4783 B14R1.17 CCCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000211992 [0,1,0,0,0,1|1,0,0]=3 4784 B14R1.17 CCCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000211992 [0,1,0,0,0,1|1,0,0]=3 4785 B14R1.17 CCCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000211992 [0,1,0,0,0,1|1,0,0]=3 4786 B14R1.17 CCCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000211992 [0,1,0,0,0,1|1,0,0]=3 4787 B14R1.17 CCCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000211992 [0,1,0,0,0,1|1,0,0]=3 4788 B14R1.17 CCCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000211992 [0,1,0,0,0,1|1,0,0]=3 4789 B14R1.17 CCCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000211992 [0,1,0,0,0,1|1,0,0]=3 4790 B14R1.17 CCNC(=O)Cc1cccc(c1Br)C 11a_100015525214_100010147021 [0,1,0,0,0,1|2,0,0]=4 4791 B14R1.17 CCNC(=O)Cc1cccc(c1Br)C 240690a_100015525214_100010147021 [0,1,0,0,0,1|2,0,0]=4 4792 B14R1.17 CCNC(=O)Cc1cccc(c1Br)C 527a_100015525214_100010147021 [0,1,0,0,0,1|2,0,0]=4 4793 B14R1.17 CCNC(=O)Cc1cccc(c1Br)Cl 11a_100015525214_100010145769 [0,1,0,0,0,1|2,0,0]=4 4794 B14R1.17 CCNC(=O)Cc1cccc(c1Br)Cl 240690a_100015525214_100010145769 [0,1,0,0,0,1|2,0,0]=4 4795 B14R1.17 CCNC(=O)Cc1cccc(c1Br)Cl 527a_100015525214_100010145769 [0,1,0,0,0,1|2,0,0]=4 4796 B14R1.17 CCNC(=O)Cc1cccc(c1Br)F 11a_100015525214_100012356664 [0,1,0,0,0,1|2,0,0]=4 4797 B14R1.17 CCNC(=O)Cc1cccc(c1Br)F 240690a_100015525214_100012356664 [0,1,0,0,0,1|2,0,0]=4 4798 B14R1.17 CCNC(=O)Cc1cccc(c1Br)F 527a_100015525214_100012356664 [0,1,0,0,0,1|2,0,0]=4 4799 B14R1.17 CCNC(=O)Cc1cccc(c1C)C 11a_100015525214_100011698479 [0,1,0,0,0,1|2,0,0]=4 4800 B14R1.17 CCNC(=O)Cc1cccc(c1C)C 240690a_100015525214_100011698479 [0,1,0,0,0,1|2,0,0]=4 4801 B14R1.17 CCNC(=O)Cc1cccc(c1C)C 527a_100015525214_100011698479 [0,1,0,0,0,1|2,0,0]=4 4802 B14R1.17 CCNC(=O)Cc1cccc(c1C)F 11a_100015525214_100000035905 [0,1,0,0,0,1|2,0,0]=4 4803 B14R1.17 CCNC(=O)Cc1cccc(c1C)F 240690a_100015525214_100000035905 [0,1,0,0,0,1|2,0,0]=4 4804 B14R1.17 CCNC(=O)Cc1cccc(c1C)F 527a_100015525214_100000035905 [0,1,0,0,0,1|2,0,0]=4 4805 B14R1.17 CCNC(=O)Cc1cccc(c1Cl)Br 11a_100015525214_100010145770 [0,1,0,0,0,1|2,0,0]=4 4806 B14R1.17 CCNC(=O)Cc1cccc(c1Cl)Br 240690a_100015525214_100010145770 [0,1,0,0,0,1|2,0,0]=4 4807 B14R1.17 CCNC(=O)Cc1cccc(c1Cl)Br 527a_100015525214_100010145770 [0,1,0,0,0,1|2,0,0]=4 4808 B14R1.17 CCNC(=O)Cc1cccc(c1Cl)Cl 11a_100015525214_100000759314 [0,1,0,0,0,1|2,0,0]=4 4809 B14R1.17 CCNC(=O)Cc1cccc(c1Cl)Cl 240690a_100015525214_100000759314 [0,1,0,0,0,1|2,0,0]=4 4810 B14R1.17 CCNC(=O)Cc1cccc(c1Cl)Cl 527a_100015525214_100000759314 [0,1,0,0,0,1|2,0,0]=4 4811 B14R1.17 CCNC(=O)Cc1cccc(c1Cl)F 11a_100015525214_100012001123 [0,1,0,0,0,1|2,0,0]=4 4812 B14R1.17 CCNC(=O)Cc1cccc(c1Cl)F 240690a_100015525214_100012001123 [0,1,0,0,0,1|2,0,0]=4 4813 B14R1.17 CCNC(=O)Cc1cccc(c1Cl)F 527a_100015525214_100012001123 [0,1,0,0,0,1|2,0,0]=4 4814 B14R1.17 CCNC(=O)Cc1cccc(c1F)Br 11a_100015525214_100011935088 [0,1,0,0,0,1|2,0,0]=4 4815 B14R1.17 CCNC(=O)Cc1cccc(c1F)Br 240690a_100015525214_100011935088 [0,1,0,0,0,1|2,0,0]=4 4816 B14R1.17 CCNC(=O)Cc1cccc(c1F)Br 527a_100015525214_100011935088 [0,1,0,0,0,1|2,0,0]=4 4817 B14R1.17 CCNC(=O)Cc1cccc(c1F)Cl 11a_100015525214_100000709823 [0,1,0,0,0,1|2,0,0]=4 4818 B14R1.17 CCNC(=O)Cc1cccc(c1F)Cl 240690a_100015525214_100000709823 [0,1,0,0,0,1|2,0,0]=4 4819 B14R1.17 CCNC(=O)Cc1cccc(c1F)Cl 527a_100015525214_100000709823 [0,1,0,0,0,1|2,0,0]=4 4820 B14R1.17 CCNC(=O)Cc1cccc(c1F)F 11a_100015525214_100000684727 [0,1,0,0,0,1|2,0,0]=4 4821 B14R1.17 CCNC(=O)Cc1cccc(c1F)F 240690a_100015525214_100000684727 [0,1,0,0,0,1|2,0,0]=4 4822 B14R1.17 CCNC(=O)Cc1cccc(c1F)F 527a_100015525214_100000684727 [0,1,0,0,0,1|2,0,0]=4 4823 B14R1.17 CCNC(=O)Nc1cccc(c1Br)C 2430a_100000684715_100015525214 [0,1,0,0,0,1|2,0,0]=4 4824 B14R1.17 CCNC(=O)Nc1cccc(c1Br)Cl 2430a_100000687072_100015525214 [0,1,0,0,0,1|2,0,0]=4 4825 B14R1.17 CCNC(=O)Nc1cccc(c1Br)F 2430a_100011934729_100015525214 [0,1,0,0,0,1|2,0,0]=4 4826 B14R1.17 CCNC(=O)Nc1cccc(c1Br)O 2430a_100012183704_100015525214 [0,1,0,0,0,1|2,0,0]=4 4827 B14R1.17 CCNC(=O)Nc1cccc(c1C)Br 2430a_100000750434_100015525214 [0,1,0,0,0,1|2,0,0]=4 4828 B14R1.17 CCNC(=O)Nc1cccc(c1C)C 2430a_100000210026_100015525214 [0,1,0,0,0,1|2,0,0]=4 4829 B14R1.17 CCNC(=O)Nc1cccc(c1C)Cl 2430a_100000210441_100015525214 [0,1,0,0,0,1|2,0,0]=4 4830 B14R1.17 CCNC(=O)Nc1cccc(c1C)F 2430a_100000745574_100015525214 [0,1,0,0,0,1|2,0,0]=4 4831 B14R1.17 CCNC(=O)Nc1cccc(c1C)I 2430a_100000761887_100015525214 [0,1,0,0,0,1|2,0,0]=4 4832 B14R1.17 CCNC(=O)Nc1cccc(c1C)O 2430a_100011216573_100015525214 [0,1,0,0,0,1|2,0,0]=4 4833 B14R1.17 CCNC(=O)Nc1cccc(c1Cl)Br 2430a_100000687075_100015525214 [0,1,0,0,0,1|2,0,0]=4 4834 B14R1.17 CCNC(=O)Nc1cccc(c1Cl)C 2430a_100000765562_100015525214 [0,1,0,0,0,1|2,0,0]=4 4835 B14R1.17 CCNC(=O)Nc1cccc(c1Cl)Cl 2430a_100000185733_100015525214 [0,1,0,0,0,1|2,0,0]=4 4836 B14R1.17 CCNC(=O)Nc1cccc(c1Cl)F 2430a_100000692321_100015525214 [0,1,0,0,0,1|2,0,0]=4 4837 B14R1.17 CCNC(=O)Nc1cccc(c1Cl)O 2430a_100012002038_100015525214 [0,1,0,0,0,1|2,0,0]=4 4838 B14R1.17 CCNC(=O)Nc1cccc(c1F)Br 2430a_100011935091_100015525214 [0,1,0,0,0,1|2,0,0]=4 4839 B14R1.17 CCNC(=O)Nc1cccc(c1F)Br 512a_100011935091_100015525214 [0,1,0,0,0,1|2,0,0]=4 4840 B14R1.17 CCNC(=O)Nc1cccc(c1F)C 2430a_100000697159_100015525214 [0,1,0,0,0,1|2,0,0]=4 4841 B14R1.17 CCNC(=O)Nc1cccc(c1F)C 512a_100000697159_100015525214 [0,1,0,0,0,1|2,0,0]=4 4842 B14R1.17 CCNC(=O)Nc1cccc(c1F)Cl 2430a_100000199060_100015525214 [0,1,0,0,0,1|2,0,0]=4 4843 B14R1.17 CCNC(=O)Nc1cccc(c1F)F 2430a_100000743855_100015525214 [0,1,0,0,0,1|2,0,0]=4 4844 B14R1.17 CCNC(=O)Nc1cccc(c1F)F 512a_100000743855_100015525214 [0,1,0,0,0,1|2,0,0]=4 4845 B14R1.17 CCNC(=O)Nc1cccc(c1I)Br 2430a_100020590159_100015525214 [0,1,0,0,0,1|2,0,0]=4 4846 B14R1.17 CCNC(=O)Nc1cccc(c1I)Br 512a_100020590159_100015525214 [0,1,0,0,0,1|2,0,0]=4 4847 B14R1.17 CCNC(=O)Nc1cccc(c1I)C 2430a_100000761888_100015525214 [0,1,0,0,0,1|2,0,0]=4 4848 B14R1.17 CCNC(=O)Nc1cccc(c1I)Cl 2430a_100000049713_100015525214 [0,1,0,0,0,1|2,0,0]=4 4849 B14R1.17 CCNC(=O)Nc1cccc(c1I)F 512a_100000690935_100015525214 [0,1,0,0,0,1|2,0,0]=4 4850 B14R1.17 CCNC(=O)Nc1cccc(c1O)Br 2430a_100011934915_100015525214 [0,1,0,0,0,1|1,0,0]=3 4851 B14R1.17 CCNC(=O)Nc1cccc(c1O)C 2430a_100000756359_100015525214 [0,1,0,0,0,1|1,0,0]=3 4852 B14R1.17 CCNC(=O)Nc1cccc(c1O)Cl 2430a_100000754742_100015525214 [0,1,0,0,0,1|1,0,0]=3 4853 B14R1.17 CCNC(=O)Nc1cccc(c1O)F 2430a_100011934987_100015525214 [0,1,0,0,0,1|1,0,0]=3 4854 B14R1.17 CCNC(=O)Nc1cccc(c1O)I 2430a_100010084371_100015525214 [0,1,0,0,0,1|1,0,0]=3 4855 B14R1.17 CCOC(=O)Cc1cccc(c1C)O 271570a_203496583355_100000718334 [0,1,0,0,0,1|1,0,0]=3 4856 B14R1.17 COCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000210968 [0,1,0,0,0,1|2,0,0]=4 4857 B14R1.17 COCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000210968 [0,1,0,0,0,1|2,0,0]=4 4858 B14R1.17 COCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000210968 [0,1,0,0,0,1|2,0,0]=4 4859 B14R1.17 COCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000210968 [0,1,0,0,0,1|2,0,0]=4 4860 B14R1.17 COCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000210968 [0,1,0,0,0,1|2,0,0]=4 4861 B14R1.17 COCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000210968 [0,1,0,0,0,1|2,0,0]=4 4862 B14R1.17 COCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000210968 [0,1,0,0,0,1|2,0,0]=4 4863 B14R1.17 COCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000210968 [0,1,0,0,0,1|2,0,0]=4 4864 B14R1.17 COCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000210968 [0,1,0,0,0,1|2,0,0]=4 4865 B14R1.17 COCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000210968 [0,1,0,0,0,1|2,0,0]=4 4866 B14R1.17 COCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000210968 [0,1,0,0,0,1|2,0,0]=4 4867 B14R1.17 COCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000210968 [0,1,0,0,0,1|2,0,0]=4 4868 B14R1.17 COCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000210968 [0,1,0,0,0,1|2,0,0]=4 4869 B14R1.17 COCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000210968 [0,1,0,0,0,1|2,0,0]=4 4870 B14R1.17 CSCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000184570 [0,1,0,0,0,1|2,0,0]=4 4871 B14R1.17 CSCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000184570 [0,1,0,0,0,1|2,0,0]=4 4872 B14R1.17 CSCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000184570 [0,1,0,0,0,1|2,0,0]=4 4873 B14R1.17 CSCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000184570 [0,1,0,0,0,1|2,0,0]=4 4874 B14R1.17 CSCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000184570 [0,1,0,0,0,1|2,0,0]=4 4875 B14R1.17 CSCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000184570 [0,1,0,0,0,1|2,0,0]=4 4876 B14R1.17 CSCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000184570 [0,1,0,0,0,1|2,0,0]=4 4877 B14R1.17 CSCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000184570 [0,1,0,0,0,1|2,0,0]=4 4878 B14R1.17 CSCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000184570 [0,1,0,0,0,1|2,0,0]=4 4879 B14R1.17 CSCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000184570 [0,1,0,0,0,1|2,0,0]=4 4880 B14R1.17 CSCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000184570 [0,1,0,0,0,1|2,0,0]=4 4881 B14R1.17 CSCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000184570 [0,1,0,0,0,1|2,0,0]=4 4882 B14R1.17 CSCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000184570 [0,1,0,0,0,1|2,0,0]=4 4883 B14R1.17 CSCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000184570 [0,1,0,0,0,1|2,0,0]=4 4884 B14R1.17 Cc1cccc(c1O)NC(=O)CCO 22a_100000756359_100011216618 [0,1,0,0,0,1|2,0,0]=4 4885 B14R1.17 O=C(CCO)Nc1cccc(c1O)Br 22a_100011934915_100011216618 [0,1,0,0,0,1|2,0,0]=4 4886 B14R1.17 O=C(CCO)Nc1cccc(c1O)Cl 22a_100000754742_100011216618 [0,1,0,0,0,1|2,0,0]=4 4887 B14R1.17 O=C(CCO)Nc1cccc(c1O)F 22a_100011934987_100011216618 [0,1,0,0,0,1|2,0,0]=4 4888 B14R1.17 O=C(CCO)Nc1cccc(c1O)I 22a_100010084371_100011216618 [0,1,0,0,0,1|2,0,0]=4 4889 B14R1.337 C=C(C)CC(=O)Cc1ccccc1O 1458a_100000743006_100000748629 [0,1,0,0,0,1|1,0,1]=4 4890 B14R1.337 CC(=CC(=O)Nc1ccccc1O)C 22a_100000185747_100000211388 [0,1,0,0,0,1|1,0,1]=4 4891 B14R1.337 CC(=CC(=O)Nc1ccccc1O)Cl 22a_100000185747_200042562850 [0,1,0,0,0,1|1,0,1]=4 4892 B14R1.337 CC(=O)CC(=O)Nc1ccccc1O 1458a_100000070787_100000014494 [0,1,0,0,0,1|1,0,1]=4 4893 B14R1.337 CC(=O)CC(=O)Nc1ccccc1O 271570a_203496583355_200000187717 [0,1,0,0,0,1|1,0,1]=4 4894 B14R1.337 CC(C)CC(=O)Cc1ccccc1Br 1458a_100000210554_100000184730 [0,1,0,0,0,1|2,0,0]=4 4895 B14R1.337 CC(C)CC(=O)Cc1ccccc1Br 1458a_100000751119_100000210624 [0,1,0,0,0,1|2,0,0]=4 4896 B14R1.337 CC(C)CC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210624 [0,1,0,0,0,1|2,0,0]=4 4897 B14R1.337 CC(C)CC(=O)Cc1ccccc1Cl 1458a_100000210554_100000187162 [0,1,0,0,0,1|2,0,0]=4 4898 B14R1.337 CC(C)CC(=O)Cc1ccccc1F 1458a_100000210554_100000187165 [0,1,0,0,0,1|2,0,0]=4 4899 B14R1.337 CC(C)CC(=O)Cc1ccccc1F 1458a_100000212012_100000210624 [0,1,0,0,0,1|2,0,0]=4 4900 B14R1.337 CC(C)CC(=O)Cc1ccccc1I 1458a_100000036491_100000210624 [0,1,0,0,0,1|2,0,0]=4 4901 B14R1.337 CC(C)CC(=O)Cc1ccccc1I 1458a_100000210554_100011216222 [0,1,0,0,0,1|2,0,0]=4 4902 B14R1.337 CC(C)CC(=O)Cc1ccccc1O 1458a_100000743006_100000210624 [0,1,0,0,0,1|1,0,0]=3 4903 B14R1.337 CC(C)CC(=O)Cc1ncccc1O 1458a_100000210554_200020655725 [0,1,0,0,0,1|2,0,0]=4 4904 B14R1.337 CC(C)CC(=O)Nc1ccccc1Br 11a_100000210017_100000210554 [0,1,0,0,0,1|2,0,0]=4 4905 B14R1.337 CC(C)CC(=O)Nc1ccccc1Br 1626a_100000210017_100000210554 [0,1,0,0,0,1|2,0,0]=4 4906 B14R1.337 CC(C)CC(=O)Nc1ccccc1Cl 11a_100000185783_100000210554 [0,1,0,0,0,1|2,0,0]=4 4907 B14R1.337 CC(C)CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210554 [0,1,0,0,0,1|2,0,0]=4 4908 B14R1.337 CC(C)CC(=O)Nc1ccccc1Cl 22a_100000185783_100000210554 [0,1,0,0,0,1|2,0,0]=4 4909 B14R1.337 CC(C)CC(=O)Nc1ccccc1Cl 527a_100000185783_100000210554 [0,1,0,0,0,1|2,0,0]=4 4910 B14R1.337 CC(C)CC(=O)Nc1ccccc1F 11a_100000210422_100000210554 [0,1,0,0,0,1|2,0,0]=4 4911 B14R1.337 CC(C)CC(=O)Nc1ccccc1F 1626a_100000210422_100000210554 [0,1,0,0,0,1|2,0,0]=4 4912 B14R1.337 CC(C)CC(=O)Nc1ccccc1F 22a_100000210422_100000210554 [0,1,0,0,0,1|2,0,0]=4 4913 B14R1.337 CC(C)CC(=O)Nc1ccccc1F 527a_100000210422_100000210554 [0,1,0,0,0,1|2,0,0]=4 4914 B14R1.337 CC(C)CC(=O)Nc1ccccc1I 11a_100000210053_100000210554 [0,1,0,0,0,1|2,0,0]=4 4915 B14R1.337 CC(C)CC(=O)Nc1ccccc1I 1626a_100000210053_100000210554 [0,1,0,0,0,1|2,0,0]=4 4916 B14R1.337 CC(C)CC(=O)Nc1ccccc1O 22a_100000185747_100000210554 [0,1,0,0,0,1|1,0,0]=3 4917 B14R1.337 CC(C)CC(=O)Nc1ccccc1O 527a_100000185747_100000210554 [0,1,0,0,0,1|1,0,0]=3 4918 B14R1.337 CC(C)NC(=O)Cc1ccccc1Br 11a_100138425928_100000751119 [0,1,0,0,0,1|2,0,0]=4 4919 B14R1.337 CC(C)NC(=O)Cc1ccccc1Br 240690a_100138425928_100000751119 [0,1,0,0,0,1|2,0,0]=4 4920 B14R1.337 CC(C)NC(=O)Cc1ccccc1Br 527a_100138425928_100000751119 [0,1,0,0,0,1|2,0,0]=4 4921 B14R1.337 CC(C)NC(=O)Cc1ccccc1Cl 11a_100138425928_100000183793 [0,1,0,0,0,1|2,0,0]=4 4922 B14R1.337 CC(C)NC(=O)Cc1ccccc1Cl 1626a_100138425928_100000183793 [0,1,0,0,0,1|2,0,0]=4 4923 B14R1.337 CC(C)NC(=O)Cc1ccccc1Cl 240690a_100138425928_100000183793 [0,1,0,0,0,1|2,0,0]=4 4924 B14R1.337 CC(C)NC(=O)Cc1ccccc1Cl 527a_100138425928_100000183793 [0,1,0,0,0,1|2,0,0]=4 4925 B14R1.337 CC(C)NC(=O)Cc1ccccc1F 11a_100138425928_100000212012 [0,1,0,0,0,1|2,0,0]=4 4926 B14R1.337 CC(C)NC(=O)Cc1ccccc1F 1626a_100138425928_100000212012 [0,1,0,0,0,1|2,0,0]=4 4927 B14R1.337 CC(C)NC(=O)Cc1ccccc1F 240690a_100138425928_100000212012 [0,1,0,0,0,1|2,0,0]=4 4928 B14R1.337 CC(C)NC(=O)Cc1ccccc1F 527a_100138425928_100000212012 [0,1,0,0,0,1|2,0,0]=4 4929 B14R1.337 CC(C)NC(=O)Cc1ccccc1I 11a_100138425928_100000036491 [0,1,0,0,0,1|2,0,0]=4 4930 B14R1.337 CC(C)NC(=O)Cc1ccccc1I 1626a_100138425928_100000036491 [0,1,0,0,0,1|2,0,0]=4 4931 B14R1.337 CC(C)NC(=O)Cc1ccccc1I 240690a_100138425928_100000036491 [0,1,0,0,0,1|2,0,0]=4 4932 B14R1.337 CC(C)NC(=O)Cc1ccccc1I 527a_100138425928_100000036491 [0,1,0,0,0,1|2,0,0]=4 4933 B14R1.337 CC(C)NC(=O)Cc1ccccc1O 240690a_100138425928_100000743006 [0,1,0,0,0,1|1,0,0]=3 4934 B14R1.337 CC(C)NC(=O)Cc1ccccc1O 527a_100138425928_100000743006 [0,1,0,0,0,1|1,0,0]=3 4935 B14R1.337 CC(C)NC(=O)Nc1ccccc1Br 2430a_100000210017_100138425928 [0,1,0,0,0,1|2,0,0]=4 4936 B14R1.337 CC(C)NC(=O)Nc1ccccc1Cl 2430a_100000185783_100138425928 [0,1,0,0,0,1|2,0,0]=4 4937 B14R1.337 CC(C)NC(=O)Nc1ccccc1F 2430a_100000210422_100138425928 [0,1,0,0,0,1|2,0,0]=4 4938 B14R1.337 CC(C)NC(=O)Nc1ccccc1I 2430a_100000210053_100138425928 [0,1,0,0,0,1|2,0,0]=4 4939 B14R1.337 CC(C)NC(=O)Nc1ccccc1O 2430a_100000185747_100138425928 [0,1,0,0,0,1|1,0,0]=3 4940 B14R1.337 CC(O)CC(=O)Cc1ccccc1Br 1458a_100000751119_100011218427 [0,1,0,0,0,1|2,0,0]=4 4941 B14R1.337 CC(O)CC(=O)Cc1ccccc1Cl 1458a_100000183793_100011218427 [0,1,0,0,0,1|2,0,0]=4 4942 B14R1.337 CC(O)CC(=O)Cc1ccccc1F 1458a_100000212012_100011218427 [0,1,0,0,0,1|2,0,0]=4 4943 B14R1.337 CC(O)CC(=O)Cc1ccccc1I 1458a_100000036491_100011218427 [0,1,0,0,0,1|2,0,0]=4 4944 B14R1.337 CC(O)CC(=O)Cc1ccccc1O 1458a_100000743006_100011218427 [0,1,0,0,0,1|1,0,0]=3 4945 B14R1.337 CN(C)CC(=O)Nc1ccccc1O 22a_100000185747_100000750896 [0,1,0,0,0,1|2,0,0]=4 4946 B14R1.337 CN(C)CC(=O)Nc1ccccc1O 269982a_100102631434_100000014494 [0,1,0,0,0,1|2,0,0]=4 4947 B14R1.337 CN(C)CC(=O)Nc1ccccc1O 527a_100000185747_100000750896 [0,1,0,0,0,1|2,0,0]=4 4948 B14R1.337 C[C@@H](O)CC(=O)Cc1ccccc1Br 1458a_100011933948_100000184730 [0,1,0,0,0,1|2,0,0]=4 4949 B14R1.337 C[C@@H](O)CC(=O)Cc1ccccc1Cl 1458a_100011933948_100000187162 [0,1,0,0,0,1|2,0,0]=4 4950 B14R1.337 C[C@@H](O)CC(=O)Cc1ccccc1F 1458a_100011933948_100000187165 [0,1,0,0,0,1|2,0,0]=4 4951 B14R1.337 C[C@@H](O)CC(=O)Cc1ccccc1I 1458a_100011933948_100011216222 [0,1,0,0,0,1|2,0,0]=4 4952 B14R1.337 C[C@@H](O)CC(=O)Cc1ncccc1O 1458a_100011933948_200020655725 [0,1,0,0,0,1|2,0,0]=4 4953 B14R1.337 C[C@@H](O)CC(=O)Nc1ccccc1Cl 22a_100000185783_100011933948 [0,1,0,0,0,1|2,0,0]=4 4954 B14R1.337 C[C@@H](O)CC(=O)Nc1ccccc1F 22a_100000210422_100011933948 [0,1,0,0,0,1|2,0,0]=4 4955 B14R1.337 C[C@@H](O)CC(=O)Nc1ccccc1O 22a_100000185747_100011933948 [0,1,0,0,0,1|1,0,0]=3 4956 B14R1.337 C[S+](C)CC(=O)Nc1ccccc1O 22a_100000185747_200159257847 [0,1,0,0,0,1|2,0,0]=4 4957 B14R1.337 C[S+](C)CC(=O)Nc1ccccc1O 527a_100000185747_200159257847 [0,1,0,0,0,1|2,0,0]=4 4958 B14R1.337 Cc1ccccc1CC(=O)CC(C)C 1458a_100000210554_100000211839 [0,1,0,0,0,1|2,0,0]=4 4959 B14R1.337 Cc1ccccc1CC(=O)CC(C)C 1458a_100000212180_100000210624 [0,1,0,0,0,1|2,0,0]=4 4960 B14R1.337 Cc1ccccc1CC(=O)CC(C)O 1458a_100000212180_100011218427 [0,1,0,0,0,1|2,0,0]=4 4961 B14R1.337 Cc1ccccc1CC(=O)C[C@@H](C)O 1458a_100011933948_100000211839 [0,1,0,0,0,1|2,0,0]=4 4962 B14R1.337 Cc1ccccc1CC(=O)NC(C)C 11a_100138425928_100000212180 [0,1,0,0,0,1|2,0,0]=4 4963 B14R1.337 Cc1ccccc1CC(=O)NC(C)C 1626a_100138425928_100000212180 [0,1,0,0,0,1|2,0,0]=4 4964 B14R1.337 Cc1ccccc1CC(=O)NC(C)C 240690a_100138425928_100000212180 [0,1,0,0,0,1|2,0,0]=4 4965 B14R1.337 Cc1ccccc1CC(=O)NC(C)C 527a_100138425928_100000212180 [0,1,0,0,0,1|2,0,0]=4 4966 B14R1.337 Cc1ccccc1NC(=O)CC(C)C 11a_100015192222_100000210554 [0,1,0,0,0,1|2,0,0]=4 4967 B14R1.337 Cc1ccccc1NC(=O)CC(C)C 1626a_100015192222_100000210554 [0,1,0,0,0,1|2,0,0]=4 4968 B14R1.337 Cc1ccccc1NC(=O)CC(C)C 22a_100015192222_100000210554 [0,1,0,0,0,1|2,0,0]=4 4969 B14R1.337 Cc1ccccc1NC(=O)CC(C)C 527a_100015192222_100000210554 [0,1,0,0,0,1|2,0,0]=4 4970 B14R1.337 Cc1ccccc1NC(=O)C[C@@H](C)O 22a_100015192222_100011933948 [0,1,0,0,0,1|2,0,0]=4 4971 B14R1.337 Cc1ccccc1NC(=O)NC(C)C 2430a_100015192222_100138425928 [0,1,0,0,0,1|2,0,0]=4 4972 B14R1.337 O=C(Cc1ccccc1O)CC(F)F 1458a_100000743006_100011934356 [0,1,0,0,0,1|2,0,0]=4 4973 B14R1.946 C#CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000753159 [0,1,0,0,0,1|1,0,1]=4 4974 B14R1.946 C#CCCC(=O)Nc1ccccc1O 22a_100000185747_100000692101 [0,1,0,0,0,1|1,0,1]=4 4975 B14R1.946 C#CCCC(=O)Nc1ccccc1O 527a_100000185747_100000692101 [0,1,0,0,0,1|1,0,1]=4 4976 B14R1.946 C#CCNC(=O)Cc1ccccc1O 240690a_100000212058_100000743006 [0,1,0,0,0,1|1,0,1]=4 4977 B14R1.946 C#CCNC(=O)Cc1ccccc1O 527a_100000212058_100000743006 [0,1,0,0,0,1|1,0,1]=4 4978 B14R1.946 C#CCNC(=O)Nc1ccccc1O 2430a_100000185747_100000212058 [0,1,0,0,0,1|1,0,1]=4 4979 B14R1.946 C/C=C/CC(=O)Cc1ccccc1O 1458a_100000743006_100102629194 [0,1,0,0,0,1|1,0,1]=4 4980 B14R1.946 C=CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000754431 [0,1,0,0,0,1|1,0,1]=4 4981 B14R1.946 C=CCCC(=O)Nc1ccccc1O 22a_100000185747_100000749702 [0,1,0,0,0,1|1,0,1]=4 4982 B14R1.946 C=CCCC(=O)Nc1ccccc1O 527a_100000185747_100000749702 [0,1,0,0,0,1|1,0,1]=4 4983 B14R1.946 C=CCNC(=O)Cc1ccccc1O 240690a_100020586998_100000743006 [0,1,0,0,0,1|1,0,1]=4 4984 B14R1.946 C=CCNC(=O)Cc1ccccc1O 527a_100020586998_100000743006 [0,1,0,0,0,1|1,0,1]=4 4985 B14R1.946 C=CCNC(=O)Nc1ccccc1O 2430a_100000185747_100020586998 [0,1,0,0,0,1|1,0,1]=4 4986 B14R1.946 CC#CCC(=O)Cc1ccccc1O 1458a_100000743006_100000748600 [0,1,0,0,0,1|1,0,1]=4 4987 B14R1.946 CC=CCC(=O)Cc1ccccc1O 1458a_100000743006_100000070051 [0,1,0,0,0,1|1,0,1]=4 4988 B14R1.946 CC=CCC(=O)Nc1ccccc1O 22a_100000185747_100121576822 [0,1,0,0,0,1|1,0,1]=4 4989 B14R1.946 CC=CCC(=O)Nc1ccccc1O 527a_100000185747_100121576822 [0,1,0,0,0,1|1,0,1]=4 4990 B14R1.946 CCC#CC(=O)Cc1ccccc1Br 1458a_100011827653_100000184730 [0,1,0,0,0,1|2,0,0]=4 4991 B14R1.946 CCC#CC(=O)Cc1ccccc1C 1458a_100011827653_100000211839 [0,1,0,0,0,1|2,0,0]=4 4992 B14R1.946 CCC#CC(=O)Cc1ccccc1Cl 1458a_100011827653_100000187162 [0,1,0,0,0,1|2,0,0]=4 4993 B14R1.946 CCC#CC(=O)Cc1ccccc1F 1458a_100011827653_100000187165 [0,1,0,0,0,1|2,0,0]=4 4994 B14R1.946 CCC#CC(=O)Cc1ccccc1I 1458a_100011827653_100011216222 [0,1,0,0,0,1|2,0,0]=4 4995 B14R1.946 CCC#CC(=O)Cc1ncccc1O 1458a_100011827653_200020655725 [0,1,0,0,0,1|2,0,0]=4 4996 B14R1.946 CCC#CC(=O)Nc1ccccc1C 22a_100015192222_100011827653 [0,1,0,0,0,1|2,0,0]=4 4997 B14R1.946 CCC#CC(=O)Nc1ccccc1Cl 22a_100000185783_100011827653 [0,1,0,0,0,1|2,0,0]=4 4998 B14R1.946 CCC#CC(=O)Nc1ccccc1F 22a_100000210422_100011827653 [0,1,0,0,0,1|2,0,0]=4 4999 B14R1.946 CCC#CC(=O)Nc1ccccc1O 22a_100000185747_100011827653 [0,1,0,0,0,1|1,0,0]=3 5000 B14R1.946 CCC=CC(=O)Cc1ccccc1Br 1458a_100000212282_100000184730 [0,1,0,0,0,1|2,0,0]=4 5001 B14R1.946 CCC=CC(=O)Cc1ccccc1C 1458a_100000212282_100000211839 [0,1,0,0,0,1|2,0,0]=4 5002 B14R1.946 CCC=CC(=O)Cc1ccccc1Cl 1458a_100000212282_100000187162 [0,1,0,0,0,1|2,0,0]=4 5003 B14R1.946 CCC=CC(=O)Cc1ccccc1F 1458a_100000212282_100000187165 [0,1,0,0,0,1|2,0,0]=4 5004 B14R1.946 CCC=CC(=O)Cc1ccccc1I 1458a_100000212282_100011216222 [0,1,0,0,0,1|2,0,0]=4 5005 B14R1.946 CCC=CC(=O)Cc1ncccc1O 1458a_100000212282_200020655725 [0,1,0,0,0,1|2,0,0]=4 5006 B14R1.946 CCC=CC(=O)Nc1ccccc1Br 11a_100000210017_100000212282 [0,1,0,0,0,1|2,0,0]=4 5007 B14R1.946 CCC=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000212282 [0,1,0,0,0,1|2,0,0]=4 5008 B14R1.946 CCC=CC(=O)Nc1ccccc1C 11a_100015192222_100000212282 [0,1,0,0,0,1|2,0,0]=4 5009 B14R1.946 CCC=CC(=O)Nc1ccccc1C 1626a_100015192222_100000212282 [0,1,0,0,0,1|2,0,0]=4 5010 B14R1.946 CCC=CC(=O)Nc1ccccc1C 22a_100015192222_100000212282 [0,1,0,0,0,1|2,0,0]=4 5011 B14R1.946 CCC=CC(=O)Nc1ccccc1Cl 11a_100000185783_100000212282 [0,1,0,0,0,1|2,0,0]=4 5012 B14R1.946 CCC=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000212282 [0,1,0,0,0,1|2,0,0]=4 5013 B14R1.946 CCC=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000212282 [0,1,0,0,0,1|2,0,0]=4 5014 B14R1.946 CCC=CC(=O)Nc1ccccc1F 11a_100000210422_100000212282 [0,1,0,0,0,1|2,0,0]=4 5015 B14R1.946 CCC=CC(=O)Nc1ccccc1F 1626a_100000210422_100000212282 [0,1,0,0,0,1|2,0,0]=4 5016 B14R1.946 CCC=CC(=O)Nc1ccccc1F 22a_100000210422_100000212282 [0,1,0,0,0,1|2,0,0]=4 5017 B14R1.946 CCC=CC(=O)Nc1ccccc1I 11a_100000210053_100000212282 [0,1,0,0,0,1|2,0,0]=4 5018 B14R1.946 CCC=CC(=O)Nc1ccccc1I 1626a_100000210053_100000212282 [0,1,0,0,0,1|2,0,0]=4 5019 B14R1.946 CCC=CC(=O)Nc1ccccc1O 22a_100000185747_100000212282 [0,1,0,0,0,1|1,0,0]=3 5020 B14R1.946 CCCCC(=Cc1ccccc1O)Br 271570a_206741709834_100000739446 [0,1,0,0,0,1|2,0,0]=4 5021 B14R1.946 CCCCC(=O)Cc1ccccc1Br 1458a_100000210183_100000184730 [0,1,0,0,0,1|2,0,0]=4 5022 B14R1.946 CCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210211 [0,1,0,0,0,1|2,0,0]=4 5023 B14R1.946 CCCCC(=O)Cc1ccccc1C 1458a_100000210183_100000211839 [0,1,0,0,0,1|2,0,0]=4 5024 B14R1.946 CCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210211 [0,1,0,0,0,1|2,0,0]=4 5025 B14R1.946 CCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210211 [0,1,0,0,0,1|2,0,0]=4 5026 B14R1.946 CCCCC(=O)Cc1ccccc1Cl 1458a_100000210183_100000187162 [0,1,0,0,0,1|2,0,0]=4 5027 B14R1.946 CCCCC(=O)Cc1ccccc1F 1458a_100000210183_100000187165 [0,1,0,0,0,1|2,0,0]=4 5028 B14R1.946 CCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210211 [0,1,0,0,0,1|2,0,0]=4 5029 B14R1.946 CCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210211 [0,1,0,0,0,1|2,0,0]=4 5030 B14R1.946 CCCCC(=O)Cc1ccccc1I 1458a_100000210183_100011216222 [0,1,0,0,0,1|2,0,0]=4 5031 B14R1.946 CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210211 [0,1,0,0,0,1|1,0,0]=3 5032 B14R1.946 CCCCC(=O)Cc1ncccc1O 1458a_100000210183_200020655725 [0,1,0,0,0,1|2,0,0]=4 5033 B14R1.946 CCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000210183 [0,1,0,0,0,1|2,0,0]=4 5034 B14R1.946 CCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000210183 [0,1,0,0,0,1|2,0,0]=4 5035 B14R1.946 CCCCC(=O)Nc1ccccc1C 11a_100015192222_100000210183 [0,1,0,0,0,1|2,0,0]=4 5036 B14R1.946 CCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000210183 [0,1,0,0,0,1|2,0,0]=4 5037 B14R1.946 CCCCC(=O)Nc1ccccc1C 22a_100015192222_100000210183 [0,1,0,0,0,1|2,0,0]=4 5038 B14R1.946 CCCCC(=O)Nc1ccccc1C 527a_100015192222_100000210183 [0,1,0,0,0,1|2,0,0]=4 5039 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000210183 [0,1,0,0,0,1|2,0,0]=4 5040 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210183 [0,1,0,0,0,1|2,0,0]=4 5041 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000210183 [0,1,0,0,0,1|2,0,0]=4 5042 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000210183 [0,1,0,0,0,1|2,0,0]=4 5043 B14R1.946 CCCCC(=O)Nc1ccccc1F 11a_100000210422_100000210183 [0,1,0,0,0,1|2,0,0]=4 5044 B14R1.946 CCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000210183 [0,1,0,0,0,1|2,0,0]=4 5045 B14R1.946 CCCCC(=O)Nc1ccccc1F 22a_100000210422_100000210183 [0,1,0,0,0,1|2,0,0]=4 5046 B14R1.946 CCCCC(=O)Nc1ccccc1F 527a_100000210422_100000210183 [0,1,0,0,0,1|2,0,0]=4 5047 B14R1.946 CCCCC(=O)Nc1ccccc1I 11a_100000210053_100000210183 [0,1,0,0,0,1|2,0,0]=4 5048 B14R1.946 CCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000210183 [0,1,0,0,0,1|2,0,0]=4 5049 B14R1.946 CCCCC(=O)Nc1ccccc1O 22a_100000185747_100000210183 [0,1,0,0,0,1|1,0,0]=3 5050 B14R1.946 CCCCC(=O)Nc1ccccc1O 527a_100000185747_100000210183 [0,1,0,0,0,1|1,0,0]=3 5051 B14R1.946 CCCNC(=O)Cc1ccccc1Br 11a_100020643023_100000751119 [0,1,0,0,0,1|2,0,0]=4 5052 B14R1.946 CCCNC(=O)Cc1ccccc1Br 240690a_100020643023_100000751119 [0,1,0,0,0,1|2,0,0]=4 5053 B14R1.946 CCCNC(=O)Cc1ccccc1Br 527a_100020643023_100000751119 [0,1,0,0,0,1|2,0,0]=4 5054 B14R1.946 CCCNC(=O)Cc1ccccc1C 11a_100020643023_100000212180 [0,1,0,0,0,1|2,0,0]=4 5055 B14R1.946 CCCNC(=O)Cc1ccccc1C 1626a_100020643023_100000212180 [0,1,0,0,0,1|2,0,0]=4 5056 B14R1.946 CCCNC(=O)Cc1ccccc1C 240690a_100020643023_100000212180 [0,1,0,0,0,1|2,0,0]=4 5057 B14R1.946 CCCNC(=O)Cc1ccccc1C 527a_100020643023_100000212180 [0,1,0,0,0,1|2,0,0]=4 5058 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 11a_100020643023_100000183793 [0,1,0,0,0,1|2,0,0]=4 5059 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 1626a_100020643023_100000183793 [0,1,0,0,0,1|2,0,0]=4 5060 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 240690a_100020643023_100000183793 [0,1,0,0,0,1|2,0,0]=4 5061 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 527a_100020643023_100000183793 [0,1,0,0,0,1|2,0,0]=4 5062 B14R1.946 CCCNC(=O)Cc1ccccc1F 11a_100020643023_100000212012 [0,1,0,0,0,1|2,0,0]=4 5063 B14R1.946 CCCNC(=O)Cc1ccccc1F 1626a_100020643023_100000212012 [0,1,0,0,0,1|2,0,0]=4 5064 B14R1.946 CCCNC(=O)Cc1ccccc1F 240690a_100020643023_100000212012 [0,1,0,0,0,1|2,0,0]=4 5065 B14R1.946 CCCNC(=O)Cc1ccccc1F 527a_100020643023_100000212012 [0,1,0,0,0,1|2,0,0]=4 5066 B14R1.946 CCCNC(=O)Cc1ccccc1I 11a_100020643023_100000036491 [0,1,0,0,0,1|2,0,0]=4 5067 B14R1.946 CCCNC(=O)Cc1ccccc1I 1626a_100020643023_100000036491 [0,1,0,0,0,1|2,0,0]=4 5068 B14R1.946 CCCNC(=O)Cc1ccccc1I 240690a_100020643023_100000036491 [0,1,0,0,0,1|2,0,0]=4 5069 B14R1.946 CCCNC(=O)Cc1ccccc1I 527a_100020643023_100000036491 [0,1,0,0,0,1|2,0,0]=4 5070 B14R1.946 CCCNC(=O)Cc1ccccc1O 240690a_100020643023_100000743006 [0,1,0,0,0,1|1,0,0]=3 5071 B14R1.946 CCCNC(=O)Cc1ccccc1O 527a_100020643023_100000743006 [0,1,0,0,0,1|1,0,0]=3 5072 B14R1.946 CCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100020643023 [0,1,0,0,0,1|2,0,0]=4 5073 B14R1.946 CCCNC(=O)Nc1ccccc1C 2430a_100015192222_100020643023 [0,1,0,0,0,1|2,0,0]=4 5074 B14R1.946 CCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100020643023 [0,1,0,0,0,1|2,0,0]=4 5075 B14R1.946 CCCNC(=O)Nc1ccccc1F 2430a_100000210422_100020643023 [0,1,0,0,0,1|2,0,0]=4 5076 B14R1.946 CCCNC(=O)Nc1ccccc1I 2430a_100000210053_100020643023 [0,1,0,0,0,1|2,0,0]=4 5077 B14R1.946 CCCNC(=O)Nc1ccccc1O 2430a_100000185747_100020643023 [0,1,0,0,0,1|1,0,0]=3 5078 B14R1.946 CCNCC(=O)Cc1ccccc1Br 2230a_100015525214_100000700504 [0,1,0,0,0,1|2,0,0]=4 5079 B14R1.946 CCNCC(=O)Cc1ccccc1C 2230a_100015525214_100011223134 [0,1,0,0,0,1|2,0,0]=4 5080 B14R1.946 CCNCC(=O)Nc1ccccc1Br 2230a_100000683505_100000210202 [0,1,0,0,0,1|2,0,0]=4 5081 B14R1.946 CCNCC(=O)Nc1ccccc1Br 2230a_100015525214_100000182372 [0,1,0,0,0,1|2,0,0]=4 5082 B14R1.946 CCNCC(=O)Nc1ccccc1C 2230a_100015186652_100000210202 [0,1,0,0,0,1|2,0,0]=4 5083 B14R1.946 CCNCC(=O)Nc1ccccc1C 2230a_100015525214_100000183529 [0,1,0,0,0,1|2,0,0]=4 5084 B14R1.946 CCNCC(=O)Nc1ccccc1Cl 2230a_100015525214_100000182448 [0,1,0,0,0,1|2,0,0]=4 5085 B14R1.946 CCNCC(=O)Nc1ccccc1F 2230a_100015525214_100000182988 [0,1,0,0,0,1|2,0,0]=4 5086 B14R1.946 CCNCC(=O)Nc1ccccc1I 2230a_100015525214_100000180142 [0,1,0,0,0,1|2,0,0]=4 5087 B14R1.946 CCNNC(=O)Cc1ccccc1Br 22a_100000756455_100000751119 [0,1,0,0,0,1|2,0,0]=4 5088 B14R1.946 CCNNC(=O)Cc1ccccc1C 22a_100000756455_100000212180 [0,1,0,0,0,1|2,0,0]=4 5089 B14R1.946 CCNNC(=O)Cc1ccccc1Cl 22a_100000756455_100000183793 [0,1,0,0,0,1|2,0,0]=4 5090 B14R1.946 CCNNC(=O)Cc1ccccc1F 22a_100000756455_100000212012 [0,1,0,0,0,1|2,0,0]=4 5091 B14R1.946 CCNNC(=O)Cc1ccccc1I 22a_100000756455_100000036491 [0,1,0,0,0,1|2,0,0]=4 5092 B14R1.946 CCNNC(=O)Cc1ccccc1O 22a_100000756455_100000743006 [0,1,0,0,0,1|1,0,0]=3 5093 B14R1.946 CCOCC(=O)Cc1ccccc1Br 1458a_100000211967_100000184730 [0,1,0,0,0,1|1,0,0]=3 5094 B14R1.946 CCOCC(=O)Cc1ccccc1Br 34a_100121572206_100000700504 [0,1,0,0,0,1|1,0,0]=3 5095 B14R1.946 CCOCC(=O)Cc1ccccc1C 1458a_100000211967_100000211839 [0,1,0,0,0,1|1,0,0]=3 5096 B14R1.946 CCOCC(=O)Cc1ccccc1Cl 1458a_100000211967_100000187162 [0,1,0,0,0,1|1,0,0]=3 5097 B14R1.946 CCOCC(=O)Cc1ccccc1F 1458a_100000211967_100000187165 [0,1,0,0,0,1|1,0,0]=3 5098 B14R1.946 CCOCC(=O)Cc1ccccc1I 1458a_100000211967_100011216222 [0,1,0,0,0,1|1,0,0]=3 5099 B14R1.946 CCOCC(=O)Cc1cccnc1Br 1458a_100000211967_100010140945 [0,1,0,0,0,1|2,0,0]=4 5100 B14R1.946 CCOCC(=O)Cc1cccnc1C 1458a_100000211967_100000732876 [0,1,0,0,0,1|2,0,0]=4 5101 B14R1.946 CCOCC(=O)Cc1cccnc1Cl 1458a_100000211967_100000045678 [0,1,0,0,0,1|2,0,0]=4 5102 B14R1.946 CCOCC(=O)Cc1cccnc1F 1458a_100000211967_100000099810 [0,1,0,0,0,1|2,0,0]=4 5103 B14R1.946 CCOCC(=O)Cc1ccncc1C 1458a_100000211967_100020672808 [0,1,0,0,0,1|2,0,0]=4 5104 B14R1.946 CCOCC(=O)Cc1ccncc1Cl 1458a_100000211967_100000763264 [0,1,0,0,0,1|2,0,0]=4 5105 B14R1.946 CCOCC(=O)Cc1cnccc1C 1458a_100000211967_100000690890 [0,1,0,0,0,1|2,0,0]=4 5106 B14R1.946 CCOCC(=O)Cc1ncccc1Br 1458a_100000211967_100025702911 [0,1,0,0,0,1|2,0,0]=4 5107 B14R1.946 CCOCC(=O)Cc1ncccc1C 1458a_100000211967_100000696600 [0,1,0,0,0,1|2,0,0]=4 5108 B14R1.946 CCOCC(=O)Cc1ncccc1Cl 1458a_100000211967_100000099807 [0,1,0,0,0,1|2,0,0]=4 5109 B14R1.946 CCOCC(=O)Cc1ncccc1F 1458a_100000211967_100000104219 [0,1,0,0,0,1|2,0,0]=4 5110 B14R1.946 CCOCC(=O)Cc1ncccc1O 1458a_100000211967_200020655725 [0,1,0,0,0,1|1,0,0]=3 5111 B14R1.946 CCOCC(=O)Nc1ccccc1Br 11a_100000210017_100000211967 [0,1,0,0,0,1|1,0,0]=3 5112 B14R1.946 CCOCC(=O)Nc1ccccc1Br 1626a_100000210017_100000211967 [0,1,0,0,0,1|1,0,0]=3 5113 B14R1.946 CCOCC(=O)Nc1ccccc1C 11a_100015192222_100000211967 [0,1,0,0,0,1|1,0,0]=3 5114 B14R1.946 CCOCC(=O)Nc1ccccc1C 1626a_100015192222_100000211967 [0,1,0,0,0,1|1,0,0]=3 5115 B14R1.946 CCOCC(=O)Nc1ccccc1C 22a_100015192222_100000211967 [0,1,0,0,0,1|1,0,0]=3 5116 B14R1.946 CCOCC(=O)Nc1ccccc1C 34a_100121572206_100000183529 [0,1,0,0,0,1|1,0,0]=3 5117 B14R1.946 CCOCC(=O)Nc1ccccc1C 527a_100015192222_100000211967 [0,1,0,0,0,1|1,0,0]=3 5118 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 11a_100000185783_100000211967 [0,1,0,0,0,1|1,0,0]=3 5119 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000211967 [0,1,0,0,0,1|1,0,0]=3 5120 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 22a_100000185783_100000211967 [0,1,0,0,0,1|1,0,0]=3 5121 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 34a_100121572206_100000182448 [0,1,0,0,0,1|1,0,0]=3 5122 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 527a_100000185783_100000211967 [0,1,0,0,0,1|1,0,0]=3 5123 B14R1.946 CCOCC(=O)Nc1ccccc1F 11a_100000210422_100000211967 [0,1,0,0,0,1|1,0,0]=3 5124 B14R1.946 CCOCC(=O)Nc1ccccc1F 1626a_100000210422_100000211967 [0,1,0,0,0,1|1,0,0]=3 5125 B14R1.946 CCOCC(=O)Nc1ccccc1F 22a_100000210422_100000211967 [0,1,0,0,0,1|1,0,0]=3 5126 B14R1.946 CCOCC(=O)Nc1ccccc1F 34a_100121572206_100000243840 [0,1,0,0,0,1|1,0,0]=3 5127 B14R1.946 CCOCC(=O)Nc1ccccc1F 527a_100000210422_100000211967 [0,1,0,0,0,1|1,0,0]=3 5128 B14R1.946 CCOCC(=O)Nc1ccccc1I 11a_100000210053_100000211967 [0,1,0,0,0,1|1,0,0]=3 5129 B14R1.946 CCOCC(=O)Nc1ccccc1I 1626a_100000210053_100000211967 [0,1,0,0,0,1|1,0,0]=3 5130 B14R1.946 CCOCC(=O)Nc1ccccc1I 34a_100121572206_100000180142 [0,1,0,0,0,1|1,0,0]=3 5131 B14R1.946 CCOCC(=O)Nc1ccccc1O 22a_100000185747_100000211967 [0,1,0,0,0,1|0,0,0]=2 5132 B14R1.946 CCOCC(=O)Nc1ccccc1O 527a_100000185747_100000211967 [0,1,0,0,0,1|0,0,0]=2 5133 B14R1.946 CCOCN(C)Cc1ccccc1O 269982a_100015189988_100000739092 [0,1,0,0,0,1|2,0,0]=4 5134 B14R1.946 CCSCC(=O)Cc1ccccc1Br 1458a_100000230394_100000184730 [0,1,0,0,0,1|1,1,0]=4 5135 B14R1.946 CCSCC(=O)Cc1ccccc1Br 62a_100000210202_100000700504 [0,1,0,0,0,1|1,1,0]=4 5136 B14R1.946 CCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000210202 [0,1,0,0,0,1|1,1,0]=4 5137 B14R1.946 CCSCC(=O)Cc1ccccc1C 1458a_100000230394_100000211839 [0,1,0,0,0,1|1,1,0]=4 5138 B14R1.946 CCSCC(=O)Cc1ccccc1C 62a_100000210202_100011223134 [0,1,0,0,0,1|1,1,0]=4 5139 B14R1.946 CCSCC(=O)Cc1ccccc1C 62a_100011223134_100000210202 [0,1,0,0,0,1|1,1,0]=4 5140 B14R1.946 CCSCC(=O)Cc1ccccc1Cl 1458a_100000230394_100000187162 [0,1,0,0,0,1|1,1,0]=4 5141 B14R1.946 CCSCC(=O)Cc1ccccc1F 1458a_100000230394_100000187165 [0,1,0,0,0,1|1,1,0]=4 5142 B14R1.946 CCSCC(=O)Cc1ccccc1I 1458a_100000230394_100011216222 [0,1,0,0,0,1|1,1,0]=4 5143 B14R1.946 CCSCC(=O)Cc1ncccc1O 1458a_100000230394_200020655725 [0,1,0,0,0,1|1,1,0]=4 5144 B14R1.946 CCSCC(=O)Nc1ccccc1Br 11a_100000210017_100000230394 [0,1,0,0,0,1|1,1,0]=4 5145 B14R1.946 CCSCC(=O)Nc1ccccc1Br 1626a_100000210017_100000230394 [0,1,0,0,0,1|1,1,0]=4 5146 B14R1.946 CCSCC(=O)Nc1ccccc1Br 62a_100000182372_100000210202 [0,1,0,0,0,1|1,1,0]=4 5147 B14R1.946 CCSCC(=O)Nc1ccccc1Br 62a_100000210202_100000182372 [0,1,0,0,0,1|1,1,0]=4 5148 B14R1.946 CCSCC(=O)Nc1ccccc1C 11a_100015192222_100000230394 [0,1,0,0,0,1|1,1,0]=4 5149 B14R1.946 CCSCC(=O)Nc1ccccc1C 1626a_100015192222_100000230394 [0,1,0,0,0,1|1,1,0]=4 5150 B14R1.946 CCSCC(=O)Nc1ccccc1C 22a_100015192222_100000230394 [0,1,0,0,0,1|1,1,0]=4 5151 B14R1.946 CCSCC(=O)Nc1ccccc1C 527a_100015192222_100000230394 [0,1,0,0,0,1|1,1,0]=4 5152 B14R1.946 CCSCC(=O)Nc1ccccc1C 62a_100000210202_100000183529 [0,1,0,0,0,1|1,1,0]=4 5153 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000230394 [0,1,0,0,0,1|1,1,0]=4 5154 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000230394 [0,1,0,0,0,1|1,1,0]=4 5155 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000230394 [0,1,0,0,0,1|1,1,0]=4 5156 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000230394 [0,1,0,0,0,1|1,1,0]=4 5157 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 62a_100000210202_100000182448 [0,1,0,0,0,1|1,1,0]=4 5158 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 62a_200011202291_100000210202 [0,1,0,0,0,1|1,1,0]=4 5159 B14R1.946 CCSCC(=O)Nc1ccccc1F 11a_100000210422_100000230394 [0,1,0,0,0,1|1,1,0]=4 5160 B14R1.946 CCSCC(=O)Nc1ccccc1F 1626a_100000210422_100000230394 [0,1,0,0,0,1|1,1,0]=4 5161 B14R1.946 CCSCC(=O)Nc1ccccc1F 22a_100000210422_100000230394 [0,1,0,0,0,1|1,1,0]=4 5162 B14R1.946 CCSCC(=O)Nc1ccccc1F 527a_100000210422_100000230394 [0,1,0,0,0,1|1,1,0]=4 5163 B14R1.946 CCSCC(=O)Nc1ccccc1F 62a_100000182988_100000210202 [0,1,0,0,0,1|1,1,0]=4 5164 B14R1.946 CCSCC(=O)Nc1ccccc1F 62a_100000210202_100000182988 [0,1,0,0,0,1|1,1,0]=4 5165 B14R1.946 CCSCC(=O)Nc1ccccc1I 11a_100000210053_100000230394 [0,1,0,0,0,1|1,1,0]=4 5166 B14R1.946 CCSCC(=O)Nc1ccccc1I 1626a_100000210053_100000230394 [0,1,0,0,0,1|1,1,0]=4 5167 B14R1.946 CCSCC(=O)Nc1ccccc1I 62a_100000180142_100000210202 [0,1,0,0,0,1|1,1,0]=4 5168 B14R1.946 CCSCC(=O)Nc1ccccc1I 62a_100000210202_100000180142 [0,1,0,0,0,1|1,1,0]=4 5169 B14R1.946 CCSCC(=O)Nc1ccccc1O 22a_100000185747_100000230394 [0,1,0,0,0,1|0,1,0]=3 5170 B14R1.946 CCSCC(=O)Nc1ccccc1O 527a_100000185747_100000230394 [0,1,0,0,0,1|0,1,0]=3 5171 B14R1.946 CCSCC(=O)Nc1ccccc1O 62a_100000210202_100000014494 [0,1,0,0,0,1|0,1,0]=3 5172 B14R1.946 CNCCC(=O)Nc1ccccc1Br 2230a_106832991635_100000181489 [0,1,0,0,0,1|2,0,0]=4 5173 B14R1.946 CNCCC(=O)Nc1ccccc1Br 7a_106832991635_100000181489 [0,1,0,0,0,1|2,0,0]=4 5174 B14R1.946 CNCCC(=O)Nc1ccccc1C 2230a_106832991635_200011206476 [0,1,0,0,0,1|2,0,0]=4 5175 B14R1.946 CNCCC(=O)Nc1ccccc1C 2230a_200015185780_200000210301 [0,1,0,0,0,1|2,0,0]=4 5176 B14R1.946 CNCCC(=O)Nc1ccccc1C 34a_200015185780_200000210301 [0,1,0,0,0,1|2,0,0]=4 5177 B14R1.946 CNCCC(=O)Nc1ccccc1C 7a_106832991635_200011206476 [0,1,0,0,0,1|2,0,0]=4 5178 B14R1.946 CNCCC(=O)Nc1ccccc1Cl 2230a_106832991635_100000242055 [0,1,0,0,0,1|2,0,0]=4 5179 B14R1.946 CNCCC(=O)Nc1ccccc1Cl 7a_106832991635_100000242055 [0,1,0,0,0,1|2,0,0]=4 5180 B14R1.946 CNCCC(=O)Nc1ccccc1F 2230a_100015185137_200000210301 [0,1,0,0,0,1|2,0,0]=4 5181 B14R1.946 CNCCC(=O)Nc1ccccc1F 2230a_106832991635_100000242066 [0,1,0,0,0,1|2,0,0]=4 5182 B14R1.946 CNCCC(=O)Nc1ccccc1F 34a_100015185137_200000210301 [0,1,0,0,0,1|2,0,0]=4 5183 B14R1.946 CNCCC(=O)Nc1ccccc1F 7a_106832991635_100000242066 [0,1,0,0,0,1|2,0,0]=4 5184 B14R1.946 COC=CC(=O)Nc1ccccc1O 22a_100000185747_100016268678 [0,1,0,0,0,1|1,0,1]=4 5185 B14R1.946 COCCC(=O)Cc1ccccc1Br 1458a_100000749529_100000184730 [0,1,0,0,0,1|2,0,0]=4 5186 B14R1.946 COCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000233755 [0,1,0,0,0,1|2,0,0]=4 5187 B14R1.946 COCCC(=O)Cc1ccccc1C 1458a_100000212180_100000233755 [0,1,0,0,0,1|2,0,0]=4 5188 B14R1.946 COCCC(=O)Cc1ccccc1C 1458a_100000749529_100000211839 [0,1,0,0,0,1|2,0,0]=4 5189 B14R1.946 COCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000233755 [0,1,0,0,0,1|2,0,0]=4 5190 B14R1.946 COCCC(=O)Cc1ccccc1Cl 1458a_100000749529_100000187162 [0,1,0,0,0,1|2,0,0]=4 5191 B14R1.946 COCCC(=O)Cc1ccccc1F 1458a_100000212012_100000233755 [0,1,0,0,0,1|2,0,0]=4 5192 B14R1.946 COCCC(=O)Cc1ccccc1F 1458a_100000749529_100000187165 [0,1,0,0,0,1|2,0,0]=4 5193 B14R1.946 COCCC(=O)Cc1ccccc1I 1458a_100000036491_100000233755 [0,1,0,0,0,1|2,0,0]=4 5194 B14R1.946 COCCC(=O)Cc1ccccc1I 1458a_100000749529_100011216222 [0,1,0,0,0,1|2,0,0]=4 5195 B14R1.946 COCCC(=O)Cc1ccccc1O 1458a_100000743006_100000233755 [0,1,0,0,0,1|1,0,0]=3 5196 B14R1.946 COCCC(=O)Cc1ncccc1O 1458a_100000749529_200020655725 [0,1,0,0,0,1|2,0,0]=4 5197 B14R1.946 COCCC(=O)Nc1ccccc1Br 11a_100000210017_100000749529 [0,1,0,0,0,1|2,0,0]=4 5198 B14R1.946 COCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000749529 [0,1,0,0,0,1|2,0,0]=4 5199 B14R1.946 COCCC(=O)Nc1ccccc1C 11a_100015192222_100000749529 [0,1,0,0,0,1|2,0,0]=4 5200 B14R1.946 COCCC(=O)Nc1ccccc1C 1626a_100015192222_100000749529 [0,1,0,0,0,1|2,0,0]=4 5201 B14R1.946 COCCC(=O)Nc1ccccc1C 22a_100015192222_100000749529 [0,1,0,0,0,1|2,0,0]=4 5202 B14R1.946 COCCC(=O)Nc1ccccc1C 527a_100015192222_100000749529 [0,1,0,0,0,1|2,0,0]=4 5203 B14R1.946 COCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000749529 [0,1,0,0,0,1|2,0,0]=4 5204 B14R1.946 COCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000749529 [0,1,0,0,0,1|2,0,0]=4 5205 B14R1.946 COCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000749529 [0,1,0,0,0,1|2,0,0]=4 5206 B14R1.946 COCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000749529 [0,1,0,0,0,1|2,0,0]=4 5207 B14R1.946 COCCC(=O)Nc1ccccc1F 11a_100000210422_100000749529 [0,1,0,0,0,1|2,0,0]=4 5208 B14R1.946 COCCC(=O)Nc1ccccc1F 1626a_100000210422_100000749529 [0,1,0,0,0,1|2,0,0]=4 5209 B14R1.946 COCCC(=O)Nc1ccccc1F 22a_100000210422_100000749529 [0,1,0,0,0,1|2,0,0]=4 5210 B14R1.946 COCCC(=O)Nc1ccccc1F 527a_100000210422_100000749529 [0,1,0,0,0,1|2,0,0]=4 5211 B14R1.946 COCCC(=O)Nc1ccccc1I 11a_100000210053_100000749529 [0,1,0,0,0,1|2,0,0]=4 5212 B14R1.946 COCCC(=O)Nc1ccccc1I 1626a_100000210053_100000749529 [0,1,0,0,0,1|2,0,0]=4 5213 B14R1.946 COCCC(=O)Nc1ccccc1O 22a_100000185747_100000749529 [0,1,0,0,0,1|1,0,0]=3 5214 B14R1.946 COCCC(=O)Nc1ccccc1O 527a_100000185747_100000749529 [0,1,0,0,0,1|1,0,0]=3 5215 B14R1.946 CSCCC(=O)Cc1ccccc1Br 1458a_100000174002_100000184730 [0,1,0,0,0,1|2,0,0]=4 5216 B14R1.946 CSCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000751147 [0,1,0,0,0,1|2,0,0]=4 5217 B14R1.946 CSCCC(=O)Cc1ccccc1C 1458a_100000174002_100000211839 [0,1,0,0,0,1|2,0,0]=4 5218 B14R1.946 CSCCC(=O)Cc1ccccc1C 1458a_100000212180_100000751147 [0,1,0,0,0,1|2,0,0]=4 5219 B14R1.946 CSCCC(=O)Cc1ccccc1Cl 1458a_100000174002_100000187162 [0,1,0,0,0,1|2,0,0]=4 5220 B14R1.946 CSCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000751147 [0,1,0,0,0,1|2,0,0]=4 5221 B14R1.946 CSCCC(=O)Cc1ccccc1F 1458a_100000174002_100000187165 [0,1,0,0,0,1|2,0,0]=4 5222 B14R1.946 CSCCC(=O)Cc1ccccc1F 1458a_100000212012_100000751147 [0,1,0,0,0,1|2,0,0]=4 5223 B14R1.946 CSCCC(=O)Cc1ccccc1I 1458a_100000036491_100000751147 [0,1,0,0,0,1|2,0,0]=4 5224 B14R1.946 CSCCC(=O)Cc1ccccc1I 1458a_100000174002_100011216222 [0,1,0,0,0,1|2,0,0]=4 5225 B14R1.946 CSCCC(=O)Cc1ccccc1O 1458a_100000743006_100000751147 [0,1,0,0,0,1|1,0,0]=3 5226 B14R1.946 CSCCC(=O)Cc1ncccc1O 1458a_100000174002_200020655725 [0,1,0,0,0,1|2,0,0]=4 5227 B14R1.946 CSCCC(=O)Nc1ccccc1Br 11a_100000210017_100000174002 [0,1,0,0,0,1|2,0,0]=4 5228 B14R1.946 CSCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000174002 [0,1,0,0,0,1|2,0,0]=4 5229 B14R1.946 CSCCC(=O)Nc1ccccc1Br 62a_100000181489_200000210301 [0,1,0,0,0,1|2,0,0]=4 5230 B14R1.946 CSCCC(=O)Nc1ccccc1Br 62a_200000210301_100000181489 [0,1,0,0,0,1|2,0,0]=4 5231 B14R1.946 CSCCC(=O)Nc1ccccc1C 11a_100015192222_100000174002 [0,1,0,0,0,1|2,0,0]=4 5232 B14R1.946 CSCCC(=O)Nc1ccccc1C 1626a_100015192222_100000174002 [0,1,0,0,0,1|2,0,0]=4 5233 B14R1.946 CSCCC(=O)Nc1ccccc1C 22a_100015192222_100000174002 [0,1,0,0,0,1|2,0,0]=4 5234 B14R1.946 CSCCC(=O)Nc1ccccc1C 527a_100015192222_100000174002 [0,1,0,0,0,1|2,0,0]=4 5235 B14R1.946 CSCCC(=O)Nc1ccccc1C 62a_200000210301_200011206476 [0,1,0,0,0,1|2,0,0]=4 5236 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000174002 [0,1,0,0,0,1|2,0,0]=4 5237 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000174002 [0,1,0,0,0,1|2,0,0]=4 5238 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000174002 [0,1,0,0,0,1|2,0,0]=4 5239 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000174002 [0,1,0,0,0,1|2,0,0]=4 5240 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 62a_200000210301_100000242055 [0,1,0,0,0,1|2,0,0]=4 5241 B14R1.946 CSCCC(=O)Nc1ccccc1F 11a_100000210422_100000174002 [0,1,0,0,0,1|2,0,0]=4 5242 B14R1.946 CSCCC(=O)Nc1ccccc1F 1626a_100000210422_100000174002 [0,1,0,0,0,1|2,0,0]=4 5243 B14R1.946 CSCCC(=O)Nc1ccccc1F 22a_100000210422_100000174002 [0,1,0,0,0,1|2,0,0]=4 5244 B14R1.946 CSCCC(=O)Nc1ccccc1F 527a_100000210422_100000174002 [0,1,0,0,0,1|2,0,0]=4 5245 B14R1.946 CSCCC(=O)Nc1ccccc1F 62a_100011216740_200000210301 [0,1,0,0,0,1|2,0,0]=4 5246 B14R1.946 CSCCC(=O)Nc1ccccc1F 62a_200000210301_100000242066 [0,1,0,0,0,1|2,0,0]=4 5247 B14R1.946 CSCCC(=O)Nc1ccccc1I 11a_100000210053_100000174002 [0,1,0,0,0,1|2,0,0]=4 5248 B14R1.946 CSCCC(=O)Nc1ccccc1I 1626a_100000210053_100000174002 [0,1,0,0,0,1|2,0,0]=4 5249 B14R1.946 CSCCC(=O)Nc1ccccc1O 22a_100000185747_100000174002 [0,1,0,0,0,1|1,0,0]=3 5250 B14R1.946 CSCCC(=O)Nc1ccccc1O 527a_100000185747_100000174002 [0,1,0,0,0,1|1,0,0]=3 5251 B14R1.946 Cc1ccccc1CC(=O)CCCF 1458a_100000212180_100011934791 [0,1,0,0,0,1|2,0,0]=4 5252 B14R1.946 Cc1ccccc1CC(=O)CCCO 1458a_100000212180_100011215043 [0,1,0,0,0,1|2,0,0]=4 5253 B14R1.946 Cc1ccccc1CC(=O)NCCF 11a_100000724931_100000212180 [0,1,0,0,0,1|2,0,0]=4 5254 B14R1.946 Cc1ccccc1CC(=O)NCCF 1626a_100000724931_100000212180 [0,1,0,0,0,1|2,0,0]=4 5255 B14R1.946 Cc1ccccc1CC(=O)NCCF 240690a_100000724931_100000212180 [0,1,0,0,0,1|2,0,0]=4 5256 B14R1.946 Cc1ccccc1CC(=O)NCCF 527a_100000724931_100000212180 [0,1,0,0,0,1|2,0,0]=4 5257 B14R1.946 Cc1ccccc1CC(=O)NCCO 240690a_100000210304_100000212180 [0,1,0,0,0,1|2,0,0]=4 5258 B14R1.946 Cc1ccccc1CC(=O)NCCO 527a_100000210304_100000212180 [0,1,0,0,0,1|2,0,0]=4 5259 B14R1.946 Cc1ccccc1NC(=O)CCN[13CH3] 2230a_200015185780_200025704644 [0,1,0,0,0,1|2,0,0]=4 5260 B14R1.946 Cc1ccccc1NC(=O)CCN[13CH3] 34a_200015185780_200025704644 [0,1,0,0,0,1|2,0,0]=4 5261 B14R1.946 Cc1ccccc1NC(=O)CCS[13CH3] 62a_200025704644_200011206476 [0,1,0,0,0,1|2,0,0]=4 5262 B14R1.946 Cc1ccccc1NC(=O)NCCF 2430a_100015192222_100000724931 [0,1,0,0,0,1|2,0,0]=4 5263 B14R1.946 Cc1ccccc1NC(=O)NCCO 2430a_100015192222_100000210304 [0,1,0,0,0,1|2,0,0]=4 5264 B14R1.946 N#CCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215226 [0,1,0,0,0,1|1,0,1]=4 5265 B14R1.946 N#CCCC(=O)Nc1ccccc1O 22a_100000185747_100011934036 [0,1,0,0,0,1|1,0,1]=4 5266 B14R1.946 N#CCCC(=O)Nc1ccccc1O 527a_100000185747_100011934036 [0,1,0,0,0,1|1,0,1]=4 5267 B14R1.946 N#CCNC(=O)Cc1ccccc1O 527a_100000734998_100000743006 [0,1,0,0,0,1|1,0,1]=4 5268 B14R1.946 N#CCNC(=O)Nc1ccccc1O 2430a_100000185747_100000734998 [0,1,0,0,0,1|1,0,1]=4 5269 B14R1.946 O=C(CCCF)Cc1ccccc1Br 1458a_100000751119_100011934791 [0,1,0,0,0,1|2,0,0]=4 5270 B14R1.946 O=C(CCCF)Cc1ccccc1Cl 1458a_100000183793_100011934791 [0,1,0,0,0,1|2,0,0]=4 5271 B14R1.946 O=C(CCCF)Cc1ccccc1F 1458a_100000212012_100011934791 [0,1,0,0,0,1|2,0,0]=4 5272 B14R1.946 O=C(CCCF)Cc1ccccc1I 1458a_100000036491_100011934791 [0,1,0,0,0,1|2,0,0]=4 5273 B14R1.946 O=C(CCCF)Cc1ccccc1O 1458a_100000743006_100011934791 [0,1,0,0,0,1|1,0,0]=3 5274 B14R1.946 O=C(CCCO)Cc1ccccc1Br 1458a_100000751119_100011215043 [0,1,0,0,0,1|2,0,0]=4 5275 B14R1.946 O=C(CCCO)Cc1ccccc1Cl 1458a_100000183793_100011215043 [0,1,0,0,0,1|2,0,0]=4 5276 B14R1.946 O=C(CCCO)Cc1ccccc1F 1458a_100000212012_100011215043 [0,1,0,0,0,1|2,0,0]=4 5277 B14R1.946 O=C(CCCO)Cc1ccccc1I 1458a_100000036491_100011215043 [0,1,0,0,0,1|2,0,0]=4 5278 B14R1.946 O=C(CCCO)Cc1ccccc1O 1458a_100000743006_100011215043 [0,1,0,0,0,1|1,0,0]=3 5279 B14R1.946 O=C(CSCF)Nc1ccccc1O 62a_100015361967_100000014494 [0,1,0,0,0,1|1,1,0]=4 5280 B14R1.946 O=C(Cc1ccccc1Br)NCCF 11a_100000724931_100000751119 [0,1,0,0,0,1|2,0,0]=4 5281 B14R1.946 O=C(Cc1ccccc1Br)NCCF 240690a_100000724931_100000751119 [0,1,0,0,0,1|2,0,0]=4 5282 B14R1.946 O=C(Cc1ccccc1Br)NCCF 527a_100000724931_100000751119 [0,1,0,0,0,1|2,0,0]=4 5283 B14R1.946 O=C(Cc1ccccc1Br)NCCO 240690a_100000210304_100000751119 [0,1,0,0,0,1|2,0,0]=4 5284 B14R1.946 O=C(Cc1ccccc1Br)NCCO 527a_100000210304_100000751119 [0,1,0,0,0,1|2,0,0]=4 5285 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 11a_100000724931_100000183793 [0,1,0,0,0,1|2,0,0]=4 5286 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 1626a_100000724931_100000183793 [0,1,0,0,0,1|2,0,0]=4 5287 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 240690a_100000724931_100000183793 [0,1,0,0,0,1|2,0,0]=4 5288 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 527a_100000724931_100000183793 [0,1,0,0,0,1|2,0,0]=4 5289 B14R1.946 O=C(Cc1ccccc1Cl)NCCO 240690a_100000210304_100000183793 [0,1,0,0,0,1|2,0,0]=4 5290 B14R1.946 O=C(Cc1ccccc1Cl)NCCO 527a_100000210304_100000183793 [0,1,0,0,0,1|2,0,0]=4 5291 B14R1.946 O=C(Cc1ccccc1F)NCCF 11a_100000724931_100000212012 [0,1,0,0,0,1|2,0,0]=4 5292 B14R1.946 O=C(Cc1ccccc1F)NCCF 1626a_100000724931_100000212012 [0,1,0,0,0,1|2,0,0]=4 5293 B14R1.946 O=C(Cc1ccccc1F)NCCF 240690a_100000724931_100000212012 [0,1,0,0,0,1|2,0,0]=4 5294 B14R1.946 O=C(Cc1ccccc1F)NCCF 527a_100000724931_100000212012 [0,1,0,0,0,1|2,0,0]=4 5295 B14R1.946 O=C(Cc1ccccc1F)NCCO 240690a_100000210304_100000212012 [0,1,0,0,0,1|2,0,0]=4 5296 B14R1.946 O=C(Cc1ccccc1F)NCCO 527a_100000210304_100000212012 [0,1,0,0,0,1|2,0,0]=4 5297 B14R1.946 O=C(Cc1ccccc1I)NCCF 11a_100000724931_100000036491 [0,1,0,0,0,1|2,0,0]=4 5298 B14R1.946 O=C(Cc1ccccc1I)NCCF 1626a_100000724931_100000036491 [0,1,0,0,0,1|2,0,0]=4 5299 B14R1.946 O=C(Cc1ccccc1I)NCCF 240690a_100000724931_100000036491 [0,1,0,0,0,1|2,0,0]=4 5300 B14R1.946 O=C(Cc1ccccc1I)NCCF 527a_100000724931_100000036491 [0,1,0,0,0,1|2,0,0]=4 5301 B14R1.946 O=C(Cc1ccccc1I)NCCO 240690a_100000210304_100000036491 [0,1,0,0,0,1|2,0,0]=4 5302 B14R1.946 O=C(Cc1ccccc1I)NCCO 527a_100000210304_100000036491 [0,1,0,0,0,1|2,0,0]=4 5303 B14R1.946 O=C(Cc1ccccc1O)NCCF 240690a_100000724931_100000743006 [0,1,0,0,0,1|1,0,0]=3 5304 B14R1.946 O=C(Cc1ccccc1O)NCCF 527a_100000724931_100000743006 [0,1,0,0,0,1|1,0,0]=3 5305 B14R1.946 O=C(Cc1ccccc1O)NCCO 240690a_100000210304_100000743006 [0,1,0,0,0,1|1,0,0]=3 5306 B14R1.946 O=C(Cc1ccccc1O)NCCO 527a_100000210304_100000743006 [0,1,0,0,0,1|1,0,0]=3 5307 B14R1.946 O=C(NCCF)Nc1ccccc1Br 2430a_100000210017_100000724931 [0,1,0,0,0,1|2,0,0]=4 5308 B14R1.946 O=C(NCCF)Nc1ccccc1Cl 2430a_100000185783_100000724931 [0,1,0,0,0,1|2,0,0]=4 5309 B14R1.946 O=C(NCCF)Nc1ccccc1F 2430a_100000210422_100000724931 [0,1,0,0,0,1|2,0,0]=4 5310 B14R1.946 O=C(NCCF)Nc1ccccc1I 2430a_100000210053_100000724931 [0,1,0,0,0,1|2,0,0]=4 5311 B14R1.946 O=C(NCCF)Nc1ccccc1O 2430a_100000185747_100000724931 [0,1,0,0,0,1|1,0,0]=3 5312 B14R1.946 O=C(NCCO)Nc1ccccc1Br 2430a_100000210017_100000210304 [0,1,0,0,0,1|2,0,0]=4 5313 B14R1.946 O=C(NCCO)Nc1ccccc1Cl 2430a_100000185783_100000210304 [0,1,0,0,0,1|2,0,0]=4 5314 B14R1.946 O=C(NCCO)Nc1ccccc1F 2430a_100000210422_100000210304 [0,1,0,0,0,1|2,0,0]=4 5315 B14R1.946 O=C(NCCO)Nc1ccccc1I 2430a_100000210053_100000210304 [0,1,0,0,0,1|2,0,0]=4 5316 B14R1.946 O=C(NCCO)Nc1ccccc1O 2430a_100000185747_100000210304 [0,1,0,0,0,1|1,0,0]=3 5317 B14R1.946 [13CH3]NCCC(=O)Nc1ccccc1F 2230a_100015185137_200025704644 [0,1,0,0,0,1|2,0,0]=4 5318 B14R1.946 [13CH3]NCCC(=O)Nc1ccccc1F 34a_100015185137_200025704644 [0,1,0,0,0,1|2,0,0]=4 5319 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1Br 62a_100000181489_200025704644 [0,1,0,0,0,1|2,0,0]=4 5320 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1Br 62a_200025704644_100000181489 [0,1,0,0,0,1|2,0,0]=4 5321 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1Cl 62a_200025704644_100000242055 [0,1,0,0,0,1|2,0,0]=4 5322 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1F 62a_100011216740_200025704644 [0,1,0,0,0,1|2,0,0]=4 5323 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1F 62a_200025704644_100000242066 [0,1,0,0,0,1|2,0,0]=4 5324 B14R1.950 CC#CC(=O)Cc1cc(ccc1O)F 1458a_100000763181_100010161318 [0,1,0,0,0,1|1,0,1]=4 5325 B14R1.950 CC#CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000763181 [0,1,0,0,0,1|1,0,1]=4 5326 B14R1.950 CC#CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000763181 [0,1,0,0,0,1|1,0,1]=4 5327 B14R1.950 CC#CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000763181 [0,1,0,0,0,1|1,0,1]=4 5328 B14R1.950 CC#CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000763181 [0,1,0,0,0,1|1,0,1]=4 5329 B14R1.950 CC#CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000763181 [0,1,0,0,0,1|1,0,1]=4 5330 B14R1.950 CC=CC(=O)Cc1cc(ccc1O)F 1458a_100000210699_100010161318 [0,1,0,0,0,1|1,0,1]=4 5331 B14R1.950 CC=CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000210699 [0,1,0,0,0,1|1,0,1]=4 5332 B14R1.950 CC=CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000210699 [0,1,0,0,0,1|1,0,1]=4 5333 B14R1.950 CC=CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000210699 [0,1,0,0,0,1|1,0,1]=4 5334 B14R1.950 CC=CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000210699 [0,1,0,0,0,1|1,0,1]=4 5335 B14R1.950 CC=CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000210699 [0,1,0,0,0,1|1,0,1]=4 5336 B14R1.950 CCCC(=O)Cc1cc(ccc1Br)Br 1458a_100000211992_100011982794 [0,1,0,0,0,1|2,0,0]=4 5337 B14R1.950 CCCC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_100000210303 [0,1,0,0,0,1|2,0,0]=4 5338 B14R1.950 CCCC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_100000210303 [0,1,0,0,0,1|2,0,0]=4 5339 B14R1.950 CCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000211992_100000733903 [0,1,0,0,0,1|2,0,0]=4 5340 B14R1.950 CCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000210303 [0,1,0,0,0,1|2,0,0]=4 5341 B14R1.950 CCCC(=O)Cc1cc(ccc1Br)F 1458a_100000211992_100000736370 [0,1,0,0,0,1|2,0,0]=4 5342 B14R1.950 CCCC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_100000210303 [0,1,0,0,0,1|2,0,0]=4 5343 B14R1.950 CCCC(=O)Cc1cc(ccc1Br)I 1458a_100000211992_100012355412 [0,1,0,0,0,1|2,0,0]=4 5344 B14R1.950 CCCC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_100000210303 [0,1,0,0,0,1|2,0,0]=4 5345 B14R1.950 CCCC(=O)Cc1cc(ccc1C)C 1458a_100000211992_100000184699 [0,1,0,0,0,1|2,0,0]=4 5346 B14R1.950 CCCC(=O)Cc1cc(ccc1C)C 1458a_100000749331_100000210303 [0,1,0,0,0,1|2,0,0]=4 5347 B14R1.950 CCCC(=O)Cc1cc(ccc1C)Cl 1458a_100000211992_100012186985 [0,1,0,0,0,1|2,0,0]=4 5348 B14R1.950 CCCC(=O)Cc1cc(ccc1C)F 1458a_100000211992_100000709795 [0,1,0,0,0,1|2,0,0]=4 5349 B14R1.950 CCCC(=O)Cc1cc(ccc1C)F 1458a_100011219217_100000210303 [0,1,0,0,0,1|2,0,0]=4 5350 B14R1.950 CCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000211992_100000763347 [0,1,0,0,0,1|2,0,0]=4 5351 B14R1.950 CCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000210303 [0,1,0,0,0,1|2,0,0]=4 5352 B14R1.950 CCCC(=O)Cc1cc(ccc1Cl)C 1458a_100000211992_100009871730 [0,1,0,0,0,1|2,0,0]=4 5353 B14R1.950 CCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000211992_100000754809 [0,1,0,0,0,1|2,0,0]=4 5354 B14R1.950 CCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000210303 [0,1,0,0,0,1|2,0,0]=4 5355 B14R1.950 CCCC(=O)Cc1cc(ccc1Cl)F 1458a_100000211992_100000709952 [0,1,0,0,0,1|2,0,0]=4 5356 B14R1.950 CCCC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_100000210303 [0,1,0,0,0,1|2,0,0]=4 5357 B14R1.950 CCCC(=O)Cc1cc(ccc1Cl)I 1458a_100000211992_100010188191 [0,1,0,0,0,1|2,0,0]=4 5358 B14R1.950 CCCC(=O)Cc1cc(ccc1F)Br 1458a_100000211992_100000736399 [0,1,0,0,0,1|2,0,0]=4 5359 B14R1.950 CCCC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_100000210303 [0,1,0,0,0,1|2,0,0]=4 5360 B14R1.950 CCCC(=O)Cc1cc(ccc1F)C 1458a_100000211992_100011260760 [0,1,0,0,0,1|2,0,0]=4 5361 B14R1.950 CCCC(=O)Cc1cc(ccc1F)C 1458a_100011667363_100000210303 [0,1,0,0,0,1|2,0,0]=4 5362 B14R1.950 CCCC(=O)Cc1cc(ccc1F)Cl 1458a_100000211992_100000716957 [0,1,0,0,0,1|2,0,0]=4 5363 B14R1.950 CCCC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_100000210303 [0,1,0,0,0,1|2,0,0]=4 5364 B14R1.950 CCCC(=O)Cc1cc(ccc1F)F 1458a_100000211992_100000741279 [0,1,0,0,0,1|2,0,0]=4 5365 B14R1.950 CCCC(=O)Cc1cc(ccc1F)F 1458a_100000762760_100000210303 [0,1,0,0,0,1|2,0,0]=4 5366 B14R1.950 CCCC(=O)Cc1cc(ccc1F)I 1458a_100000211992_200010149601 [0,1,0,0,0,1|2,0,0]=4 5367 B14R1.950 CCCC(=O)Cc1cc(ccc1I)Br 1458a_100000211992_100012362523 [0,1,0,0,0,1|2,0,0]=4 5368 B14R1.950 CCCC(=O)Cc1cc(ccc1I)Cl 1458a_100000211992_100012348826 [0,1,0,0,0,1|2,0,0]=4 5369 B14R1.950 CCCC(=O)Cc1cc(ccc1I)F 1458a_100000211992_100010149606 [0,1,0,0,0,1|2,0,0]=4 5370 B14R1.950 CCCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000210303 [0,1,0,0,0,1|1,0,0]=3 5371 B14R1.950 CCCC(=O)Cc1cc(ccc1O)F 1458a_100000211992_100010161318 [0,1,0,0,0,1|1,0,0]=3 5372 B14R1.950 CCCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000210303 [0,1,0,0,0,1|1,0,0]=3 5373 B14R1.950 CCCC(=O)Cc1nc(ccc1O)C 1458a_100000211992_100020630696 [0,1,0,0,0,1|2,0,0]=4 5374 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100000211992 [0,1,0,0,0,1|2,0,0]=4 5375 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100000211992 [0,1,0,0,0,1|2,0,0]=4 5376 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100000211992 [0,1,0,0,0,1|2,0,0]=4 5377 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100000211992 [0,1,0,0,0,1|2,0,0]=4 5378 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100000211992 [0,1,0,0,0,1|2,0,0]=4 5379 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100000211992 [0,1,0,0,0,1|2,0,0]=4 5380 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100000211992 [0,1,0,0,0,1|2,0,0]=4 5381 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100000211992 [0,1,0,0,0,1|2,0,0]=4 5382 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100000211992 [0,1,0,0,0,1|2,0,0]=4 5383 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100000211992 [0,1,0,0,0,1|2,0,0]=4 5384 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000211992 [0,1,0,0,0,1|2,0,0]=4 5385 B14R1.950 CCCC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100000211992 [0,1,0,0,0,1|2,0,0]=4 5386 B14R1.950 CCCC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100000211992 [0,1,0,0,0,1|2,0,0]=4 5387 B14R1.950 CCCC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100000211992 [0,1,0,0,0,1|2,0,0]=4 5388 B14R1.950 CCCC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000211992 [0,1,0,0,0,1|2,0,0]=4 5389 B14R1.950 CCCC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100000211992 [0,1,0,0,0,1|2,0,0]=4 5390 B14R1.950 CCCC(=O)Nc1cc(ccc1C)C 11a_100000185781_100000211992 [0,1,0,0,0,1|2,0,0]=4 5391 B14R1.950 CCCC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100000211992 [0,1,0,0,0,1|2,0,0]=4 5392 B14R1.950 CCCC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000211992 [0,1,0,0,0,1|2,0,0]=4 5393 B14R1.950 CCCC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100000211992 [0,1,0,0,0,1|2,0,0]=4 5394 B14R1.950 CCCC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100000211992 [0,1,0,0,0,1|2,0,0]=4 5395 B14R1.950 CCCC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000211992 [0,1,0,0,0,1|2,0,0]=4 5396 B14R1.950 CCCC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100000211992 [0,1,0,0,0,1|2,0,0]=4 5397 B14R1.950 CCCC(=O)Nc1cc(ccc1C)F 11a_100000211107_100000211992 [0,1,0,0,0,1|2,0,0]=4 5398 B14R1.950 CCCC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100000211992 [0,1,0,0,0,1|2,0,0]=4 5399 B14R1.950 CCCC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000211992 [0,1,0,0,0,1|2,0,0]=4 5400 B14R1.950 CCCC(=O)Nc1cc(ccc1C)I 11a_100000761890_100000211992 [0,1,0,0,0,1|2,0,0]=4 5401 B14R1.950 CCCC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100000211992 [0,1,0,0,0,1|2,0,0]=4 5402 B14R1.950 CCCC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000211992 [0,1,0,0,0,1|2,0,0]=4 5403 B14R1.950 CCCC(=O)Nc1cc(ccc1C)I 527a_100000761890_100000211992 [0,1,0,0,0,1|2,0,0]=4 5404 B14R1.950 CCCC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000211992 [0,1,0,0,0,1|2,0,0]=4 5405 B14R1.950 CCCC(=O)Nc1cc(ccc1C)O 527a_100011216113_100000211992 [0,1,0,0,0,1|2,0,0]=4 5406 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100000211992 [0,1,0,0,0,1|2,0,0]=4 5407 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100000211992 [0,1,0,0,0,1|2,0,0]=4 5408 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100000211992 [0,1,0,0,0,1|2,0,0]=4 5409 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100000211992 [0,1,0,0,0,1|2,0,0]=4 5410 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000211992 [0,1,0,0,0,1|2,0,0]=4 5411 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100000211992 [0,1,0,0,0,1|2,0,0]=4 5412 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100000211992 [0,1,0,0,0,1|2,0,0]=4 5413 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100000211992 [0,1,0,0,0,1|2,0,0]=4 5414 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100000211992 [0,1,0,0,0,1|2,0,0]=4 5415 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100000211992 [0,1,0,0,0,1|2,0,0]=4 5416 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100000211992 [0,1,0,0,0,1|2,0,0]=4 5417 B14R1.950 CCCC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100000211992 [0,1,0,0,0,1|2,0,0]=4 5418 B14R1.950 CCCC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100000211992 [0,1,0,0,0,1|2,0,0]=4 5419 B14R1.950 CCCC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100000211992 [0,1,0,0,0,1|2,0,0]=4 5420 B14R1.950 CCCC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000211992 [0,1,0,0,0,1|2,0,0]=4 5421 B14R1.950 CCCC(=O)Nc1cc(ccc1F)C 11a_100000211285_100000211992 [0,1,0,0,0,1|2,0,0]=4 5422 B14R1.950 CCCC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100000211992 [0,1,0,0,0,1|2,0,0]=4 5423 B14R1.950 CCCC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000211992 [0,1,0,0,0,1|2,0,0]=4 5424 B14R1.950 CCCC(=O)Nc1cc(ccc1F)C 527a_100000211285_100000211992 [0,1,0,0,0,1|2,0,0]=4 5425 B14R1.950 CCCC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100000211992 [0,1,0,0,0,1|2,0,0]=4 5426 B14R1.950 CCCC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100000211992 [0,1,0,0,0,1|2,0,0]=4 5427 B14R1.950 CCCC(=O)Nc1cc(ccc1F)F 11a_100000210742_100000211992 [0,1,0,0,0,1|2,0,0]=4 5428 B14R1.950 CCCC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100000211992 [0,1,0,0,0,1|2,0,0]=4 5429 B14R1.950 CCCC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000211992 [0,1,0,0,0,1|2,0,0]=4 5430 B14R1.950 CCCC(=O)Nc1cc(ccc1F)I 11a_100011464823_100000211992 [0,1,0,0,0,1|2,0,0]=4 5431 B14R1.950 CCCC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100000211992 [0,1,0,0,0,1|2,0,0]=4 5432 B14R1.950 CCCC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100000211992 [0,1,0,0,0,1|2,0,0]=4 5433 B14R1.950 CCCC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000211992 [0,1,0,0,0,1|2,0,0]=4 5434 B14R1.950 CCCC(=O)Nc1cc(ccc1F)O 527a_100012017239_100000211992 [0,1,0,0,0,1|2,0,0]=4 5435 B14R1.950 CCCC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100000211992 [0,1,0,0,0,1|2,0,0]=4 5436 B14R1.950 CCCC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100000211992 [0,1,0,0,0,1|2,0,0]=4 5437 B14R1.950 CCCC(=O)Nc1cc(ccc1I)C 11a_100011216686_100000211992 [0,1,0,0,0,1|2,0,0]=4 5438 B14R1.950 CCCC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100000211992 [0,1,0,0,0,1|2,0,0]=4 5439 B14R1.950 CCCC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100000211992 [0,1,0,0,0,1|2,0,0]=4 5440 B14R1.950 CCCC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100000211992 [0,1,0,0,0,1|2,0,0]=4 5441 B14R1.950 CCCC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000211992 [0,1,0,0,0,1|2,0,0]=4 5442 B14R1.950 CCCC(=O)Nc1cc(ccc1I)F 11a_100011218093_100000211992 [0,1,0,0,0,1|2,0,0]=4 5443 B14R1.950 CCCC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100000211992 [0,1,0,0,0,1|2,0,0]=4 5444 B14R1.950 CCCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000211992 [0,1,0,0,0,1|1,0,0]=3 5445 B14R1.950 CCCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000211992 [0,1,0,0,0,1|1,0,0]=3 5446 B14R1.950 CCCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000211992 [0,1,0,0,0,1|1,0,0]=3 5447 B14R1.950 CCCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000211992 [0,1,0,0,0,1|1,0,0]=3 5448 B14R1.950 CCCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000211992 [0,1,0,0,0,1|1,0,0]=3 5449 B14R1.950 CCCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000211992 [0,1,0,0,0,1|1,0,0]=3 5450 B14R1.950 CCCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000211992 [0,1,0,0,0,1|1,0,0]=3 5451 B14R1.950 CCCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000211992 [0,1,0,0,0,1|1,0,0]=3 5452 B14R1.950 CCCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000211992 [0,1,0,0,0,1|1,0,0]=3 5453 B14R1.950 CCCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000211992 [0,1,0,0,0,1|1,0,0]=3 5454 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)Br 11a_100015525214_100010004897 [0,1,0,0,0,1|2,0,0]=4 5455 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)Br 240690a_100015525214_100010004897 [0,1,0,0,0,1|2,0,0]=4 5456 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)Br 527a_100015525214_100010004897 [0,1,0,0,0,1|2,0,0]=4 5457 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)C 11a_100015525214_100010004923 [0,1,0,0,0,1|2,0,0]=4 5458 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)C 240690a_100015525214_100010004923 [0,1,0,0,0,1|2,0,0]=4 5459 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)C 527a_100015525214_100010004923 [0,1,0,0,0,1|2,0,0]=4 5460 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)Cl 11a_100015525214_100000690875 [0,1,0,0,0,1|2,0,0]=4 5461 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)Cl 240690a_100015525214_100000690875 [0,1,0,0,0,1|2,0,0]=4 5462 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)Cl 527a_100015525214_100000690875 [0,1,0,0,0,1|2,0,0]=4 5463 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)F 11a_100015525214_100000690878 [0,1,0,0,0,1|2,0,0]=4 5464 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)F 240690a_100015525214_100000690878 [0,1,0,0,0,1|2,0,0]=4 5465 B14R1.950 CCNC(=O)Cc1cc(ccc1Br)F 527a_100015525214_100000690878 [0,1,0,0,0,1|2,0,0]=4 5466 B14R1.950 CCNC(=O)Cc1cc(ccc1C)Br 11a_100015525214_100010244045 [0,1,0,0,0,1|2,0,0]=4 5467 B14R1.950 CCNC(=O)Cc1cc(ccc1C)Br 240690a_100015525214_100010244045 [0,1,0,0,0,1|2,0,0]=4 5468 B14R1.950 CCNC(=O)Cc1cc(ccc1C)Br 527a_100015525214_100010244045 [0,1,0,0,0,1|2,0,0]=4 5469 B14R1.950 CCNC(=O)Cc1cc(ccc1C)C 11a_100015525214_100000749331 [0,1,0,0,0,1|2,0,0]=4 5470 B14R1.950 CCNC(=O)Cc1cc(ccc1C)C 240690a_100015525214_100000749331 [0,1,0,0,0,1|2,0,0]=4 5471 B14R1.950 CCNC(=O)Cc1cc(ccc1C)C 527a_100015525214_100000749331 [0,1,0,0,0,1|2,0,0]=4 5472 B14R1.950 CCNC(=O)Cc1cc(ccc1C)F 11a_100015525214_100011219217 [0,1,0,0,0,1|2,0,0]=4 5473 B14R1.950 CCNC(=O)Cc1cc(ccc1C)F 240690a_100015525214_100011219217 [0,1,0,0,0,1|2,0,0]=4 5474 B14R1.950 CCNC(=O)Cc1cc(ccc1C)F 527a_100015525214_100011219217 [0,1,0,0,0,1|2,0,0]=4 5475 B14R1.950 CCNC(=O)Cc1cc(ccc1Cl)Br 11a_100015525214_100011600618 [0,1,0,0,0,1|2,0,0]=4 5476 B14R1.950 CCNC(=O)Cc1cc(ccc1Cl)Br 240690a_100015525214_100011600618 [0,1,0,0,0,1|2,0,0]=4 5477 B14R1.950 CCNC(=O)Cc1cc(ccc1Cl)Br 527a_100015525214_100011600618 [0,1,0,0,0,1|2,0,0]=4 5478 B14R1.950 CCNC(=O)Cc1cc(ccc1Cl)Cl 11a_100015525214_100000748246 [0,1,0,0,0,1|2,0,0]=4 5479 B14R1.950 CCNC(=O)Cc1cc(ccc1Cl)Cl 240690a_100015525214_100000748246 [0,1,0,0,0,1|2,0,0]=4 5480 B14R1.950 CCNC(=O)Cc1cc(ccc1Cl)Cl 527a_100015525214_100000748246 [0,1,0,0,0,1|2,0,0]=4 5481 B14R1.950 CCNC(=O)Cc1cc(ccc1Cl)F 11a_100015525214_100011830335 [0,1,0,0,0,1|2,0,0]=4 5482 B14R1.950 CCNC(=O)Cc1cc(ccc1Cl)F 240690a_100015525214_100011830335 [0,1,0,0,0,1|2,0,0]=4 5483 B14R1.950 CCNC(=O)Cc1cc(ccc1Cl)F 527a_100015525214_100011830335 [0,1,0,0,0,1|2,0,0]=4 5484 B14R1.950 CCNC(=O)Cc1cc(ccc1F)Br 11a_100015525214_100000690877 [0,1,0,0,0,1|2,0,0]=4 5485 B14R1.950 CCNC(=O)Cc1cc(ccc1F)Br 240690a_100015525214_100000690877 [0,1,0,0,0,1|2,0,0]=4 5486 B14R1.950 CCNC(=O)Cc1cc(ccc1F)Br 527a_100015525214_100000690877 [0,1,0,0,0,1|2,0,0]=4 5487 B14R1.950 CCNC(=O)Cc1cc(ccc1F)C 11a_100015525214_100011667363 [0,1,0,0,0,1|2,0,0]=4 5488 B14R1.950 CCNC(=O)Cc1cc(ccc1F)C 240690a_100015525214_100011667363 [0,1,0,0,0,1|2,0,0]=4 5489 B14R1.950 CCNC(=O)Cc1cc(ccc1F)C 527a_100015525214_100011667363 [0,1,0,0,0,1|2,0,0]=4 5490 B14R1.950 CCNC(=O)Cc1cc(ccc1F)Cl 11a_100015525214_100011217548 [0,1,0,0,0,1|2,0,0]=4 5491 B14R1.950 CCNC(=O)Cc1cc(ccc1F)Cl 240690a_100015525214_100011217548 [0,1,0,0,0,1|2,0,0]=4 5492 B14R1.950 CCNC(=O)Cc1cc(ccc1F)Cl 527a_100015525214_100011217548 [0,1,0,0,0,1|2,0,0]=4 5493 B14R1.950 CCNC(=O)Cc1cc(ccc1F)F 11a_100015525214_100000762760 [0,1,0,0,0,1|2,0,0]=4 5494 B14R1.950 CCNC(=O)Cc1cc(ccc1F)F 240690a_100015525214_100000762760 [0,1,0,0,0,1|2,0,0]=4 5495 B14R1.950 CCNC(=O)Cc1cc(ccc1F)F 527a_100015525214_100000762760 [0,1,0,0,0,1|2,0,0]=4 5496 B14R1.950 CCNC(=O)Cc1cc(ccc1O)Br 240690a_100015525214_100010072483 [0,1,0,0,0,1|1,0,0]=3 5497 B14R1.950 CCNC(=O)Nc1cc(ccc1Br)Br 2430a_100000737762_100015525214 [0,1,0,0,0,1|2,0,0]=4 5498 B14R1.950 CCNC(=O)Nc1cc(ccc1Br)C 2430a_100000745044_100015525214 [0,1,0,0,0,1|2,0,0]=4 5499 B14R1.950 CCNC(=O)Nc1cc(ccc1Br)F 2430a_100000687223_100015525214 [0,1,0,0,0,1|2,0,0]=4 5500 B14R1.950 CCNC(=O)Nc1cc(ccc1Br)I 2430a_100000750456_100015525214 [0,1,0,0,0,1|2,0,0]=4 5501 B14R1.950 CCNC(=O)Nc1cc(ccc1Br)I 512a_100000750456_100015525214 [0,1,0,0,0,1|2,0,0]=4 5502 B14R1.950 CCNC(=O)Nc1cc(ccc1Br)O 2430a_100011999798_100015525214 [0,1,0,0,0,1|2,0,0]=4 5503 B14R1.950 CCNC(=O)Nc1cc(ccc1C)Br 2430a_100000741167_100015525214 [0,1,0,0,0,1|2,0,0]=4 5504 B14R1.950 CCNC(=O)Nc1cc(ccc1C)Br 512a_100000741167_100015525214 [0,1,0,0,0,1|2,0,0]=4 5505 B14R1.950 CCNC(=O)Nc1cc(ccc1C)C 2430a_100000185781_100015525214 [0,1,0,0,0,1|2,0,0]=4 5506 B14R1.950 CCNC(=O)Nc1cc(ccc1C)Cl 2430a_100000211374_100015525214 [0,1,0,0,0,1|2,0,0]=4 5507 B14R1.950 CCNC(=O)Nc1cc(ccc1C)F 2430a_100000211107_100015525214 [0,1,0,0,0,1|2,0,0]=4 5508 B14R1.950 CCNC(=O)Nc1cc(ccc1C)I 2430a_100000761890_100015525214 [0,1,0,0,0,1|2,0,0]=4 5509 B14R1.950 CCNC(=O)Nc1cc(ccc1C)I 512a_100000761890_100015525214 [0,1,0,0,0,1|2,0,0]=4 5510 B14R1.950 CCNC(=O)Nc1cc(ccc1C)O 2430a_100011216113_100015525214 [0,1,0,0,0,1|2,0,0]=4 5511 B14R1.950 CCNC(=O)Nc1cc(ccc1Cl)C 2430a_100011215360_100015525214 [0,1,0,0,0,1|2,0,0]=4 5512 B14R1.950 CCNC(=O)Nc1cc(ccc1Cl)Cl 2430a_100000184485_100015525214 [0,1,0,0,0,1|2,0,0]=4 5513 B14R1.950 CCNC(=O)Nc1cc(ccc1Cl)F 2430a_100000751338_100015525214 [0,1,0,0,0,1|2,0,0]=4 5514 B14R1.950 CCNC(=O)Nc1cc(ccc1Cl)I 2430a_200000761891_100015525214 [0,1,0,0,0,1|2,0,0]=4 5515 B14R1.950 CCNC(=O)Nc1cc(ccc1Cl)O 2430a_100011934297_100015525214 [0,1,0,0,0,1|2,0,0]=4 5516 B14R1.950 CCNC(=O)Nc1cc(ccc1F)Br 2430a_100000740924_100015525214 [0,1,0,0,0,1|2,0,0]=4 5517 B14R1.950 CCNC(=O)Nc1cc(ccc1F)Br 512a_100000740924_100015525214 [0,1,0,0,0,1|2,0,0]=4 5518 B14R1.950 CCNC(=O)Nc1cc(ccc1F)C 2430a_100000211285_100015525214 [0,1,0,0,0,1|2,0,0]=4 5519 B14R1.950 CCNC(=O)Nc1cc(ccc1F)Cl 2430a_100000212115_100015525214 [0,1,0,0,0,1|2,0,0]=4 5520 B14R1.950 CCNC(=O)Nc1cc(ccc1F)F 2430a_100000210742_100015525214 [0,1,0,0,0,1|2,0,0]=4 5521 B14R1.950 CCNC(=O)Nc1cc(ccc1F)I 2430a_100011464823_100015525214 [0,1,0,0,0,1|2,0,0]=4 5522 B14R1.950 CCNC(=O)Nc1cc(ccc1F)I 512a_100011464823_100015525214 [0,1,0,0,0,1|2,0,0]=4 5523 B14R1.950 CCNC(=O)Nc1cc(ccc1F)O 2430a_100012017239_100015525214 [0,1,0,0,0,1|2,0,0]=4 5524 B14R1.950 CCNC(=O)Nc1cc(ccc1I)Br 512a_100000743836_100015525214 [0,1,0,0,0,1|2,0,0]=4 5525 B14R1.950 CCNC(=O)Nc1cc(ccc1I)C 2430a_100011216686_100015525214 [0,1,0,0,0,1|2,0,0]=4 5526 B14R1.950 CCNC(=O)Nc1cc(ccc1I)F 2430a_100011218093_100015525214 [0,1,0,0,0,1|2,0,0]=4 5527 B14R1.950 CCNC(=O)Nc1cc(ccc1I)F 512a_100011218093_100015525214 [0,1,0,0,0,1|2,0,0]=4 5528 B14R1.950 CCNC(=O)Nc1cc(ccc1O)Br 2430a_100000752626_100015525214 [0,1,0,0,0,1|1,0,0]=3 5529 B14R1.950 CCNC(=O)Nc1cc(ccc1O)C 2430a_100011215204_100015525214 [0,1,0,0,0,1|1,0,0]=3 5530 B14R1.950 CCNC(=O)Nc1cc(ccc1O)Cl 2430a_100000210500_100015525214 [0,1,0,0,0,1|1,0,0]=3 5531 B14R1.950 CCNC(=O)Nc1cc(ccc1O)F 2430a_100000759472_100015525214 [0,1,0,0,0,1|1,0,0]=3 5532 B14R1.950 CCNC(=O)Nc1cc(ccc1O)I 2430a_100000753495_100015525214 [0,1,0,0,0,1|1,0,0]=3 5533 B14R1.950 CNCC(=O)Nc1cc(ccc1O)Cl 2230a_106832991635_200000014493 [0,1,0,0,0,1|2,0,0]=4 5534 B14R1.950 CNCC(=O)Nc1cc(ccc1O)Cl 7a_106832991635_200000014493 [0,1,0,0,0,1|2,0,0]=4 5535 B14R1.950 CNNC(=O)Cc1cc(ccc1O)Br 22a_100016993582_100010072483 [0,1,0,0,0,1|2,0,0]=4 5536 B14R1.950 CNNC(=O)Cc1cc(ccc1O)O 22a_100016993582_100000038496 [0,1,0,0,0,1|2,0,0]=4 5537 B14R1.950 COCC(=O)Cc1cc(ccc1O)F 1458a_100000210968_100010161318 [0,1,0,0,0,1|2,0,0]=4 5538 B14R1.950 COCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000210968 [0,1,0,0,0,1|2,0,0]=4 5539 B14R1.950 COCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000210968 [0,1,0,0,0,1|2,0,0]=4 5540 B14R1.950 COCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000210968 [0,1,0,0,0,1|2,0,0]=4 5541 B14R1.950 COCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000210968 [0,1,0,0,0,1|2,0,0]=4 5542 B14R1.950 COCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000210968 [0,1,0,0,0,1|2,0,0]=4 5543 B14R1.950 COCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000210968 [0,1,0,0,0,1|2,0,0]=4 5544 B14R1.950 COCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000210968 [0,1,0,0,0,1|2,0,0]=4 5545 B14R1.950 COCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000210968 [0,1,0,0,0,1|2,0,0]=4 5546 B14R1.950 COCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000210968 [0,1,0,0,0,1|2,0,0]=4 5547 B14R1.950 COCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000210968 [0,1,0,0,0,1|2,0,0]=4 5548 B14R1.950 CSCC(=O)Cc1cc(ccc1O)F 1458a_100000184570_100010161318 [0,1,0,0,0,1|2,0,0]=4 5549 B14R1.950 CSCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000184570 [0,1,0,0,0,1|2,0,0]=4 5550 B14R1.950 CSCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000184570 [0,1,0,0,0,1|2,0,0]=4 5551 B14R1.950 CSCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000184570 [0,1,0,0,0,1|2,0,0]=4 5552 B14R1.950 CSCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000184570 [0,1,0,0,0,1|2,0,0]=4 5553 B14R1.950 CSCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000184570 [0,1,0,0,0,1|2,0,0]=4 5554 B14R1.950 CSCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000184570 [0,1,0,0,0,1|2,0,0]=4 5555 B14R1.950 CSCC(=O)Nc1cc(ccc1O)Cl 62a_200000210301_200000014493 [0,1,0,0,0,1|2,0,0]=4 5556 B14R1.950 CSCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000184570 [0,1,0,0,0,1|2,0,0]=4 5557 B14R1.950 CSCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000184570 [0,1,0,0,0,1|2,0,0]=4 5558 B14R1.950 CSCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000184570 [0,1,0,0,0,1|2,0,0]=4 5559 B14R1.950 CSCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000184570 [0,1,0,0,0,1|2,0,0]=4 5560 B14R1.950 Cc1ccc(c(c1)NC(=O)CCO)O 22a_100011215204_100011216618 [0,1,0,0,0,1|2,0,0]=4 5561 B14R1.950 O=C(CCF)Cc1cc(ccc1O)Br 1458a_100010072483_100011217306 [0,1,0,0,0,1|2,0,0]=4 5562 B14R1.950 O=C(CCF)Cc1cc(ccc1O)O 1458a_100000038496_100011217306 [0,1,0,0,0,1|2,0,0]=4 5563 B14R1.950 O=C(CCO)Cc1cc(ccc1O)Br 1458a_100010072483_100000211926 [0,1,0,0,0,1|2,0,0]=4 5564 B14R1.950 O=C(CCO)Cc1cc(ccc1O)F 1458a_100011216618_100010161318 [0,1,0,0,0,1|2,0,0]=4 5565 B14R1.950 O=C(CCO)Cc1cc(ccc1O)O 1458a_100000038496_100000211926 [0,1,0,0,0,1|2,0,0]=4 5566 B14R1.950 O=C(CCO)Nc1cc(ccc1O)Br 22a_100000752626_100011216618 [0,1,0,0,0,1|2,0,0]=4 5567 B14R1.950 O=C(CCO)Nc1cc(ccc1O)Cl 22a_100000210500_100011216618 [0,1,0,0,0,1|2,0,0]=4 5568 B14R1.950 O=C(CCO)Nc1cc(ccc1O)F 22a_100000759472_100011216618 [0,1,0,0,0,1|2,0,0]=4 5569 B14R1.950 O=C(CCO)Nc1cc(ccc1O)I 22a_100000753495_100011216618 [0,1,0,0,0,1|2,0,0]=4 5570 B14R1.950 [13CH3]SCC(=O)Nc1cc(ccc1O)Cl 62a_200025704644_200000014493 [0,1,0,0,0,1|2,0,0]=4 5571 B14R1.965 C#Cc1ccccc1NC(=O)CCC 11a_100011470550_100000211992 [0,1,0,0,0,1|2,0,0]=4 5572 B14R1.965 C#Cc1ccccc1NC(=O)CCC 1626a_100011470550_100000211992 [0,1,0,0,0,1|2,0,0]=4 5573 B14R1.965 C#Cc1ccccc1NC(=O)CCC 22a_100011470550_100000211992 [0,1,0,0,0,1|2,0,0]=4 5574 B14R1.965 C#Cc1ccccc1NC(=O)NCC 2430a_100011470550_100015525214 [0,1,0,0,0,1|2,0,0]=4 5575 B14R1.965 C=Cc1ccccc1CC(=O)NCC 271570a_100011290941_200009816148 [0,1,0,0,0,1|2,0,0]=4 5576 B14R1.965 C=Cc1ccccc1CC(=O)OCC 271570a_100011290941_100011218996 [0,1,0,0,0,1|1,0,0]=3 5577 B14R1.965 C=Cc1ccccc1NC(=O)CCC 11a_100012022501_100000211992 [0,1,0,0,0,1|2,0,0]=4 5578 B14R1.965 C=Cc1ccccc1NC(=O)CCC 1626a_100012022501_100000211992 [0,1,0,0,0,1|2,0,0]=4 5579 B14R1.965 C=Cc1ccccc1NC(=O)CCC 22a_100012022501_100000211992 [0,1,0,0,0,1|2,0,0]=4 5580 B14R1.965 C=Cc1ccccc1NC(=O)CCC 271570a_100011290941_100000153530 [0,1,0,0,0,1|2,0,0]=4 5581 B14R1.965 C=Cc1ccccc1NC(=O)NCC 2430a_100012022501_100015525214 [0,1,0,0,0,1|2,0,0]=4 5582 B14R1.965 C=Cc1cccnc1CC(=O)OCC 271570a_100011290941_100016306959 [0,1,0,0,0,1|2,0,0]=4 5583 B14R1.965 C=Cc1cnccc1CC(=O)OCC 271570a_100011290941_100010089795 [0,1,0,0,0,1|2,0,0]=4 5584 B14R1.965 C=Cc1ncccc1CC(=O)OCC 271570a_100011290941_100009886914 [0,1,0,0,0,1|2,0,0]=4 5585 B14R1.965 CC#CC(=O)Cc1ccccc1CO 1458a_100000763181_100009816955 [0,1,0,0,0,1|1,0,1]=4 5586 B14R1.965 CC#CC(=O)Cc1ccccc1OC 1458a_100000763181_100000210004 [0,1,0,0,0,1|1,0,1]=4 5587 B14R1.965 CC#CC(=O)Nc1ccccc1CO 22a_100000212039_100000763181 [0,1,0,0,0,1|1,0,1]=4 5588 B14R1.965 CC#CC(=O)Nc1ccccc1OC 22a_100000210025_100000763181 [0,1,0,0,0,1|1,0,1]=4 5589 B14R1.965 CC=CC(=O)Cc1ccccc1CO 1458a_100000210699_100009816955 [0,1,0,0,0,1|1,0,1]=4 5590 B14R1.965 CC=CC(=O)Cc1ccccc1OC 1458a_100000210699_100000210004 [0,1,0,0,0,1|1,0,1]=4 5591 B14R1.965 CC=CC(=O)Nc1ccccc1CO 22a_100000212039_100000210699 [0,1,0,0,0,1|1,0,1]=4 5592 B14R1.965 CC=CC(=O)Nc1ccccc1OC 11a_100000210025_100000210699 [0,1,0,0,0,1|1,0,1]=4 5593 B14R1.965 CC=CC(=O)Nc1ccccc1OC 1626a_100000210025_100000210699 [0,1,0,0,0,1|1,0,1]=4 5594 B14R1.965 CC=CC(=O)Nc1ccccc1OC 22a_100000210025_100000210699 [0,1,0,0,0,1|1,0,1]=4 5595 B14R1.965 CCCC(=O)Cc1ccccc1C#N 1458a_100000211992_100000181865 [0,1,0,0,0,1|2,0,0]=4 5596 B14R1.965 CCCC(=O)Cc1ccccc1C#N 1458a_100000238613_100000210303 [0,1,0,0,0,1|2,0,0]=4 5597 B14R1.965 CCCC(=O)Cc1ccccc1C=O 1458a_100000211992_200009853537 [0,1,0,0,0,1|1,0,1]=4 5598 B14R1.965 CCCC(=O)Cc1ccccc1CO 1458a_100000211992_100009816955 [0,1,0,0,0,1|1,0,0]=3 5599 B14R1.965 CCCC(=O)Cc1ccccc1OC 1458a_100000211604_100000210303 [0,1,0,0,0,1|1,0,0]=3 5600 B14R1.965 CCCC(=O)Cc1ccccc1OC 1458a_100000211992_100000210004 [0,1,0,0,0,1|1,0,0]=3 5601 B14R1.965 CCCC(=O)Cc1ccccc1SC 1458a_100000211992_100000699184 [0,1,0,0,0,1|1,1,0]=4 5602 B14R1.965 CCCC(=O)Cc1cccnc1OC 1458a_100000211992_100020631285 [0,1,0,0,0,1|2,0,0]=4 5603 B14R1.965 CCCC(=O)Cc1ccncc1OC 1458a_100000211992_100020635607 [0,1,0,0,0,1|2,0,0]=4 5604 B14R1.965 CCCC(=O)Nc1ccccc1C#N 11a_100000211148_100000211992 [0,1,0,0,0,1|2,0,0]=4 5605 B14R1.965 CCCC(=O)Nc1ccccc1C#N 1626a_100000211148_100000211992 [0,1,0,0,0,1|2,0,0]=4 5606 B14R1.965 CCCC(=O)Nc1ccccc1CC 11a_100000212081_100000211992 [0,1,0,0,0,1|2,0,0]=4 5607 B14R1.965 CCCC(=O)Nc1ccccc1CC 1626a_100000212081_100000211992 [0,1,0,0,0,1|2,0,0]=4 5608 B14R1.965 CCCC(=O)Nc1ccccc1CC 22a_100000212081_100000211992 [0,1,0,0,0,1|2,0,0]=4 5609 B14R1.965 CCCC(=O)Nc1ccccc1CC 527a_100000212081_100000211992 [0,1,0,0,0,1|2,0,0]=4 5610 B14R1.965 CCCC(=O)Nc1ccccc1CO 22a_100000212039_100000211992 [0,1,0,0,0,1|1,0,0]=3 5611 B14R1.965 CCCC(=O)Nc1ccccc1OC 11a_100000210025_100000211992 [0,1,0,0,0,1|1,0,0]=3 5612 B14R1.965 CCCC(=O)Nc1ccccc1OC 1626a_100000210025_100000211992 [0,1,0,0,0,1|1,0,0]=3 5613 B14R1.965 CCCC(=O)Nc1ccccc1OC 22a_100000210025_100000211992 [0,1,0,0,0,1|1,0,0]=3 5614 B14R1.965 CCCC(=O)Nc1ccccc1OC 527a_100000210025_100000211992 [0,1,0,0,0,1|1,0,0]=3 5615 B14R1.965 CCCC(=O)Nc1ccccc1SC 11a_100000211160_100000211992 [0,1,0,0,0,1|1,1,0]=4 5616 B14R1.965 CCCC(=O)Nc1ccccc1SC 22a_100000211160_100000211992 [0,1,0,0,0,1|1,1,0]=4 5617 B14R1.965 CCCC(=O)Nc1ccccc1SC 62a_200000210301_100000153530 [0,1,0,0,0,1|1,1,0]=4 5618 B14R1.965 CCCC(=O)Nc1ccccc1S[13CH3] 62a_200025704644_100000153530 [0,1,0,0,0,1|1,1,0]=4 5619 B14R1.965 CCNC(=O)Cc1ccccc1C#N 11a_100015525214_100000238613 [0,1,0,0,0,1|2,0,0]=4 5620 B14R1.965 CCNC(=O)Cc1ccccc1C#N 527a_100015525214_100000238613 [0,1,0,0,0,1|2,0,0]=4 5621 B14R1.965 CCNC(=O)Cc1ccccc1OC 11a_100015525214_100000211604 [0,1,0,0,0,1|1,0,0]=3 5622 B14R1.965 CCNC(=O)Cc1ccccc1OC 240690a_100015525214_100000211604 [0,1,0,0,0,1|1,0,0]=3 5623 B14R1.965 CCNC(=O)Cc1ccccc1OC 527a_100015525214_100000211604 [0,1,0,0,0,1|1,0,0]=3 5624 B14R1.965 CCNC(=O)Cc1ccccc1SC 62a_200000210301_200009816148 [0,1,0,0,0,1|1,1,0]=4 5625 B14R1.965 CCNC(=O)Cc1ccccc1SC 62a_200009816148_200000210301 [0,1,0,0,0,1|1,1,0]=4 5626 B14R1.965 CCNC(=O)Cc1ccccc1S[13CH3] 62a_200009816148_200025704644 [0,1,0,0,0,1|1,1,0]=4 5627 B14R1.965 CCNC(=O)Cc1ccccc1S[13CH3] 62a_200025704644_200009816148 [0,1,0,0,0,1|1,1,0]=4 5628 B14R1.965 CCNC(=O)Nc1ccccc1C#N 2430a_100000211148_100015525214 [0,1,0,0,0,1|2,0,0]=4 5629 B14R1.965 CCNC(=O)Nc1ccccc1CC 2430a_100000212081_100015525214 [0,1,0,0,0,1|2,0,0]=4 5630 B14R1.965 CCNC(=O)Nc1ccccc1OC 2430a_100000210025_100015525214 [0,1,0,0,0,1|1,0,0]=3 5631 B14R1.965 CCNC(=O)Nc1ccccc1SC 2430a_100000211160_100015525214 [0,1,0,0,0,1|1,1,0]=4 5632 B14R1.965 CCNC(=O)Nc1ccccc1SC 512a_100000211160_100015525214 [0,1,0,0,0,1|1,1,0]=4 5633 B14R1.965 CCOC(=O)Cc1ccccc1OC 7a_100011742756_200000210301 [0,1,0,0,0,1|0,0,0]=2 5634 B14R1.965 CCOC(=O)Cc1ccccc1O[13CH3] 7a_100011742756_200025704644 [0,1,0,0,0,1|0,0,0]=2 5635 B14R1.965 CCOC(=O)Cc1ccccc1SC 62a_100011218996_200000210301 [0,1,0,0,0,1|0,1,0]=3 5636 B14R1.965 CCOC(=O)Cc1ccccc1SC 62a_200000210301_100011218996 [0,1,0,0,0,1|0,1,0]=3 5637 B14R1.965 CCOC(=O)Cc1ccccc1S[13CH3] 62a_100011218996_200025704644 [0,1,0,0,0,1|0,1,0]=3 5638 B14R1.965 CCOC(=O)Cc1ccccc1S[13CH3] 62a_200025704644_100011218996 [0,1,0,0,0,1|0,1,0]=3 5639 B14R1.965 CCOC(=O)Cc1cccnc1SC 62a_100009886914_200000210301 [0,1,0,0,0,1|1,1,0]=4 5640 B14R1.965 CCOC(=O)Cc1cccnc1SC 62a_200000210301_100009886914 [0,1,0,0,0,1|1,1,0]=4 5641 B14R1.965 CCOC(=O)Cc1cccnc1S[13CH3] 62a_100009886914_200025704644 [0,1,0,0,0,1|1,1,0]=4 5642 B14R1.965 CCOC(=O)Cc1cccnc1S[13CH3] 62a_200025704644_100009886914 [0,1,0,0,0,1|1,1,0]=4 5643 B14R1.965 CCOC(=O)Cc1ccncc1SC 62a_100010089795_200000210301 [0,1,0,0,0,1|1,1,0]=4 5644 B14R1.965 CCOC(=O)Cc1ccncc1SC 62a_200000210301_100010089795 [0,1,0,0,0,1|1,1,0]=4 5645 B14R1.965 CCOC(=O)Cc1ccncc1S[13CH3] 62a_100010089795_200025704644 [0,1,0,0,0,1|1,1,0]=4 5646 B14R1.965 CCOC(=O)Cc1ccncc1S[13CH3] 62a_200025704644_100010089795 [0,1,0,0,0,1|1,1,0]=4 5647 B14R1.965 CCOC(=O)Cc1ncccc1SC 62a_100016306959_200000210301 [0,1,0,0,0,1|1,1,0]=4 5648 B14R1.965 CCOC(=O)Cc1ncccc1SC 62a_200000210301_100016306959 [0,1,0,0,0,1|1,1,0]=4 5649 B14R1.965 CCOC(=O)Cc1ncccc1S[13CH3] 62a_100016306959_200025704644 [0,1,0,0,0,1|1,1,0]=4 5650 B14R1.965 CCOC(=O)Cc1ncccc1S[13CH3] 62a_200025704644_100016306959 [0,1,0,0,0,1|1,1,0]=4 5651 B14R1.965 CCOC(C)Cc1ccccc1OC 7a_100000691916_100000210202 [0,1,0,0,0,1|1,0,1]=4 5652 B14R1.965 CCOC(C)Oc1ccccc1OC 34a_100000040939_200000210301 [0,1,0,0,0,1|1,0,1]=4 5653 B14R1.965 CCOC(C)Oc1ccccc1OC 7a_100000040939_200000210301 [0,1,0,0,0,1|1,0,1]=4 5654 B14R1.965 CCOC(C)Oc1ccccc1O[13CH3] 34a_100000040939_200025704644 [0,1,0,0,0,1|1,0,1]=4 5655 B14R1.965 CCOC(C)Oc1ccccc1O[13CH3] 7a_100000040939_200025704644 [0,1,0,0,0,1|1,0,1]=4 5656 B14R1.965 CNCC(=O)Nc1ccccc1OC 2230a_106832991635_100000182883 [0,1,0,0,0,1|2,0,0]=4 5657 B14R1.965 CNCC(=O)Nc1ccccc1OC 34a_100102657272_100000182883 [0,1,0,0,0,1|2,0,0]=4 5658 B14R1.965 CNCC(=O)Nc1ccccc1OC 7a_106832991635_100000182883 [0,1,0,0,0,1|2,0,0]=4 5659 B14R1.965 CNNC(=O)Cc1ccccc1OC 22a_100016993582_100000211604 [0,1,0,0,0,1|2,0,0]=4 5660 B14R1.965 COCC(=O)Cc1ccccc1CO 1458a_100000210968_100009816955 [0,1,0,0,0,1|2,0,0]=4 5661 B14R1.965 COCC(=O)Cc1ccccc1OC 1458a_100000210968_100000210004 [0,1,0,0,0,1|2,0,0]=4 5662 B14R1.965 COCC(=O)Nc1ccccc1CO 22a_100000212039_100000210968 [0,1,0,0,0,1|2,0,0]=4 5663 B14R1.965 COCC(=O)Nc1ccccc1OC 11a_100000210025_100000210968 [0,1,0,0,0,1|2,0,0]=4 5664 B14R1.965 COCC(=O)Nc1ccccc1OC 1626a_100000210025_100000210968 [0,1,0,0,0,1|2,0,0]=4 5665 B14R1.965 COCC(=O)Nc1ccccc1OC 22a_100000210025_100000210968 [0,1,0,0,0,1|2,0,0]=4 5666 B14R1.965 COCC(=O)Nc1ccccc1OC 34a_100138415774_100000182883 [0,1,0,0,0,1|2,0,0]=4 5667 B14R1.965 COCC(=O)Nc1ccccc1OC 527a_100000210025_100000210968 [0,1,0,0,0,1|2,0,0]=4 5668 B14R1.965 COc1ccccc1CC(=O)CCF 1458a_100000211604_100011217306 [0,1,0,0,0,1|2,0,0]=4 5669 B14R1.965 COc1ccccc1CC(=O)CCO 1458a_100000211604_100000211926 [0,1,0,0,0,1|2,0,0]=4 5670 B14R1.965 COc1ccccc1CC(=O)CCO 1458a_100011216618_100000210004 [0,1,0,0,0,1|2,0,0]=4 5671 B14R1.965 COc1ccccc1CC(=O)CSC 1458a_100000184570_100000210004 [0,1,0,0,0,1|2,0,0]=4 5672 B14R1.965 COc1ccccc1NC(=O)CCO 22a_100000210025_100011216618 [0,1,0,0,0,1|2,0,0]=4 5673 B14R1.965 COc1ccccc1NC(=O)CSC 11a_100000210025_100000184570 [0,1,0,0,0,1|2,0,0]=4 5674 B14R1.965 COc1ccccc1NC(=O)CSC 1626a_100000210025_100000184570 [0,1,0,0,0,1|2,0,0]=4 5675 B14R1.965 COc1ccccc1NC(=O)CSC 22a_100000210025_100000184570 [0,1,0,0,0,1|2,0,0]=4 5676 B14R1.965 COc1ccccc1NC(=O)CSC 527a_100000210025_100000184570 [0,1,0,0,0,1|2,0,0]=4 5677 B14R1.965 COc1ccccc1NC(=O)CSC 62a_200000210301_100000182883 [0,1,0,0,0,1|2,0,0]=4 5678 B14R1.965 COc1ccccc1NC(=O)CSC 62a_200000243729_200000210301 [0,1,0,0,0,1|2,0,0]=4 5679 B14R1.965 COc1ccccc1NC(=O)CS[13CH3] 62a_200000243729_200025704644 [0,1,0,0,0,1|2,0,0]=4 5680 B14R1.965 COc1ccccc1NC(=O)CS[13CH3] 62a_200025704644_100000182883 [0,1,0,0,0,1|2,0,0]=4 5681 B14R1.965 CSCC(=O)Cc1ccccc1CO 1458a_100000184570_100009816955 [0,1,0,0,0,1|2,0,0]=4 5682 B14R1.965 CSCC(=O)Nc1ccccc1CO 22a_100000212039_100000184570 [0,1,0,0,0,1|2,0,0]=4 5683 B14R1.965 O=C(CCO)Cc1ccccc1CO 1458a_100011216618_100009816955 [0,1,0,0,0,1|2,0,0]=4 5684 B14R1.965 O=C(CCO)Nc1ccccc1CO 22a_100000212039_100011216618 [0,1,0,0,0,1|2,0,0]=4 5685 B14R1.1007 C/C=C(\C)/C(=O)Nc1ccccc1O 22a_100000185747_100020587367 [0,1,0,0,0,1|1,0,1]=4 5686 B14R1.1007 C=C(CO)C(=O)Nc1ccccc1O 22a_100000185747_200000705526 [0,1,0,0,0,1|2,0,0]=4 5687 B14R1.1007 CCC(=O)C(=O)Nc1ccccc1C 1458a_200011297352_100000210202 [0,1,0,0,0,1|2,0,0]=4 5688 B14R1.1007 CCC(=O)C(=O)Nc1ccccc1F 1458a_200011297310_100000210202 [0,1,0,0,0,1|2,0,0]=4 5689 B14R1.1007 CCC(C)C(=O)Cc1ccccc1Br 1458a_100000751119_100000758301 [0,1,0,0,0,1|2,0,0]=4 5690 B14R1.1007 CCC(C)C(=O)Cc1ccccc1Br 1458a_100011192722_100000184730 [0,1,0,0,0,1|2,0,0]=4 5691 B14R1.1007 CCC(C)C(=O)Cc1ccccc1C 1458a_100000212180_100000758301 [0,1,0,0,0,1|2,0,0]=4 5692 B14R1.1007 CCC(C)C(=O)Cc1ccccc1C 1458a_100011192722_100000211839 [0,1,0,0,0,1|2,0,0]=4 5693 B14R1.1007 CCC(C)C(=O)Cc1ccccc1Cl 1458a_100000183793_100000758301 [0,1,0,0,0,1|2,0,0]=4 5694 B14R1.1007 CCC(C)C(=O)Cc1ccccc1Cl 1458a_100011192722_100000187162 [0,1,0,0,0,1|2,0,0]=4 5695 B14R1.1007 CCC(C)C(=O)Cc1ccccc1F 1458a_100000212012_100000758301 [0,1,0,0,0,1|2,0,0]=4 5696 B14R1.1007 CCC(C)C(=O)Cc1ccccc1F 1458a_100011192722_100000187165 [0,1,0,0,0,1|2,0,0]=4 5697 B14R1.1007 CCC(C)C(=O)Cc1ccccc1I 1458a_100000036491_100000758301 [0,1,0,0,0,1|2,0,0]=4 5698 B14R1.1007 CCC(C)C(=O)Cc1ccccc1I 1458a_100011192722_100011216222 [0,1,0,0,0,1|2,0,0]=4 5699 B14R1.1007 CCC(C)C(=O)Cc1ccccc1O 1458a_100000743006_100000758301 [0,1,0,0,0,1|1,0,0]=3 5700 B14R1.1007 CCC(C)C(=O)Cc1ncccc1O 1458a_100011192722_200020655725 [0,1,0,0,0,1|2,0,0]=4 5701 B14R1.1007 CCC(C)C(=O)Nc1ccccc1Br 11a_100000210017_100011192722 [0,1,0,0,0,1|2,0,0]=4 5702 B14R1.1007 CCC(C)C(=O)Nc1ccccc1Br 1626a_100000210017_100011192722 [0,1,0,0,0,1|2,0,0]=4 5703 B14R1.1007 CCC(C)C(=O)Nc1ccccc1C 11a_100015192222_100011192722 [0,1,0,0,0,1|2,0,0]=4 5704 B14R1.1007 CCC(C)C(=O)Nc1ccccc1C 1626a_100015192222_100011192722 [0,1,0,0,0,1|2,0,0]=4 5705 B14R1.1007 CCC(C)C(=O)Nc1ccccc1C 22a_100015192222_100011192722 [0,1,0,0,0,1|2,0,0]=4 5706 B14R1.1007 CCC(C)C(=O)Nc1ccccc1C 527a_100015192222_100011192722 [0,1,0,0,0,1|2,0,0]=4 5707 B14R1.1007 CCC(C)C(=O)Nc1ccccc1Cl 11a_100000185783_100011192722 [0,1,0,0,0,1|2,0,0]=4 5708 B14R1.1007 CCC(C)C(=O)Nc1ccccc1Cl 1626a_100000185783_100011192722 [0,1,0,0,0,1|2,0,0]=4 5709 B14R1.1007 CCC(C)C(=O)Nc1ccccc1Cl 22a_100000185783_100011192722 [0,1,0,0,0,1|2,0,0]=4 5710 B14R1.1007 CCC(C)C(=O)Nc1ccccc1Cl 527a_100000185783_100011192722 [0,1,0,0,0,1|2,0,0]=4 5711 B14R1.1007 CCC(C)C(=O)Nc1ccccc1F 11a_100000210422_100011192722 [0,1,0,0,0,1|2,0,0]=4 5712 B14R1.1007 CCC(C)C(=O)Nc1ccccc1F 1626a_100000210422_100011192722 [0,1,0,0,0,1|2,0,0]=4 5713 B14R1.1007 CCC(C)C(=O)Nc1ccccc1F 22a_100000210422_100011192722 [0,1,0,0,0,1|2,0,0]=4 5714 B14R1.1007 CCC(C)C(=O)Nc1ccccc1F 527a_100000210422_100011192722 [0,1,0,0,0,1|2,0,0]=4 5715 B14R1.1007 CCC(C)C(=O)Nc1ccccc1I 11a_100000210053_100011192722 [0,1,0,0,0,1|2,0,0]=4 5716 B14R1.1007 CCC(C)C(=O)Nc1ccccc1I 1626a_100000210053_100011192722 [0,1,0,0,0,1|2,0,0]=4 5717 B14R1.1007 CCC(C)C(=O)Nc1ccccc1O 22a_100000185747_100011192722 [0,1,0,0,0,1|1,0,0]=3 5718 B14R1.1007 CCC(C)C(=O)Nc1ccccc1O 527a_100000185747_100011192722 [0,1,0,0,0,1|1,0,0]=3 5719 B14R1.1007 CCC(O)C(=O)Cc1ccccc1Br 1458a_100011196387_100000184730 [0,1,0,0,0,1|2,0,0]=4 5720 B14R1.1007 CCC(O)C(=O)Cc1ccccc1C 1458a_100011196387_100000211839 [0,1,0,0,0,1|2,0,0]=4 5721 B14R1.1007 CCC(O)C(=O)Cc1ccccc1Cl 1458a_100011196387_100000187162 [0,1,0,0,0,1|2,0,0]=4 5722 B14R1.1007 CCC(O)C(=O)Cc1ccccc1F 1458a_100011196387_100000187165 [0,1,0,0,0,1|2,0,0]=4 5723 B14R1.1007 CCC(O)C(=O)Cc1ccccc1I 1458a_100011196387_100011216222 [0,1,0,0,0,1|2,0,0]=4 5724 B14R1.1007 CCC(O)C(=O)Cc1ncccc1O 1458a_100011196387_200020655725 [0,1,0,0,0,1|2,0,0]=4 5725 B14R1.1007 CCC(O)C(=O)Nc1ccccc1C 22a_100015192222_100011196387 [0,1,0,0,0,1|2,0,0]=4 5726 B14R1.1007 CCC(O)C(=O)Nc1ccccc1Cl 22a_100000185783_100011196387 [0,1,0,0,0,1|2,0,0]=4 5727 B14R1.1007 CCC(O)C(=O)Nc1ccccc1F 22a_100000210422_100011196387 [0,1,0,0,0,1|2,0,0]=4 5728 B14R1.1007 CCC(O)C(=O)Nc1ccccc1O 22a_100000185747_100011196387 [0,1,0,0,0,1|1,0,0]=3 5729 B14R1.1007 CCN(C)C(=O)Cc1ccccc1Br 11a_100000225621_100000751119 [0,1,0,0,0,1|2,0,0]=4 5730 B14R1.1007 CCN(C)C(=O)Cc1ccccc1Br 240690a_100000225621_100000751119 [0,1,0,0,0,1|2,0,0]=4 5731 B14R1.1007 CCN(C)C(=O)Cc1ccccc1Br 527a_100000225621_100000751119 [0,1,0,0,0,1|2,0,0]=4 5732 B14R1.1007 CCN(C)C(=O)Cc1ccccc1C 11a_100000225621_100000212180 [0,1,0,0,0,1|2,0,0]=4 5733 B14R1.1007 CCN(C)C(=O)Cc1ccccc1C 1626a_100000225621_100000212180 [0,1,0,0,0,1|2,0,0]=4 5734 B14R1.1007 CCN(C)C(=O)Cc1ccccc1C 240690a_100000225621_100000212180 [0,1,0,0,0,1|2,0,0]=4 5735 B14R1.1007 CCN(C)C(=O)Cc1ccccc1C 527a_100000225621_100000212180 [0,1,0,0,0,1|2,0,0]=4 5736 B14R1.1007 CCN(C)C(=O)Cc1ccccc1Cl 11a_100000225621_100000183793 [0,1,0,0,0,1|2,0,0]=4 5737 B14R1.1007 CCN(C)C(=O)Cc1ccccc1Cl 1626a_100000225621_100000183793 [0,1,0,0,0,1|2,0,0]=4 5738 B14R1.1007 CCN(C)C(=O)Cc1ccccc1Cl 240690a_100000225621_100000183793 [0,1,0,0,0,1|2,0,0]=4 5739 B14R1.1007 CCN(C)C(=O)Cc1ccccc1Cl 527a_100000225621_100000183793 [0,1,0,0,0,1|2,0,0]=4 5740 B14R1.1007 CCN(C)C(=O)Cc1ccccc1F 11a_100000225621_100000212012 [0,1,0,0,0,1|2,0,0]=4 5741 B14R1.1007 CCN(C)C(=O)Cc1ccccc1F 1626a_100000225621_100000212012 [0,1,0,0,0,1|2,0,0]=4 5742 B14R1.1007 CCN(C)C(=O)Cc1ccccc1F 240690a_100000225621_100000212012 [0,1,0,0,0,1|2,0,0]=4 5743 B14R1.1007 CCN(C)C(=O)Cc1ccccc1F 527a_100000225621_100000212012 [0,1,0,0,0,1|2,0,0]=4 5744 B14R1.1007 CCN(C)C(=O)Cc1ccccc1I 11a_100000225621_100000036491 [0,1,0,0,0,1|2,0,0]=4 5745 B14R1.1007 CCN(C)C(=O)Cc1ccccc1I 1626a_100000225621_100000036491 [0,1,0,0,0,1|2,0,0]=4 5746 B14R1.1007 CCN(C)C(=O)Cc1ccccc1I 240690a_100000225621_100000036491 [0,1,0,0,0,1|2,0,0]=4 5747 B14R1.1007 CCN(C)C(=O)Cc1ccccc1I 527a_100000225621_100000036491 [0,1,0,0,0,1|2,0,0]=4 5748 B14R1.1007 CCN(C)C(=O)Cc1ccccc1O 240690a_100000225621_100000743006 [0,1,0,0,0,1|1,0,0]=3 5749 B14R1.1007 CCN(C)C(=O)Cc1ccccc1O 527a_100000225621_100000743006 [0,1,0,0,0,1|1,0,0]=3 5750 B14R1.1007 CCN(C)C(=O)Nc1ccccc1Br 2430a_100000210017_100000225621 [0,1,0,0,0,1|2,0,0]=4 5751 B14R1.1007 CCN(C)C(=O)Nc1ccccc1C 2430a_100015192222_100000225621 [0,1,0,0,0,1|2,0,0]=4 5752 B14R1.1007 CCN(C)C(=O)Nc1ccccc1Cl 2430a_100000185783_100000225621 [0,1,0,0,0,1|2,0,0]=4 5753 B14R1.1007 CCN(C)C(=O)Nc1ccccc1F 2430a_100000210422_100000225621 [0,1,0,0,0,1|2,0,0]=4 5754 B14R1.1007 CCN(C)C(=O)Nc1ccccc1I 2430a_100000210053_100000225621 [0,1,0,0,0,1|2,0,0]=4 5755 B14R1.1007 CCN(C)C(=O)Nc1ccccc1O 2430a_100000185747_100000225621 [0,1,0,0,0,1|1,0,0]=3 5756 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1O 22a_100000185747_100011218921 [0,1,0,0,0,1|2,0,0]=4 5757 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1O 527a_100000185747_100011218921 [0,1,0,0,0,1|2,0,0]=4 5758 B14R1.1007 COC(=O)C(=O)Nc1ccccc1O 527a_100000185747_100000024059 [0,1,0,0,0,1|2,0,0]=4 5759 B14R1.1007 COC(C)C(=O)Nc1ccccc1O 22a_100000185747_100000743197 [0,1,0,0,0,1|2,0,0]=4 5760 B14R1.1007 COC(C)C(=O)Nc1ccccc1O 527a_100000185747_100000743197 [0,1,0,0,0,1|2,0,0]=4 5761 B14R1.1007 CSC(C)C(=O)Nc1ccccc1O 22a_100000185747_100000149566 [0,1,0,0,0,1|2,0,0]=4 5762 B14R1.1007 CSC(C)C(=O)Nc1ccccc1O 527a_100000185747_100000149566 [0,1,0,0,0,1|2,0,0]=4 5763 B14R1.1007 O=C(Nc1ccccc1O)C(O)CO 22a_100000185747_100011215603 [0,1,0,0,0,1|2,0,0]=4 5764 B14R1.3348 CC#CC(=O)N(C)c1ccccc1O 22a_100000033821_100000763181 [0,1,0,0,0,1|1,0,1]=4 5765 B14R1.3348 CC=CC(=O)N(C)c1ccccc1O 22a_100000033821_100000210699 [0,1,0,0,0,1|1,0,1]=4 5766 B14R1.3348 CCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000210303 [0,1,0,0,0,1|2,0,0]=4 5767 B14R1.3348 CCCC(=O)C(C)c1ccccc1Cl 1458a_100000211992_100000181259 [0,1,0,0,0,1|2,0,0]=4 5768 B14R1.3348 CCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000210303 [0,1,0,0,0,1|2,0,0]=4 5769 B14R1.3348 CCCC(=O)C(C)c1ccccc1F 1458a_100000211992_200000741388 [0,1,0,0,0,1|2,0,0]=4 5770 B14R1.3348 CCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000210303 [0,1,0,0,0,1|2,0,0]=4 5771 B14R1.3348 CCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000210303 [0,1,0,0,0,1|2,0,0]=4 5772 B14R1.3348 CCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000210303 [0,1,0,0,0,1|2,0,0]=4 5773 B14R1.3348 CCCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000211992 [0,1,0,0,0,1|2,0,0]=4 5774 B14R1.3348 CCCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000211992 [0,1,0,0,0,1|2,0,0]=4 5775 B14R1.3348 CCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000211992 [0,1,0,0,0,1|2,0,0]=4 5776 B14R1.3348 CCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000211992 [0,1,0,0,0,1|2,0,0]=4 5777 B14R1.3348 CCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000211992 [0,1,0,0,0,1|2,0,0]=4 5778 B14R1.3348 CCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000211992 [0,1,0,0,0,1|2,0,0]=4 5779 B14R1.3348 CCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000211992 [0,1,0,0,0,1|2,0,0]=4 5780 B14R1.3348 CCCC(=O)N(C)c1ccccc1F 11a_100000220357_100000211992 [0,1,0,0,0,1|2,0,0]=4 5781 B14R1.3348 CCCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000211992 [0,1,0,0,0,1|2,0,0]=4 5782 B14R1.3348 CCCC(=O)N(C)c1ccccc1F 22a_100000220357_100000211992 [0,1,0,0,0,1|2,0,0]=4 5783 B14R1.3348 CCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000211992 [0,1,0,0,0,1|1,0,0]=3 5784 B14R1.3348 CCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000211992 [0,1,0,0,0,1|1,0,0]=3 5785 B14R1.3348 CCNC(=O)C(C)c1ccccc1Br 11a_100015525214_100012359601 [0,1,0,0,0,1|2,0,0]=4 5786 B14R1.3348 CCNC(=O)C(C)c1ccccc1Br 240690a_100015525214_100012359601 [0,1,0,0,0,1|2,0,0]=4 5787 B14R1.3348 CCNC(=O)C(C)c1ccccc1Br 527a_100015525214_100012359601 [0,1,0,0,0,1|2,0,0]=4 5788 B14R1.3348 CCNC(=O)C(C)c1ccccc1Cl 11a_100015525214_100011667492 [0,1,0,0,0,1|2,0,0]=4 5789 B14R1.3348 CCNC(=O)C(C)c1ccccc1Cl 240690a_100015525214_100011667492 [0,1,0,0,0,1|2,0,0]=4 5790 B14R1.3348 CCNC(=O)C(C)c1ccccc1Cl 527a_100015525214_100011667492 [0,1,0,0,0,1|2,0,0]=4 5791 B14R1.3348 CCNC(=O)C(O)c1ccccc1Br 240690a_100015525214_200011356456 [0,1,0,0,0,1|2,0,0]=4 5792 B14R1.3348 CCNC(=O)C(O)c1ccccc1Cl 240690a_100015525214_100011217820 [0,1,0,0,0,1|2,0,0]=4 5793 B14R1.3348 CCNC(=O)C(O)c1ccccc1F 240690a_100015525214_100011219519 [0,1,0,0,0,1|2,0,0]=4 5794 B14R1.3348 CCNC(=O)N(C)c1ccccc1Br 512a_100015525214_100020606079 [0,1,0,0,0,1|2,0,0]=4 5795 B14R1.3348 CCNC(=O)N(C)c1ccccc1C 512a_100015525214_100000219699 [0,1,0,0,0,1|2,0,0]=4 5796 B14R1.3348 CCNC(=O)N(C)c1ccccc1Cl 512a_100015525214_100000219374 [0,1,0,0,0,1|2,0,0]=4 5797 B14R1.3348 CN(C(=O)CCO)c1ccccc1O 22a_100000033821_100011216618 [0,1,0,0,0,1|2,0,0]=4 5798 B14R1.3348 COCC(=O)N(C)c1ccccc1O 22a_100000033821_100000210968 [0,1,0,0,0,1|2,0,0]=4 5799 B14R1.3348 COCC(=O)N(C)c1ccccc1O 527a_100000033821_100000210968 [0,1,0,0,0,1|2,0,0]=4 5800 B14R1.3348 CSCC(=O)N(C)c1ccccc1O 22a_100000033821_100000184570 [0,1,0,0,0,1|2,0,0]=4 5801 B14R1.3348 CSCC(=O)N(C)c1ccccc1O 527a_100000033821_100000184570 [0,1,0,0,0,1|2,0,0]=4 5802 B14R1.6823 CC#CC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000763181 [0,1,0,0,0,1|1,0,1]=4 5803 B14R1.6823 CC#CC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000763181 [0,1,0,0,0,1|1,0,1]=4 5804 B14R1.6823 CC#CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000763181 [0,1,0,0,0,1|1,0,1]=4 5805 B14R1.6823 CC#CC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000763181 [0,1,0,0,0,1|1,0,1]=4 5806 B14R1.6823 CC#CC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000763181 [0,1,0,0,0,1|1,0,1]=4 5807 B14R1.6823 CC#CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000763181 [0,1,0,0,0,1|1,0,1]=4 5808 B14R1.6823 CC=CC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000210699 [0,1,0,0,0,1|1,0,1]=4 5809 B14R1.6823 CC=CC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000210699 [0,1,0,0,0,1|1,0,1]=4 5810 B14R1.6823 CC=CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000210699 [0,1,0,0,0,1|1,0,1]=4 5811 B14R1.6823 CC=CC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000210699 [0,1,0,0,0,1|1,0,1]=4 5812 B14R1.6823 CC=CC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000210699 [0,1,0,0,0,1|1,0,1]=4 5813 B14R1.6823 CC=CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000210699 [0,1,0,0,0,1|1,0,1]=4 5814 B14R1.6823 CCCC(=O)Cc1ccc(cc1Br)Br 1458a_100000211992_200012351560 [0,1,0,0,0,1|2,0,0]=4 5815 B14R1.6823 CCCC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100000210303 [0,1,0,0,0,1|2,0,0]=4 5816 B14R1.6823 CCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000211992_100000755608 [0,1,0,0,0,1|2,0,0]=4 5817 B14R1.6823 CCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000210303 [0,1,0,0,0,1|2,0,0]=4 5818 B14R1.6823 CCCC(=O)Cc1ccc(cc1Br)F 1458a_100000211992_100000243222 [0,1,0,0,0,1|2,0,0]=4 5819 B14R1.6823 CCCC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100000210303 [0,1,0,0,0,1|2,0,0]=4 5820 B14R1.6823 CCCC(=O)Cc1ccc(cc1Br)I 1458a_100000211992_100010146610 [0,1,0,0,0,1|2,0,0]=4 5821 B14R1.6823 CCCC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000210303 [0,1,0,0,0,1|2,0,0]=4 5822 B14R1.6823 CCCC(=O)Cc1ccc(cc1C)Br 1458a_100000211992_100000708836 [0,1,0,0,0,1|2,0,0]=4 5823 B14R1.6823 CCCC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_100000210303 [0,1,0,0,0,1|2,0,0]=4 5824 B14R1.6823 CCCC(=O)Cc1ccc(cc1C)C 1458a_100000211992_100011219618 [0,1,0,0,0,1|2,0,0]=4 5825 B14R1.6823 CCCC(=O)Cc1ccc(cc1C)C 1458a_100011236500_100000210303 [0,1,0,0,0,1|2,0,0]=4 5826 B14R1.6823 CCCC(=O)Cc1ccc(cc1C)Cl 1458a_100000211992_100012361307 [0,1,0,0,0,1|2,0,0]=4 5827 B14R1.6823 CCCC(=O)Cc1ccc(cc1C)F 1458a_100000211992_100000700533 [0,1,0,0,0,1|2,0,0]=4 5828 B14R1.6823 CCCC(=O)Cc1ccc(cc1C)F 1458a_100011667441_100000210303 [0,1,0,0,0,1|2,0,0]=4 5829 B14R1.6823 CCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000211992_100011740631 [0,1,0,0,0,1|2,0,0]=4 5830 B14R1.6823 CCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000210303 [0,1,0,0,0,1|2,0,0]=4 5831 B14R1.6823 CCCC(=O)Cc1ccc(cc1Cl)C 1458a_100000211992_100012349684 [0,1,0,0,0,1|2,0,0]=4 5832 B14R1.6823 CCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000210303 [0,1,0,0,0,1|2,0,0]=4 5833 B14R1.6823 CCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000211992_100000188473 [0,1,0,0,0,1|2,0,0]=4 5834 B14R1.6823 CCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000211992_100011216360 [0,1,0,0,0,1|2,0,0]=4 5835 B14R1.6823 CCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100000210303 [0,1,0,0,0,1|2,0,0]=4 5836 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)Br 1458a_100000211992_100000211606 [0,1,0,0,0,1|2,0,0]=4 5837 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100000210303 [0,1,0,0,0,1|2,0,0]=4 5838 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)C 1458a_100000042674_100000210303 [0,1,0,0,0,1|2,0,0]=4 5839 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)C 1458a_100000211992_100012002367 [0,1,0,0,0,1|2,0,0]=4 5840 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)Cl 1458a_100000211992_100000709361 [0,1,0,0,0,1|2,0,0]=4 5841 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100000210303 [0,1,0,0,0,1|2,0,0]=4 5842 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)F 1458a_100000211992_100000748237 [0,1,0,0,0,1|2,0,0]=4 5843 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100000210303 [0,1,0,0,0,1|2,0,0]=4 5844 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)I 1458a_100000211992_100010244991 [0,1,0,0,0,1|2,0,0]=4 5845 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100000210303 [0,1,0,0,0,1|2,0,0]=4 5846 B14R1.6823 CCCC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000210303 [0,1,0,0,0,1|2,0,0]=4 5847 B14R1.6823 CCCC(=O)Cc1ccc(cc1I)Br 1458a_100000211992_100010146615 [0,1,0,0,0,1|2,0,0]=4 5848 B14R1.6823 CCCC(=O)Cc1ccc(cc1I)Cl 1458a_100000211992_100010254388 [0,1,0,0,0,1|2,0,0]=4 5849 B14R1.6823 CCCC(=O)Cc1ccc(cc1I)F 1458a_100000211992_100012354799 [0,1,0,0,0,1|2,0,0]=4 5850 B14R1.6823 CCCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000210303 [0,1,0,0,0,1|1,0,0]=3 5851 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)Br 11a_100000211012_100000211992 [0,1,0,0,0,1|2,0,0]=4 5852 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)Br 1626a_100000211012_100000211992 [0,1,0,0,0,1|2,0,0]=4 5853 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100000211992 [0,1,0,0,0,1|2,0,0]=4 5854 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100000211992 [0,1,0,0,0,1|2,0,0]=4 5855 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100000211992 [0,1,0,0,0,1|2,0,0]=4 5856 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100000211992 [0,1,0,0,0,1|2,0,0]=4 5857 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)F 11a_100000738039_100000211992 [0,1,0,0,0,1|2,0,0]=4 5858 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)F 1626a_100000738039_100000211992 [0,1,0,0,0,1|2,0,0]=4 5859 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)I 11a_100000750455_100000211992 [0,1,0,0,0,1|2,0,0]=4 5860 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)I 1626a_100000750455_100000211992 [0,1,0,0,0,1|2,0,0]=4 5861 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000211992 [0,1,0,0,0,1|2,0,0]=4 5862 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100000211992 [0,1,0,0,0,1|2,0,0]=4 5863 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)Br 11a_100000211769_100000211992 [0,1,0,0,0,1|2,0,0]=4 5864 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)Br 1626a_100000211769_100000211992 [0,1,0,0,0,1|2,0,0]=4 5865 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)Br 22a_100000211769_100000211992 [0,1,0,0,0,1|2,0,0]=4 5866 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)C 11a_100000736561_100000211992 [0,1,0,0,0,1|2,0,0]=4 5867 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100000211992 [0,1,0,0,0,1|2,0,0]=4 5868 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000211992 [0,1,0,0,0,1|2,0,0]=4 5869 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)C 527a_100000736561_100000211992 [0,1,0,0,0,1|2,0,0]=4 5870 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100000211992 [0,1,0,0,0,1|2,0,0]=4 5871 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100000211992 [0,1,0,0,0,1|2,0,0]=4 5872 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000211992 [0,1,0,0,0,1|2,0,0]=4 5873 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)F 11a_100000211637_100000211992 [0,1,0,0,0,1|2,0,0]=4 5874 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)F 1626a_100000211637_100000211992 [0,1,0,0,0,1|2,0,0]=4 5875 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)F 22a_100000211637_100000211992 [0,1,0,0,0,1|2,0,0]=4 5876 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)F 527a_100000211637_100000211992 [0,1,0,0,0,1|2,0,0]=4 5877 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)I 11a_100000184554_100000211992 [0,1,0,0,0,1|2,0,0]=4 5878 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)I 1626a_100000184554_100000211992 [0,1,0,0,0,1|2,0,0]=4 5879 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)I 22a_100000184554_100000211992 [0,1,0,0,0,1|2,0,0]=4 5880 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000211992 [0,1,0,0,0,1|2,0,0]=4 5881 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)O 527a_100000756630_100000211992 [0,1,0,0,0,1|2,0,0]=4 5882 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100000211992 [0,1,0,0,0,1|2,0,0]=4 5883 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100000211992 [0,1,0,0,0,1|2,0,0]=4 5884 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000211992 [0,1,0,0,0,1|2,0,0]=4 5885 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000211992 [0,1,0,0,0,1|2,0,0]=4 5886 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000211992 [0,1,0,0,0,1|2,0,0]=4 5887 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100000211992 [0,1,0,0,0,1|2,0,0]=4 5888 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100000211992 [0,1,0,0,0,1|2,0,0]=4 5889 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000211992 [0,1,0,0,0,1|2,0,0]=4 5890 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100000211992 [0,1,0,0,0,1|2,0,0]=4 5891 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100000211992 [0,1,0,0,0,1|2,0,0]=4 5892 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000211992 [0,1,0,0,0,1|2,0,0]=4 5893 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100000211992 [0,1,0,0,0,1|2,0,0]=4 5894 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100000211992 [0,1,0,0,0,1|2,0,0]=4 5895 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000211992 [0,1,0,0,0,1|2,0,0]=4 5896 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000211992 [0,1,0,0,0,1|2,0,0]=4 5897 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100000211992 [0,1,0,0,0,1|2,0,0]=4 5898 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)Br 11a_100000210722_100000211992 [0,1,0,0,0,1|2,0,0]=4 5899 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)Br 1626a_100000210722_100000211992 [0,1,0,0,0,1|2,0,0]=4 5900 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)Br 22a_100000210722_100000211992 [0,1,0,0,0,1|2,0,0]=4 5901 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)C 11a_100000211023_100000211992 [0,1,0,0,0,1|2,0,0]=4 5902 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100000211992 [0,1,0,0,0,1|2,0,0]=4 5903 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000211992 [0,1,0,0,0,1|2,0,0]=4 5904 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)C 527a_100000211023_100000211992 [0,1,0,0,0,1|2,0,0]=4 5905 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100000211992 [0,1,0,0,0,1|2,0,0]=4 5906 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100000211992 [0,1,0,0,0,1|2,0,0]=4 5907 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000211992 [0,1,0,0,0,1|2,0,0]=4 5908 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)F 11a_100000210720_100000211992 [0,1,0,0,0,1|2,0,0]=4 5909 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)F 1626a_100000210720_100000211992 [0,1,0,0,0,1|2,0,0]=4 5910 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)F 22a_100000210720_100000211992 [0,1,0,0,0,1|2,0,0]=4 5911 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)I 11a_100011215594_100000211992 [0,1,0,0,0,1|2,0,0]=4 5912 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)I 1626a_100011215594_100000211992 [0,1,0,0,0,1|2,0,0]=4 5913 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)I 22a_100011215594_100000211992 [0,1,0,0,0,1|2,0,0]=4 5914 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000211992 [0,1,0,0,0,1|2,0,0]=4 5915 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)O 527a_100000759473_100000211992 [0,1,0,0,0,1|2,0,0]=4 5916 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)Br 11a_100000187925_100000211992 [0,1,0,0,0,1|2,0,0]=4 5917 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)Br 1626a_100000187925_100000211992 [0,1,0,0,0,1|2,0,0]=4 5918 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)C 11a_100011356834_100000211992 [0,1,0,0,0,1|2,0,0]=4 5919 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100000211992 [0,1,0,0,0,1|2,0,0]=4 5920 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100000211992 [0,1,0,0,0,1|2,0,0]=4 5921 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100000211992 [0,1,0,0,0,1|2,0,0]=4 5922 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)F 11a_100000760547_100000211992 [0,1,0,0,0,1|2,0,0]=4 5923 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)F 1626a_100000760547_100000211992 [0,1,0,0,0,1|2,0,0]=4 5924 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)F 22a_100000760547_100000211992 [0,1,0,0,0,1|2,0,0]=4 5925 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)I 11a_100010002754_100000211992 [0,1,0,0,0,1|2,0,0]=4 5926 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)I 1626a_100010002754_100000211992 [0,1,0,0,0,1|2,0,0]=4 5927 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000211992 [0,1,0,0,0,1|2,0,0]=4 5928 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)O 527a_100010084370_100000211992 [0,1,0,0,0,1|2,0,0]=4 5929 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000211992 [0,1,0,0,0,1|1,0,0]=3 5930 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000211992 [0,1,0,0,0,1|1,0,0]=3 5931 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000211992 [0,1,0,0,0,1|1,0,0]=3 5932 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000211992 [0,1,0,0,0,1|1,0,0]=3 5933 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000211992 [0,1,0,0,0,1|1,0,0]=3 5934 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000211992 [0,1,0,0,0,1|1,0,0]=3 5935 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000211992 [0,1,0,0,0,1|1,0,0]=3 5936 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000211992 [0,1,0,0,0,1|1,0,0]=3 5937 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000211992 [0,1,0,0,0,1|1,0,0]=3 5938 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000211992 [0,1,0,0,0,1|1,0,0]=3 5939 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000211992 [0,1,0,0,0,1|1,0,0]=3 5940 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000211992 [0,1,0,0,0,1|1,0,0]=3 5941 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)Br 11a_100015525214_100010172832 [0,1,0,0,0,1|2,0,0]=4 5942 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)Br 240690a_100015525214_100010172832 [0,1,0,0,0,1|2,0,0]=4 5943 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)Br 527a_100015525214_100010172832 [0,1,0,0,0,1|2,0,0]=4 5944 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)Cl 11a_100015525214_100000755479 [0,1,0,0,0,1|2,0,0]=4 5945 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)Cl 240690a_100015525214_100000755479 [0,1,0,0,0,1|2,0,0]=4 5946 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)Cl 527a_100015525214_100000755479 [0,1,0,0,0,1|2,0,0]=4 5947 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)F 11a_100015525214_100000708238 [0,1,0,0,0,1|2,0,0]=4 5948 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)F 240690a_100015525214_100000708238 [0,1,0,0,0,1|2,0,0]=4 5949 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)F 527a_100015525214_100000708238 [0,1,0,0,0,1|2,0,0]=4 5950 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)O 240690a_100015525214_100010176083 [0,1,0,0,0,1|2,0,0]=4 5951 B14R1.6823 CCNC(=O)Cc1ccc(cc1Br)O 527a_100015525214_100010176083 [0,1,0,0,0,1|2,0,0]=4 5952 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)Br 11a_100015525214_100000697930 [0,1,0,0,0,1|2,0,0]=4 5953 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)Br 240690a_100015525214_100000697930 [0,1,0,0,0,1|2,0,0]=4 5954 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)Br 527a_100015525214_100000697930 [0,1,0,0,0,1|2,0,0]=4 5955 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)C 11a_100015525214_100011236500 [0,1,0,0,0,1|2,0,0]=4 5956 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)C 240690a_100015525214_100011236500 [0,1,0,0,0,1|2,0,0]=4 5957 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)C 527a_100015525214_100011236500 [0,1,0,0,0,1|2,0,0]=4 5958 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)F 11a_100015525214_100011667441 [0,1,0,0,0,1|2,0,0]=4 5959 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)F 240690a_100015525214_100011667441 [0,1,0,0,0,1|2,0,0]=4 5960 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)F 527a_100015525214_100011667441 [0,1,0,0,0,1|2,0,0]=4 5961 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Br 11a_100015525214_100012361378 [0,1,0,0,0,1|2,0,0]=4 5962 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Br 240690a_100015525214_100012361378 [0,1,0,0,0,1|2,0,0]=4 5963 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Br 527a_100015525214_100012361378 [0,1,0,0,0,1|2,0,0]=4 5964 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Cl 11a_100015525214_100000210926 [0,1,0,0,0,1|2,0,0]=4 5965 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100015525214_100000210926 [0,1,0,0,0,1|2,0,0]=4 5966 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Cl 527a_100015525214_100000210926 [0,1,0,0,0,1|2,0,0]=4 5967 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)F 11a_100015525214_100000690284 [0,1,0,0,0,1|2,0,0]=4 5968 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)F 240690a_100015525214_100000690284 [0,1,0,0,0,1|2,0,0]=4 5969 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)F 527a_100015525214_100000690284 [0,1,0,0,0,1|2,0,0]=4 5970 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)Br 11a_100015525214_100011295475 [0,1,0,0,0,1|2,0,0]=4 5971 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)Br 240690a_100015525214_100011295475 [0,1,0,0,0,1|2,0,0]=4 5972 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)Br 527a_100015525214_100011295475 [0,1,0,0,0,1|2,0,0]=4 5973 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)C 11a_100015525214_100000042674 [0,1,0,0,0,1|2,0,0]=4 5974 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)C 240690a_100015525214_100000042674 [0,1,0,0,0,1|2,0,0]=4 5975 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)C 527a_100015525214_100000042674 [0,1,0,0,0,1|2,0,0]=4 5976 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)Cl 11a_100015525214_100011830378 [0,1,0,0,0,1|2,0,0]=4 5977 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)Cl 240690a_100015525214_100011830378 [0,1,0,0,0,1|2,0,0]=4 5978 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)Cl 527a_100015525214_100011830378 [0,1,0,0,0,1|2,0,0]=4 5979 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)F 11a_100015525214_100000684719 [0,1,0,0,0,1|2,0,0]=4 5980 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)F 240690a_100015525214_100000684719 [0,1,0,0,0,1|2,0,0]=4 5981 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)F 527a_100015525214_100000684719 [0,1,0,0,0,1|2,0,0]=4 5982 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)I 11a_100015525214_100010149628 [0,1,0,0,0,1|2,0,0]=4 5983 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)I 240690a_100015525214_100010149628 [0,1,0,0,0,1|2,0,0]=4 5984 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)I 527a_100015525214_100010149628 [0,1,0,0,0,1|2,0,0]=4 5985 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)O 240690a_100015525214_100000090534 [0,1,0,0,0,1|2,0,0]=4 5986 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)O 527a_100015525214_100000090534 [0,1,0,0,0,1|2,0,0]=4 5987 B14R1.6823 CCNC(=O)Cc1ccc(cc1O)Br 240690a_100015525214_100000707504 [0,1,0,0,0,1|1,0,0]=3 5988 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)Br 2430a_100000211012_100015525214 [0,1,0,0,0,1|2,0,0]=4 5989 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)C 2430a_100000210942_100015525214 [0,1,0,0,0,1|2,0,0]=4 5990 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)Cl 2430a_100000752454_100015525214 [0,1,0,0,0,1|2,0,0]=4 5991 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)F 2430a_100000738039_100015525214 [0,1,0,0,0,1|2,0,0]=4 5992 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)I 2430a_100000750455_100015525214 [0,1,0,0,0,1|2,0,0]=4 5993 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)O 2430a_100012001276_100015525214 [0,1,0,0,0,1|2,0,0]=4 5994 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)Br 2430a_100000211769_100015525214 [0,1,0,0,0,1|2,0,0]=4 5995 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)C 2430a_100000736561_100015525214 [0,1,0,0,0,1|2,0,0]=4 5996 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)Cl 2430a_100000210418_100015525214 [0,1,0,0,0,1|2,0,0]=4 5997 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)F 2430a_100000211637_100015525214 [0,1,0,0,0,1|2,0,0]=4 5998 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)I 2430a_100000184554_100015525214 [0,1,0,0,0,1|2,0,0]=4 5999 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)O 2430a_100000756630_100015525214 [0,1,0,0,0,1|2,0,0]=4 6000 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100015525214 [0,1,0,0,0,1|2,0,0]=4 6001 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100015525214 [0,1,0,0,0,1|2,0,0]=4 6002 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100015525214 [0,1,0,0,0,1|2,0,0]=4 6003 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100015525214 [0,1,0,0,0,1|2,0,0]=4 6004 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100015525214 [0,1,0,0,0,1|2,0,0]=4 6005 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100015525214 [0,1,0,0,0,1|2,0,0]=4 6006 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)Br 2430a_100000210722_100015525214 [0,1,0,0,0,1|2,0,0]=4 6007 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)C 2430a_100000211023_100015525214 [0,1,0,0,0,1|2,0,0]=4 6008 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)Cl 2430a_100000211020_100015525214 [0,1,0,0,0,1|2,0,0]=4 6009 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)F 2430a_100000210720_100015525214 [0,1,0,0,0,1|2,0,0]=4 6010 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)I 2430a_100011215594_100015525214 [0,1,0,0,0,1|2,0,0]=4 6011 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)O 2430a_100000759473_100015525214 [0,1,0,0,0,1|2,0,0]=4 6012 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)C 2430a_100011356834_100015525214 [0,1,0,0,0,1|2,0,0]=4 6013 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)Cl 2430a_100000761889_100015525214 [0,1,0,0,0,1|2,0,0]=4 6014 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)F 2430a_100000760547_100015525214 [0,1,0,0,0,1|2,0,0]=4 6015 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)I 2430a_100010002754_100015525214 [0,1,0,0,0,1|2,0,0]=4 6016 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)I 512a_100010002754_100015525214 [0,1,0,0,0,1|2,0,0]=4 6017 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)O 2430a_100010084370_100015525214 [0,1,0,0,0,1|2,0,0]=4 6018 B14R1.6823 CCNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100015525214 [0,1,0,0,0,1|1,0,0]=3 6019 B14R1.6823 CCNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100015525214 [0,1,0,0,0,1|1,0,0]=3 6020 B14R1.6823 CCNC(=O)Nc1ccc(cc1O)F 2430a_100000753323_100015525214 [0,1,0,0,0,1|1,0,0]=3 6021 B14R1.6823 CCNC(=O)Nc1ccc(cc1O)I 2430a_100000057187_100015525214 [0,1,0,0,0,1|1,0,0]=3 6022 B14R1.6823 CCNC(=O)Nc1ccc(cc1O)O 2430a_100000106777_100015525214 [0,1,0,0,0,1|1,0,0]=3 6023 B14R1.6823 CCOC(=O)Cc1ccc(cc1F)O 271570a_203496583355_200012359708 [0,1,0,0,0,1|1,0,0]=3 6024 B14R1.6823 CCOC(=O)Cc1ccc(cc1O)F 271570a_203496583355_200012558204 [0,1,0,0,0,1|0,0,0]=2 6025 B14R1.6823 CNNC(=O)Cc1ccc(cc1O)Br 22a_100016993582_100000707504 [0,1,0,0,0,1|2,0,0]=4 6026 B14R1.6823 COCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000210968 [0,1,0,0,0,1|2,0,0]=4 6027 B14R1.6823 COCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000210968 [0,1,0,0,0,1|2,0,0]=4 6028 B14R1.6823 COCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000210968 [0,1,0,0,0,1|2,0,0]=4 6029 B14R1.6823 COCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000210968 [0,1,0,0,0,1|2,0,0]=4 6030 B14R1.6823 COCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000210968 [0,1,0,0,0,1|2,0,0]=4 6031 B14R1.6823 COCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000210968 [0,1,0,0,0,1|2,0,0]=4 6032 B14R1.6823 COCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000210968 [0,1,0,0,0,1|2,0,0]=4 6033 B14R1.6823 COCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000210968 [0,1,0,0,0,1|2,0,0]=4 6034 B14R1.6823 COCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000210968 [0,1,0,0,0,1|2,0,0]=4 6035 B14R1.6823 COCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000210968 [0,1,0,0,0,1|2,0,0]=4 6036 B14R1.6823 COCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000210968 [0,1,0,0,0,1|2,0,0]=4 6037 B14R1.6823 COCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000210968 [0,1,0,0,0,1|2,0,0]=4 6038 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000184570 [0,1,0,0,0,1|2,0,0]=4 6039 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000184570 [0,1,0,0,0,1|2,0,0]=4 6040 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000184570 [0,1,0,0,0,1|2,0,0]=4 6041 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000184570 [0,1,0,0,0,1|2,0,0]=4 6042 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000184570 [0,1,0,0,0,1|2,0,0]=4 6043 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000184570 [0,1,0,0,0,1|2,0,0]=4 6044 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000184570 [0,1,0,0,0,1|2,0,0]=4 6045 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000184570 [0,1,0,0,0,1|2,0,0]=4 6046 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000184570 [0,1,0,0,0,1|2,0,0]=4 6047 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000184570 [0,1,0,0,0,1|2,0,0]=4 6048 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000184570 [0,1,0,0,0,1|2,0,0]=4 6049 B14R1.6823 CSCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000184570 [0,1,0,0,0,1|2,0,0]=4 6050 B14R1.6823 Cc1ccc(c(c1)O)NC(=O)CCO 22a_100000211527_100011216618 [0,1,0,0,0,1|2,0,0]=4 6051 B14R1.6823 O=C(CCF)Cc1ccc(cc1O)Br 1458a_100000707504_100011217306 [0,1,0,0,0,1|2,0,0]=4 6052 B14R1.6823 O=C(CCO)Cc1ccc(cc1O)Br 1458a_100000707504_100000211926 [0,1,0,0,0,1|2,0,0]=4 6053 B14R1.6823 O=C(CCO)Nc1ccc(cc1O)Br 22a_100000739049_100011216618 [0,1,0,0,0,1|2,0,0]=4 6054 B14R1.6823 O=C(CCO)Nc1ccc(cc1O)Cl 22a_100000185728_100011216618 [0,1,0,0,0,1|2,0,0]=4 6055 B14R1.6823 O=C(CCO)Nc1ccc(cc1O)F 22a_100000753323_100011216618 [0,1,0,0,0,1|2,0,0]=4 6056 B14R1.6823 O=C(CCO)Nc1ccc(cc1O)I 22a_100000057187_100011216618 [0,1,0,0,0,1|2,0,0]=4 6057 B14R1.6823 O=C(CCO)Nc1ccc(cc1O)O 22a_100000106777_100011216618 [0,1,0,0,0,1|2,0,0]=4 6058 B14R1.19171 CC#CC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000763181 [0,1,0,0,0,1|1,0,1]=4 6059 B14R1.19171 CC#CC(=O)Nc1c(cccc1F)O 22a_100020591140_100000763181 [0,1,0,0,0,1|1,0,1]=4 6060 B14R1.19171 CC#CC(=O)Nc1c(cccc1I)O 22a_200000049512_100000763181 [0,1,0,0,0,1|1,0,1]=4 6061 B14R1.19171 CC#CC(=O)Nc1c(cccc1O)C 22a_100000743429_100000763181 [0,1,0,0,0,1|1,0,1]=4 6062 B14R1.19171 CC#CC(=O)Nc1c(cccc1O)O 22a_100011995820_100000763181 [0,1,0,0,0,1|1,0,1]=4 6063 B14R1.19171 CC=CC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000210699 [0,1,0,0,0,1|1,0,1]=4 6064 B14R1.19171 CC=CC(=O)Nc1c(cccc1F)O 22a_100020591140_100000210699 [0,1,0,0,0,1|1,0,1]=4 6065 B14R1.19171 CC=CC(=O)Nc1c(cccc1I)O 22a_200000049512_100000210699 [0,1,0,0,0,1|1,0,1]=4 6066 B14R1.19171 CC=CC(=O)Nc1c(cccc1O)C 22a_100000743429_100000210699 [0,1,0,0,0,1|1,0,1]=4 6067 B14R1.19171 CC=CC(=O)Nc1c(cccc1O)O 22a_100011995820_100000210699 [0,1,0,0,0,1|1,0,1]=4 6068 B14R1.19171 CCCC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_100000210303 [0,1,0,0,0,1|2,0,0]=4 6069 B14R1.19171 CCCC(=O)Cc1c(cccc1Br)C 1458a_100000211992_100010146847 [0,1,0,0,0,1|2,0,0]=4 6070 B14R1.19171 CCCC(=O)Cc1c(cccc1Br)C 1458a_100010147022_100000210303 [0,1,0,0,0,1|2,0,0]=4 6071 B14R1.19171 CCCC(=O)Cc1c(cccc1Br)Cl 1458a_100000211992_100010138402 [0,1,0,0,0,1|2,0,0]=4 6072 B14R1.19171 CCCC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_100000210303 [0,1,0,0,0,1|2,0,0]=4 6073 B14R1.19171 CCCC(=O)Cc1c(cccc1Br)F 1458a_100000211992_100000696636 [0,1,0,0,0,1|2,0,0]=4 6074 B14R1.19171 CCCC(=O)Cc1c(cccc1Br)F 1458a_100010172741_100000210303 [0,1,0,0,0,1|2,0,0]=4 6075 B14R1.19171 CCCC(=O)Cc1c(cccc1C)C 1458a_100000211992_100000758300 [0,1,0,0,0,1|2,0,0]=4 6076 B14R1.19171 CCCC(=O)Cc1c(cccc1C)C 1458a_100000689862_100000210303 [0,1,0,0,0,1|2,0,0]=4 6077 B14R1.19171 CCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000210303 [0,1,0,0,0,1|2,0,0]=4 6078 B14R1.19171 CCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211992_100000187851 [0,1,0,0,0,1|2,0,0]=4 6079 B14R1.19171 CCCC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_100000210303 [0,1,0,0,0,1|2,0,0]=4 6080 B14R1.19171 CCCC(=O)Cc1c(cccc1Cl)F 1458a_100000211992_100000187852 [0,1,0,0,0,1|2,0,0]=4 6081 B14R1.19171 CCCC(=O)Cc1c(cccc1F)C 1458a_100000211992_100009814554 [0,1,0,0,0,1|2,0,0]=4 6082 B14R1.19171 CCCC(=O)Cc1c(cccc1F)F 1458a_100000211992_100000698325 [0,1,0,0,0,1|2,0,0]=4 6083 B14R1.19171 CCCC(=O)Cc1c(cccc1F)F 1458a_100000684726_100000210303 [0,1,0,0,0,1|2,0,0]=4 6084 B14R1.19171 CCCC(=O)Cc1c(cccc1I)Br 1458a_100000211992_100010146611 [0,1,0,0,0,1|2,0,0]=4 6085 B14R1.19171 CCCC(=O)Cc1c(cccc1I)C 1458a_100000211992_100010150146 [0,1,0,0,0,1|2,0,0]=4 6086 B14R1.19171 CCCC(=O)Cc1c(cccc1I)F 1458a_100000211992_100010149602 [0,1,0,0,0,1|2,0,0]=4 6087 B14R1.19171 CCCC(=O)Nc1c(cccc1Br)Br 1626a_100000690995_100000211992 [0,1,0,0,0,1|2,0,0]=4 6088 B14R1.19171 CCCC(=O)Nc1c(cccc1Br)C 11a_100011834072_100000211992 [0,1,0,0,0,1|2,0,0]=4 6089 B14R1.19171 CCCC(=O)Nc1c(cccc1Br)C 1626a_100011834072_100000211992 [0,1,0,0,0,1|2,0,0]=4 6090 B14R1.19171 CCCC(=O)Nc1c(cccc1Br)Cl 11a_100102946385_100000211992 [0,1,0,0,0,1|2,0,0]=4 6091 B14R1.19171 CCCC(=O)Nc1c(cccc1Br)Cl 1626a_100102946385_100000211992 [0,1,0,0,0,1|2,0,0]=4 6092 B14R1.19171 CCCC(=O)Nc1c(cccc1Br)F 11a_100000684712_100000211992 [0,1,0,0,0,1|2,0,0]=4 6093 B14R1.19171 CCCC(=O)Nc1c(cccc1Br)F 1626a_100000684712_100000211992 [0,1,0,0,0,1|2,0,0]=4 6094 B14R1.19171 CCCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000211992 [0,1,0,0,0,1|1,0,0]=3 6095 B14R1.19171 CCCC(=O)Nc1c(cccc1C)C 11a_100000185769_100000211992 [0,1,0,0,0,1|2,0,0]=4 6096 B14R1.19171 CCCC(=O)Nc1c(cccc1C)C 1626a_100000185769_100000211992 [0,1,0,0,0,1|2,0,0]=4 6097 B14R1.19171 CCCC(=O)Nc1c(cccc1C)C 22a_100000185769_100000211992 [0,1,0,0,0,1|2,0,0]=4 6098 B14R1.19171 CCCC(=O)Nc1c(cccc1Cl)C 11a_100000756524_100000211992 [0,1,0,0,0,1|2,0,0]=4 6099 B14R1.19171 CCCC(=O)Nc1c(cccc1Cl)C 1626a_100000756524_100000211992 [0,1,0,0,0,1|2,0,0]=4 6100 B14R1.19171 CCCC(=O)Nc1c(cccc1Cl)Cl 11a_100000210028_100000211992 [0,1,0,0,0,1|2,0,0]=4 6101 B14R1.19171 CCCC(=O)Nc1c(cccc1Cl)Cl 1626a_100000210028_100000211992 [0,1,0,0,0,1|2,0,0]=4 6102 B14R1.19171 CCCC(=O)Nc1c(cccc1Cl)F 11a_100000760031_100000211992 [0,1,0,0,0,1|2,0,0]=4 6103 B14R1.19171 CCCC(=O)Nc1c(cccc1Cl)F 1626a_100000760031_100000211992 [0,1,0,0,0,1|2,0,0]=4 6104 B14R1.19171 CCCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000211992 [0,1,0,0,0,1|1,0,0]=3 6105 B14R1.19171 CCCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000211992 [0,1,0,0,0,1|1,0,0]=3 6106 B14R1.19171 CCCC(=O)Nc1c(cccc1F)C 11a_100000766463_100000211992 [0,1,0,0,0,1|2,0,0]=4 6107 B14R1.19171 CCCC(=O)Nc1c(cccc1F)C 1626a_100000766463_100000211992 [0,1,0,0,0,1|2,0,0]=4 6108 B14R1.19171 CCCC(=O)Nc1c(cccc1F)C 22a_100000766463_100000211992 [0,1,0,0,0,1|2,0,0]=4 6109 B14R1.19171 CCCC(=O)Nc1c(cccc1F)F 11a_100000210704_100000211992 [0,1,0,0,0,1|2,0,0]=4 6110 B14R1.19171 CCCC(=O)Nc1c(cccc1F)F 1626a_100000210704_100000211992 [0,1,0,0,0,1|2,0,0]=4 6111 B14R1.19171 CCCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000211992 [0,1,0,0,0,1|1,0,0]=3 6112 B14R1.19171 CCCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000211992 [0,1,0,0,0,1|1,0,0]=3 6113 B14R1.19171 CCCC(=O)Nc1c(cccc1I)Br 11a_100010146558_100000211992 [0,1,0,0,0,1|2,0,0]=4 6114 B14R1.19171 CCCC(=O)Nc1c(cccc1I)Br 1626a_100010146558_100000211992 [0,1,0,0,0,1|2,0,0]=4 6115 B14R1.19171 CCCC(=O)Nc1c(cccc1I)Cl 11a_100010190421_100000211992 [0,1,0,0,0,1|2,0,0]=4 6116 B14R1.19171 CCCC(=O)Nc1c(cccc1I)Cl 1626a_100010190421_100000211992 [0,1,0,0,0,1|2,0,0]=4 6117 B14R1.19171 CCCC(=O)Nc1c(cccc1I)F 11a_100000042321_100000211992 [0,1,0,0,0,1|2,0,0]=4 6118 B14R1.19171 CCCC(=O)Nc1c(cccc1I)F 1626a_100000042321_100000211992 [0,1,0,0,0,1|2,0,0]=4 6119 B14R1.19171 CCCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000211992 [0,1,0,0,0,1|1,0,0]=3 6120 B14R1.19171 CCCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000211992 [0,1,0,0,0,1|1,0,0]=3 6121 B14R1.19171 CCCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000211992 [0,1,0,0,0,1|1,0,0]=3 6122 B14R1.19171 CCCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000211992 [0,1,0,0,0,1|1,0,0]=3 6123 B14R1.19171 CCCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000211992 [0,1,0,0,0,1|1,0,0]=3 6124 B14R1.19171 CCCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000211992 [0,1,0,0,0,1|1,0,0]=3 6125 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Br 11a_100015525214_100010209379 [0,1,0,0,0,1|2,0,0]=4 6126 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Br 240690a_100015525214_100010209379 [0,1,0,0,0,1|2,0,0]=4 6127 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Br 527a_100015525214_100010209379 [0,1,0,0,0,1|2,0,0]=4 6128 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)C 11a_100015525214_100010147022 [0,1,0,0,0,1|2,0,0]=4 6129 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)C 240690a_100015525214_100010147022 [0,1,0,0,0,1|2,0,0]=4 6130 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)C 527a_100015525214_100010147022 [0,1,0,0,0,1|2,0,0]=4 6131 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Cl 11a_100015525214_100013084675 [0,1,0,0,0,1|2,0,0]=4 6132 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Cl 240690a_100015525214_100013084675 [0,1,0,0,0,1|2,0,0]=4 6133 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Cl 527a_100015525214_100013084675 [0,1,0,0,0,1|2,0,0]=4 6134 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)F 11a_100015525214_100010172741 [0,1,0,0,0,1|2,0,0]=4 6135 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)F 240690a_100015525214_100010172741 [0,1,0,0,0,1|2,0,0]=4 6136 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)F 527a_100015525214_100010172741 [0,1,0,0,0,1|2,0,0]=4 6137 B14R1.19171 CCNC(=O)Cc1c(cccc1C)C 11a_100015525214_100000689862 [0,1,0,0,0,1|2,0,0]=4 6138 B14R1.19171 CCNC(=O)Cc1c(cccc1C)C 240690a_100015525214_100000689862 [0,1,0,0,0,1|2,0,0]=4 6139 B14R1.19171 CCNC(=O)Cc1c(cccc1C)C 527a_100015525214_100000689862 [0,1,0,0,0,1|2,0,0]=4 6140 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)Cl 11a_100015525214_100000211232 [0,1,0,0,0,1|2,0,0]=4 6141 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)Cl 240690a_100015525214_100000211232 [0,1,0,0,0,1|2,0,0]=4 6142 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)Cl 527a_100015525214_100000211232 [0,1,0,0,0,1|2,0,0]=4 6143 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)F 11a_100015525214_100000185183 [0,1,0,0,0,1|2,0,0]=4 6144 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)F 240690a_100015525214_100000185183 [0,1,0,0,0,1|2,0,0]=4 6145 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)F 527a_100015525214_100000185183 [0,1,0,0,0,1|2,0,0]=4 6146 B14R1.19171 CCNC(=O)Cc1c(cccc1F)F 11a_100015525214_100000684726 [0,1,0,0,0,1|2,0,0]=4 6147 B14R1.19171 CCNC(=O)Cc1c(cccc1F)F 240690a_100015525214_100000684726 [0,1,0,0,0,1|2,0,0]=4 6148 B14R1.19171 CCNC(=O)Cc1c(cccc1F)F 527a_100015525214_100000684726 [0,1,0,0,0,1|2,0,0]=4 6149 B14R1.19171 CCNC(=O)Nc1c(cccc1Br)C 2430a_100011834072_100015525214 [0,1,0,0,0,1|2,0,0]=4 6150 B14R1.19171 CCNC(=O)Nc1c(cccc1Br)Cl 2430a_100102946385_100015525214 [0,1,0,0,0,1|2,0,0]=4 6151 B14R1.19171 CCNC(=O)Nc1c(cccc1C)C 2430a_100000185769_100015525214 [0,1,0,0,0,1|2,0,0]=4 6152 B14R1.19171 CCNC(=O)Nc1c(cccc1C)C 512a_100015525214_100000185769 [0,1,0,0,0,1|2,0,0]=4 6153 B14R1.19171 CCNC(=O)Nc1c(cccc1Cl)C 2430a_100000756524_100015525214 [0,1,0,0,0,1|2,0,0]=4 6154 B14R1.19171 CCNC(=O)Nc1c(cccc1Cl)F 2430a_100000760031_100015525214 [0,1,0,0,0,1|2,0,0]=4 6155 B14R1.19171 CCNC(=O)Nc1c(cccc1F)C 2430a_100000766463_100015525214 [0,1,0,0,0,1|2,0,0]=4 6156 B14R1.19171 CCNC(=O)Nc1c(cccc1F)F 2430a_100000210704_100015525214 [0,1,0,0,0,1|2,0,0]=4 6157 B14R1.19171 CCNC(=O)Nc1c(cccc1F)O 2430a_100020591140_100015525214 [0,1,0,0,0,1|1,0,0]=3 6158 B14R1.19171 CCNC(=O)Nc1c(cccc1I)Br 512a_100010146558_100015525214 [0,1,0,0,0,1|2,0,0]=4 6159 B14R1.19171 CCNC(=O)Nc1c(cccc1I)F 2430a_100000042321_100015525214 [0,1,0,0,0,1|2,0,0]=4 6160 B14R1.19171 CCNC(=O)Nc1c(cccc1O)C 2430a_100000743429_100015525214 [0,1,0,0,0,1|1,0,0]=3 6161 B14R1.19171 COCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000210968 [0,1,0,0,0,1|2,0,0]=4 6162 B14R1.19171 COCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000210968 [0,1,0,0,0,1|2,0,0]=4 6163 B14R1.19171 COCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000210968 [0,1,0,0,0,1|2,0,0]=4 6164 B14R1.19171 COCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000210968 [0,1,0,0,0,1|2,0,0]=4 6165 B14R1.19171 COCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000210968 [0,1,0,0,0,1|2,0,0]=4 6166 B14R1.19171 COCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000210968 [0,1,0,0,0,1|2,0,0]=4 6167 B14R1.19171 COCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000210968 [0,1,0,0,0,1|2,0,0]=4 6168 B14R1.19171 COCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000210968 [0,1,0,0,0,1|2,0,0]=4 6169 B14R1.19171 COCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000210968 [0,1,0,0,0,1|2,0,0]=4 6170 B14R1.19171 COCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000210968 [0,1,0,0,0,1|2,0,0]=4 6171 B14R1.19171 COCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000210968 [0,1,0,0,0,1|2,0,0]=4 6172 B14R1.19171 CSCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000184570 [0,1,0,0,0,1|2,0,0]=4 6173 B14R1.19171 CSCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000184570 [0,1,0,0,0,1|2,0,0]=4 6174 B14R1.19171 CSCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000184570 [0,1,0,0,0,1|2,0,0]=4 6175 B14R1.19171 CSCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000184570 [0,1,0,0,0,1|2,0,0]=4 6176 B14R1.19171 CSCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000184570 [0,1,0,0,0,1|2,0,0]=4 6177 B14R1.19171 CSCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000184570 [0,1,0,0,0,1|2,0,0]=4 6178 B14R1.19171 CSCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000184570 [0,1,0,0,0,1|2,0,0]=4 6179 B14R1.19171 CSCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000184570 [0,1,0,0,0,1|2,0,0]=4 6180 B14R1.19171 CSCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000184570 [0,1,0,0,0,1|2,0,0]=4 6181 B14R1.19171 CSCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000184570 [0,1,0,0,0,1|2,0,0]=4 6182 B14R1.19171 CSCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000184570 [0,1,0,0,0,1|2,0,0]=4 6183 B14R1.19171 Cc1cccc(c1NC(=O)CCO)O 22a_100000743429_100011216618 [0,1,0,0,0,1|2,0,0]=4 6184 B14R1.19171 O=C(CCO)Nc1c(cccc1Cl)O 22a_100012022510_100011216618 [0,1,0,0,0,1|2,0,0]=4 6185 B14R1.19171 O=C(CCO)Nc1c(cccc1F)O 22a_100020591140_100011216618 [0,1,0,0,0,1|2,0,0]=4 6186 B14R1.19171 O=C(CCO)Nc1c(cccc1I)O 22a_200000049512_100011216618 [0,1,0,0,0,1|2,0,0]=4 6187 B14R1.19171 O=C(CCO)Nc1c(cccc1O)O 22a_100011995820_100011216618 [0,1,0,0,0,1|2,0,0]=4 6188 B14R1.16 C#CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000753159 [0,2,0,0,0,0|1,0,1]=4 6189 B14R1.16 C#CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000753159 [0,2,0,0,0,0|1,0,1]=4 6190 B14R1.16 C#CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000753159 [0,2,0,0,0,0|1,0,1]=4 6191 B14R1.16 C#CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000753159 [0,2,0,0,0,0|1,0,1]=4 6192 B14R1.16 C#CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000753159 [0,2,0,0,0,0|1,0,1]=4 6193 B14R1.16 C#CCNC(=O)c1cccc(c1O)Br 240690a_100000212058_100000752940 [0,2,0,0,0,0|1,0,1]=4 6194 B14R1.16 C#CCNC(=O)c1cccc(c1O)Br 527a_100000212058_100000752940 [0,2,0,0,0,0|1,0,1]=4 6195 B14R1.16 C#CCNC(=O)c1cccc(c1O)C 240690a_100000212058_100000183896 [0,2,0,0,0,0|1,0,1]=4 6196 B14R1.16 C#CCNC(=O)c1cccc(c1O)C 527a_100000212058_100000183896 [0,2,0,0,0,0|1,0,1]=4 6197 B14R1.16 C#CCNC(=O)c1cccc(c1O)Cl 240690a_100000212058_100000742801 [0,2,0,0,0,0|1,0,1]=4 6198 B14R1.16 C#CCNC(=O)c1cccc(c1O)Cl 527a_100000212058_100000742801 [0,2,0,0,0,0|1,0,1]=4 6199 B14R1.16 C#CCNC(=O)c1cccc(c1O)F 240690a_100000212058_100011217230 [0,2,0,0,0,0|1,0,1]=4 6200 B14R1.16 C#CCNC(=O)c1cccc(c1O)F 527a_100000212058_100011217230 [0,2,0,0,0,0|1,0,1]=4 6201 B14R1.16 C#CCNC(=O)c1cccc(c1O)O 527a_100000212058_100000690420 [0,2,0,0,0,0|1,0,1]=4 6202 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)Br 1458a_100000752940_100102629194 [0,2,0,0,0,0|1,0,1]=4 6203 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)C 1458a_100000183896_100102629194 [0,2,0,0,0,0|1,0,1]=4 6204 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100102629194 [0,2,0,0,0,0|1,0,1]=4 6205 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)F 1458a_100011217230_100102629194 [0,2,0,0,0,0|1,0,1]=4 6206 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)O 1458a_100000690420_100102629194 [0,2,0,0,0,0|1,0,1]=4 6207 B14R1.16 C=CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000754431 [0,2,0,0,0,0|1,0,1]=4 6208 B14R1.16 C=CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000754431 [0,2,0,0,0,0|1,0,1]=4 6209 B14R1.16 C=CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000754431 [0,2,0,0,0,0|1,0,1]=4 6210 B14R1.16 C=CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000754431 [0,2,0,0,0,0|1,0,1]=4 6211 B14R1.16 C=CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000754431 [0,2,0,0,0,0|1,0,1]=4 6212 B14R1.16 C=CCNC(=O)c1cccc(c1O)Br 240690a_100020586998_100000752940 [0,2,0,0,0,0|1,0,1]=4 6213 B14R1.16 C=CCNC(=O)c1cccc(c1O)Br 527a_100020586998_100000752940 [0,2,0,0,0,0|1,0,1]=4 6214 B14R1.16 C=CCNC(=O)c1cccc(c1O)C 240690a_100020586998_100000183896 [0,2,0,0,0,0|1,0,1]=4 6215 B14R1.16 C=CCNC(=O)c1cccc(c1O)C 527a_100020586998_100000183896 [0,2,0,0,0,0|1,0,1]=4 6216 B14R1.16 C=CCNC(=O)c1cccc(c1O)Cl 240690a_100020586998_100000742801 [0,2,0,0,0,0|1,0,1]=4 6217 B14R1.16 C=CCNC(=O)c1cccc(c1O)Cl 527a_100020586998_100000742801 [0,2,0,0,0,0|1,0,1]=4 6218 B14R1.16 C=CCNC(=O)c1cccc(c1O)F 240690a_100020586998_100011217230 [0,2,0,0,0,0|1,0,1]=4 6219 B14R1.16 C=CCNC(=O)c1cccc(c1O)F 527a_100020586998_100011217230 [0,2,0,0,0,0|1,0,1]=4 6220 B14R1.16 C=CCNC(=O)c1cccc(c1O)O 527a_100020586998_100000690420 [0,2,0,0,0,0|1,0,1]=4 6221 B14R1.16 CC#CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000748600 [0,2,0,0,0,0|1,0,1]=4 6222 B14R1.16 CC#CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000748600 [0,2,0,0,0,0|1,0,1]=4 6223 B14R1.16 CC#CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000748600 [0,2,0,0,0,0|1,0,1]=4 6224 B14R1.16 CC#CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000748600 [0,2,0,0,0,0|1,0,1]=4 6225 B14R1.16 CC#CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000748600 [0,2,0,0,0,0|1,0,1]=4 6226 B14R1.16 CC=CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000070051 [0,2,0,0,0,0|1,0,1]=4 6227 B14R1.16 CC=CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000070051 [0,2,0,0,0,0|1,0,1]=4 6228 B14R1.16 CC=CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000070051 [0,2,0,0,0,0|1,0,1]=4 6229 B14R1.16 CC=CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000070051 [0,2,0,0,0,0|1,0,1]=4 6230 B14R1.16 CC=CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000070051 [0,2,0,0,0,0|1,0,1]=4 6231 B14R1.16 CCCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210211 [0,2,0,0,0,0|2,0,0]=4 6232 B14R1.16 CCCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210211 [0,2,0,0,0,0|2,0,0]=4 6233 B14R1.16 CCCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210211 [0,2,0,0,0,0|2,0,0]=4 6234 B14R1.16 CCCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210211 [0,2,0,0,0,0|2,0,0]=4 6235 B14R1.16 CCCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210211 [0,2,0,0,0,0|2,0,0]=4 6236 B14R1.16 CCCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210211 [0,2,0,0,0,0|2,0,0]=4 6237 B14R1.16 CCCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210211 [0,2,0,0,0,0|2,0,0]=4 6238 B14R1.16 CCCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210211 [0,2,0,0,0,0|2,0,0]=4 6239 B14R1.16 CCCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210211 [0,2,0,0,0,0|2,0,0]=4 6240 B14R1.16 CCCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210211 [0,2,0,0,0,0|2,0,0]=4 6241 B14R1.16 CCCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210211 [0,2,0,0,0,0|2,0,0]=4 6242 B14R1.16 CCCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210211 [0,2,0,0,0,0|2,0,0]=4 6243 B14R1.16 CCCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210211 [0,2,0,0,0,0|2,0,0]=4 6244 B14R1.16 CCCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210211 [0,2,0,0,0,0|2,0,0]=4 6245 B14R1.16 CCCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210211 [0,2,0,0,0,0|2,0,0]=4 6246 B14R1.16 CCCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210211 [0,2,0,0,0,0|2,0,0]=4 6247 B14R1.16 CCCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210211 [0,2,0,0,0,0|2,0,0]=4 6248 B14R1.16 CCCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210211 [0,2,0,0,0,0|2,0,0]=4 6249 B14R1.16 CCCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210211 [0,2,0,0,0,0|2,0,0]=4 6250 B14R1.16 CCCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210211 [0,2,0,0,0,0|2,0,0]=4 6251 B14R1.16 CCCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210211 [0,2,0,0,0,0|2,0,0]=4 6252 B14R1.16 CCCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210211 [0,2,0,0,0,0|2,0,0]=4 6253 B14R1.16 CCCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210211 [0,2,0,0,0,0|2,0,0]=4 6254 B14R1.16 CCCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210211 [0,2,0,0,0,0|2,0,0]=4 6255 B14R1.16 CCCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210211 [0,2,0,0,0,0|2,0,0]=4 6256 B14R1.16 CCCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210211 [0,2,0,0,0,0|2,0,0]=4 6257 B14R1.16 CCCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210211 [0,2,0,0,0,0|2,0,0]=4 6258 B14R1.16 CCCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210211 [0,2,0,0,0,0|2,0,0]=4 6259 B14R1.16 CCCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210211 [0,2,0,0,0,0|2,0,0]=4 6260 B14R1.16 CCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210211 [0,2,0,0,0,0|1,0,0]=3 6261 B14R1.16 CCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210211 [0,2,0,0,0,0|1,0,0]=3 6262 B14R1.16 CCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210211 [0,2,0,0,0,0|1,0,0]=3 6263 B14R1.16 CCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210211 [0,2,0,0,0,0|1,0,0]=3 6264 B14R1.16 CCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210211 [0,2,0,0,0,0|1,0,0]=3 6265 B14R1.16 CCCNC(=O)c1cccc(c1Br)Br 11a_100020643023_100012360534 [0,2,0,0,0,0|2,0,0]=4 6266 B14R1.16 CCCNC(=O)c1cccc(c1Br)Br 1626a_100020643023_100012360534 [0,2,0,0,0,0|2,0,0]=4 6267 B14R1.16 CCCNC(=O)c1cccc(c1Br)Br 240690a_100020643023_100012360534 [0,2,0,0,0,0|2,0,0]=4 6268 B14R1.16 CCCNC(=O)c1cccc(c1Br)Br 527a_100020643023_100012360534 [0,2,0,0,0,0|2,0,0]=4 6269 B14R1.16 CCCNC(=O)c1cccc(c1Br)C 11a_100020643023_100000692419 [0,2,0,0,0,0|2,0,0]=4 6270 B14R1.16 CCCNC(=O)c1cccc(c1Br)C 1626a_100020643023_100000692419 [0,2,0,0,0,0|2,0,0]=4 6271 B14R1.16 CCCNC(=O)c1cccc(c1Br)C 240690a_100020643023_100000692419 [0,2,0,0,0,0|2,0,0]=4 6272 B14R1.16 CCCNC(=O)c1cccc(c1Br)C 527a_100020643023_100000692419 [0,2,0,0,0,0|2,0,0]=4 6273 B14R1.16 CCCNC(=O)c1cccc(c1Br)Cl 11a_100020643023_100012339722 [0,2,0,0,0,0|2,0,0]=4 6274 B14R1.16 CCCNC(=O)c1cccc(c1Br)Cl 1626a_100020643023_100012339722 [0,2,0,0,0,0|2,0,0]=4 6275 B14R1.16 CCCNC(=O)c1cccc(c1Br)Cl 240690a_100020643023_100012339722 [0,2,0,0,0,0|2,0,0]=4 6276 B14R1.16 CCCNC(=O)c1cccc(c1Br)Cl 527a_100020643023_100012339722 [0,2,0,0,0,0|2,0,0]=4 6277 B14R1.16 CCCNC(=O)c1cccc(c1Br)F 11a_100020643023_100011217547 [0,2,0,0,0,0|2,0,0]=4 6278 B14R1.16 CCCNC(=O)c1cccc(c1Br)F 1626a_100020643023_100011217547 [0,2,0,0,0,0|2,0,0]=4 6279 B14R1.16 CCCNC(=O)c1cccc(c1Br)F 240690a_100020643023_100011217547 [0,2,0,0,0,0|2,0,0]=4 6280 B14R1.16 CCCNC(=O)c1cccc(c1Br)F 527a_100020643023_100011217547 [0,2,0,0,0,0|2,0,0]=4 6281 B14R1.16 CCCNC(=O)c1cccc(c1Br)I 11a_100020643023_100010232522 [0,2,0,0,0,0|2,0,0]=4 6282 B14R1.16 CCCNC(=O)c1cccc(c1Br)I 1626a_100020643023_100010232522 [0,2,0,0,0,0|2,0,0]=4 6283 B14R1.16 CCCNC(=O)c1cccc(c1Br)I 240690a_100020643023_100010232522 [0,2,0,0,0,0|2,0,0]=4 6284 B14R1.16 CCCNC(=O)c1cccc(c1Br)I 527a_100020643023_100010232522 [0,2,0,0,0,0|2,0,0]=4 6285 B14R1.16 CCCNC(=O)c1cccc(c1Br)O 240690a_100020643023_100010230362 [0,2,0,0,0,0|2,0,0]=4 6286 B14R1.16 CCCNC(=O)c1cccc(c1Br)O 527a_100020643023_100010230362 [0,2,0,0,0,0|2,0,0]=4 6287 B14R1.16 CCCNC(=O)c1cccc(c1C)Br 11a_100020643023_100000760464 [0,2,0,0,0,0|2,0,0]=4 6288 B14R1.16 CCCNC(=O)c1cccc(c1C)Br 1626a_100020643023_100000760464 [0,2,0,0,0,0|2,0,0]=4 6289 B14R1.16 CCCNC(=O)c1cccc(c1C)Br 240690a_100020643023_100000760464 [0,2,0,0,0,0|2,0,0]=4 6290 B14R1.16 CCCNC(=O)c1cccc(c1C)Br 527a_100020643023_100000760464 [0,2,0,0,0,0|2,0,0]=4 6291 B14R1.16 CCCNC(=O)c1cccc(c1C)C 11a_100020643023_100000183679 [0,2,0,0,0,0|2,0,0]=4 6292 B14R1.16 CCCNC(=O)c1cccc(c1C)C 1626a_100020643023_100000183679 [0,2,0,0,0,0|2,0,0]=4 6293 B14R1.16 CCCNC(=O)c1cccc(c1C)C 240690a_100020643023_100000183679 [0,2,0,0,0,0|2,0,0]=4 6294 B14R1.16 CCCNC(=O)c1cccc(c1C)C 527a_100020643023_100000183679 [0,2,0,0,0,0|2,0,0]=4 6295 B14R1.16 CCCNC(=O)c1cccc(c1C)Cl 11a_100020643023_100000690184 [0,2,0,0,0,0|2,0,0]=4 6296 B14R1.16 CCCNC(=O)c1cccc(c1C)Cl 1626a_100020643023_100000690184 [0,2,0,0,0,0|2,0,0]=4 6297 B14R1.16 CCCNC(=O)c1cccc(c1C)Cl 240690a_100020643023_100000690184 [0,2,0,0,0,0|2,0,0]=4 6298 B14R1.16 CCCNC(=O)c1cccc(c1C)Cl 527a_100020643023_100000690184 [0,2,0,0,0,0|2,0,0]=4 6299 B14R1.16 CCCNC(=O)c1cccc(c1C)F 11a_100020643023_100011218272 [0,2,0,0,0,0|2,0,0]=4 6300 B14R1.16 CCCNC(=O)c1cccc(c1C)F 1626a_100020643023_100011218272 [0,2,0,0,0,0|2,0,0]=4 6301 B14R1.16 CCCNC(=O)c1cccc(c1C)F 240690a_100020643023_100011218272 [0,2,0,0,0,0|2,0,0]=4 6302 B14R1.16 CCCNC(=O)c1cccc(c1C)F 527a_100020643023_100011218272 [0,2,0,0,0,0|2,0,0]=4 6303 B14R1.16 CCCNC(=O)c1cccc(c1C)I 11a_100020643023_100000751865 [0,2,0,0,0,0|2,0,0]=4 6304 B14R1.16 CCCNC(=O)c1cccc(c1C)I 1626a_100020643023_100000751865 [0,2,0,0,0,0|2,0,0]=4 6305 B14R1.16 CCCNC(=O)c1cccc(c1C)I 240690a_100020643023_100000751865 [0,2,0,0,0,0|2,0,0]=4 6306 B14R1.16 CCCNC(=O)c1cccc(c1C)I 527a_100020643023_100000751865 [0,2,0,0,0,0|2,0,0]=4 6307 B14R1.16 CCCNC(=O)c1cccc(c1C)O 240690a_100020643023_100000766327 [0,2,0,0,0,0|2,0,0]=4 6308 B14R1.16 CCCNC(=O)c1cccc(c1C)O 527a_100020643023_100000766327 [0,2,0,0,0,0|2,0,0]=4 6309 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Br 11a_100020643023_100000760540 [0,2,0,0,0,0|2,0,0]=4 6310 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Br 1626a_100020643023_100000760540 [0,2,0,0,0,0|2,0,0]=4 6311 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Br 240690a_100020643023_100000760540 [0,2,0,0,0,0|2,0,0]=4 6312 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Br 527a_100020643023_100000760540 [0,2,0,0,0,0|2,0,0]=4 6313 B14R1.16 CCCNC(=O)c1cccc(c1Cl)C 11a_100020643023_100000693142 [0,2,0,0,0,0|2,0,0]=4 6314 B14R1.16 CCCNC(=O)c1cccc(c1Cl)C 1626a_100020643023_100000693142 [0,2,0,0,0,0|2,0,0]=4 6315 B14R1.16 CCCNC(=O)c1cccc(c1Cl)C 240690a_100020643023_100000693142 [0,2,0,0,0,0|2,0,0]=4 6316 B14R1.16 CCCNC(=O)c1cccc(c1Cl)C 527a_100020643023_100000693142 [0,2,0,0,0,0|2,0,0]=4 6317 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Cl 11a_100020643023_100000183631 [0,2,0,0,0,0|2,0,0]=4 6318 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Cl 1626a_100020643023_100000183631 [0,2,0,0,0,0|2,0,0]=4 6319 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Cl 240690a_100020643023_100000183631 [0,2,0,0,0,0|2,0,0]=4 6320 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Cl 527a_100020643023_100000183631 [0,2,0,0,0,0|2,0,0]=4 6321 B14R1.16 CCCNC(=O)c1cccc(c1Cl)F 11a_100020643023_100000759904 [0,2,0,0,0,0|2,0,0]=4 6322 B14R1.16 CCCNC(=O)c1cccc(c1Cl)F 1626a_100020643023_100000759904 [0,2,0,0,0,0|2,0,0]=4 6323 B14R1.16 CCCNC(=O)c1cccc(c1Cl)F 240690a_100020643023_100000759904 [0,2,0,0,0,0|2,0,0]=4 6324 B14R1.16 CCCNC(=O)c1cccc(c1Cl)F 527a_100020643023_100000759904 [0,2,0,0,0,0|2,0,0]=4 6325 B14R1.16 CCCNC(=O)c1cccc(c1Cl)I 11a_100020643023_100010176783 [0,2,0,0,0,0|2,0,0]=4 6326 B14R1.16 CCCNC(=O)c1cccc(c1Cl)I 1626a_100020643023_100010176783 [0,2,0,0,0,0|2,0,0]=4 6327 B14R1.16 CCCNC(=O)c1cccc(c1Cl)I 240690a_100020643023_100010176783 [0,2,0,0,0,0|2,0,0]=4 6328 B14R1.16 CCCNC(=O)c1cccc(c1Cl)I 527a_100020643023_100010176783 [0,2,0,0,0,0|2,0,0]=4 6329 B14R1.16 CCCNC(=O)c1cccc(c1Cl)O 240690a_100020643023_100000092362 [0,2,0,0,0,0|2,0,0]=4 6330 B14R1.16 CCCNC(=O)c1cccc(c1Cl)O 527a_100020643023_100000092362 [0,2,0,0,0,0|2,0,0]=4 6331 B14R1.16 CCCNC(=O)c1cccc(c1F)Br 11a_100020643023_100000756403 [0,2,0,0,0,0|2,0,0]=4 6332 B14R1.16 CCCNC(=O)c1cccc(c1F)Br 1626a_100020643023_100000756403 [0,2,0,0,0,0|2,0,0]=4 6333 B14R1.16 CCCNC(=O)c1cccc(c1F)Br 240690a_100020643023_100000756403 [0,2,0,0,0,0|2,0,0]=4 6334 B14R1.16 CCCNC(=O)c1cccc(c1F)Br 527a_100020643023_100000756403 [0,2,0,0,0,0|2,0,0]=4 6335 B14R1.16 CCCNC(=O)c1cccc(c1F)C 11a_100020643023_100000766181 [0,2,0,0,0,0|2,0,0]=4 6336 B14R1.16 CCCNC(=O)c1cccc(c1F)C 1626a_100020643023_100000766181 [0,2,0,0,0,0|2,0,0]=4 6337 B14R1.16 CCCNC(=O)c1cccc(c1F)C 240690a_100020643023_100000766181 [0,2,0,0,0,0|2,0,0]=4 6338 B14R1.16 CCCNC(=O)c1cccc(c1F)C 527a_100020643023_100000766181 [0,2,0,0,0,0|2,0,0]=4 6339 B14R1.16 CCCNC(=O)c1cccc(c1F)Cl 11a_100020643023_100000688816 [0,2,0,0,0,0|2,0,0]=4 6340 B14R1.16 CCCNC(=O)c1cccc(c1F)Cl 1626a_100020643023_100000688816 [0,2,0,0,0,0|2,0,0]=4 6341 B14R1.16 CCCNC(=O)c1cccc(c1F)Cl 240690a_100020643023_100000688816 [0,2,0,0,0,0|2,0,0]=4 6342 B14R1.16 CCCNC(=O)c1cccc(c1F)Cl 527a_100020643023_100000688816 [0,2,0,0,0,0|2,0,0]=4 6343 B14R1.16 CCCNC(=O)c1cccc(c1F)F 11a_100020643023_100000748134 [0,2,0,0,0,0|2,0,0]=4 6344 B14R1.16 CCCNC(=O)c1cccc(c1F)F 1626a_100020643023_100000748134 [0,2,0,0,0,0|2,0,0]=4 6345 B14R1.16 CCCNC(=O)c1cccc(c1F)F 240690a_100020643023_100000748134 [0,2,0,0,0,0|2,0,0]=4 6346 B14R1.16 CCCNC(=O)c1cccc(c1F)F 527a_100020643023_100000748134 [0,2,0,0,0,0|2,0,0]=4 6347 B14R1.16 CCCNC(=O)c1cccc(c1F)I 11a_100020643023_100010185205 [0,2,0,0,0,0|2,0,0]=4 6348 B14R1.16 CCCNC(=O)c1cccc(c1F)I 1626a_100020643023_100010185205 [0,2,0,0,0,0|2,0,0]=4 6349 B14R1.16 CCCNC(=O)c1cccc(c1F)I 240690a_100020643023_100010185205 [0,2,0,0,0,0|2,0,0]=4 6350 B14R1.16 CCCNC(=O)c1cccc(c1F)I 527a_100020643023_100010185205 [0,2,0,0,0,0|2,0,0]=4 6351 B14R1.16 CCCNC(=O)c1cccc(c1F)O 240690a_100020643023_100000037433 [0,2,0,0,0,0|2,0,0]=4 6352 B14R1.16 CCCNC(=O)c1cccc(c1F)O 527a_100020643023_100000037433 [0,2,0,0,0,0|2,0,0]=4 6353 B14R1.16 CCCNC(=O)c1cccc(c1I)Br 11a_100020643023_100000688019 [0,2,0,0,0,0|2,0,0]=4 6354 B14R1.16 CCCNC(=O)c1cccc(c1I)Br 1626a_100020643023_100000688019 [0,2,0,0,0,0|2,0,0]=4 6355 B14R1.16 CCCNC(=O)c1cccc(c1I)Br 240690a_100020643023_100000688019 [0,2,0,0,0,0|2,0,0]=4 6356 B14R1.16 CCCNC(=O)c1cccc(c1I)Br 527a_100020643023_100000688019 [0,2,0,0,0,0|2,0,0]=4 6357 B14R1.16 CCCNC(=O)c1cccc(c1I)C 11a_100020643023_100000739377 [0,2,0,0,0,0|2,0,0]=4 6358 B14R1.16 CCCNC(=O)c1cccc(c1I)C 1626a_100020643023_100000739377 [0,2,0,0,0,0|2,0,0]=4 6359 B14R1.16 CCCNC(=O)c1cccc(c1I)C 240690a_100020643023_100000739377 [0,2,0,0,0,0|2,0,0]=4 6360 B14R1.16 CCCNC(=O)c1cccc(c1I)C 527a_100020643023_100000739377 [0,2,0,0,0,0|2,0,0]=4 6361 B14R1.16 CCCNC(=O)c1cccc(c1I)Cl 11a_100020643023_100010176784 [0,2,0,0,0,0|2,0,0]=4 6362 B14R1.16 CCCNC(=O)c1cccc(c1I)Cl 1626a_100020643023_100010176784 [0,2,0,0,0,0|2,0,0]=4 6363 B14R1.16 CCCNC(=O)c1cccc(c1I)Cl 240690a_100020643023_100010176784 [0,2,0,0,0,0|2,0,0]=4 6364 B14R1.16 CCCNC(=O)c1cccc(c1I)Cl 527a_100020643023_100010176784 [0,2,0,0,0,0|2,0,0]=4 6365 B14R1.16 CCCNC(=O)c1cccc(c1I)F 11a_100020643023_100000690930 [0,2,0,0,0,0|2,0,0]=4 6366 B14R1.16 CCCNC(=O)c1cccc(c1I)F 1626a_100020643023_100000690930 [0,2,0,0,0,0|2,0,0]=4 6367 B14R1.16 CCCNC(=O)c1cccc(c1I)F 240690a_100020643023_100000690930 [0,2,0,0,0,0|2,0,0]=4 6368 B14R1.16 CCCNC(=O)c1cccc(c1I)F 527a_100020643023_100000690930 [0,2,0,0,0,0|2,0,0]=4 6369 B14R1.16 CCCNC(=O)c1cccc(c1I)O 527a_100020643023_100010084636 [0,2,0,0,0,0|2,0,0]=4 6370 B14R1.16 CCCNC(=O)c1cccc(c1O)Br 240690a_100020643023_100000752940 [0,2,0,0,0,0|1,0,0]=3 6371 B14R1.16 CCCNC(=O)c1cccc(c1O)Br 527a_100020643023_100000752940 [0,2,0,0,0,0|1,0,0]=3 6372 B14R1.16 CCCNC(=O)c1cccc(c1O)C 240690a_100020643023_100000183896 [0,2,0,0,0,0|1,0,0]=3 6373 B14R1.16 CCCNC(=O)c1cccc(c1O)C 527a_100020643023_100000183896 [0,2,0,0,0,0|1,0,0]=3 6374 B14R1.16 CCCNC(=O)c1cccc(c1O)Cl 240690a_100020643023_100000742801 [0,2,0,0,0,0|1,0,0]=3 6375 B14R1.16 CCCNC(=O)c1cccc(c1O)Cl 527a_100020643023_100000742801 [0,2,0,0,0,0|1,0,0]=3 6376 B14R1.16 CCCNC(=O)c1cccc(c1O)F 240690a_100020643023_100011217230 [0,2,0,0,0,0|1,0,0]=3 6377 B14R1.16 CCCNC(=O)c1cccc(c1O)F 527a_100020643023_100011217230 [0,2,0,0,0,0|1,0,0]=3 6378 B14R1.16 CCCNC(=O)c1cccc(c1O)O 527a_100020643023_100000690420 [0,2,0,0,0,0|1,0,0]=3 6379 B14R1.16 CCNCC(=O)c1cccc(c1F)Br 2230a_100015525214_100012356374 [0,2,0,0,0,0|2,0,0]=4 6380 B14R1.16 CCNCC(=O)c1cccc(c1F)Cl 2230a_100015525214_200012351890 [0,2,0,0,0,0|2,0,0]=4 6381 B14R1.16 CCNN=C(C)c1cccc(c1O)Br 4a_100000756455_100009815558 [0,2,0,0,0,0|2,0,0]=4 6382 B14R1.16 CCNN=C(C)c1cccc(c1O)C 4a_100000756455_100009847209 [0,2,0,0,0,0|2,0,0]=4 6383 B14R1.16 CCNN=C(C)c1cccc(c1O)Cl 4a_100000756455_100000043392 [0,2,0,0,0,0|2,0,0]=4 6384 B14R1.16 CCNN=C(C)c1cccc(c1O)F 4a_100000756455_100011246037 [0,2,0,0,0,0|2,0,0]=4 6385 B14R1.16 CCNN=C(C)c1cccc(c1O)O 4a_100000756455_200000080400 [0,2,0,0,0,0|2,0,0]=4 6386 B14R1.16 CCNNC(=O)c1cccc(c1Br)Br 22a_100000756455_100012360534 [0,2,0,0,0,0|2,0,0]=4 6387 B14R1.16 CCNNC(=O)c1cccc(c1Br)C 22a_100000756455_100000692419 [0,2,0,0,0,0|2,0,0]=4 6388 B14R1.16 CCNNC(=O)c1cccc(c1Br)Cl 22a_100000756455_100012339722 [0,2,0,0,0,0|2,0,0]=4 6389 B14R1.16 CCNNC(=O)c1cccc(c1Br)F 22a_100000756455_100011217547 [0,2,0,0,0,0|2,0,0]=4 6390 B14R1.16 CCNNC(=O)c1cccc(c1Br)I 22a_100000756455_100010232522 [0,2,0,0,0,0|2,0,0]=4 6391 B14R1.16 CCNNC(=O)c1cccc(c1Br)O 22a_100000756455_100010230362 [0,2,0,0,0,0|2,0,0]=4 6392 B14R1.16 CCNNC(=O)c1cccc(c1C)Br 22a_100000756455_100000760464 [0,2,0,0,0,0|2,0,0]=4 6393 B14R1.16 CCNNC(=O)c1cccc(c1C)C 22a_100000756455_100000183679 [0,2,0,0,0,0|2,0,0]=4 6394 B14R1.16 CCNNC(=O)c1cccc(c1C)Cl 22a_100000756455_100000690184 [0,2,0,0,0,0|2,0,0]=4 6395 B14R1.16 CCNNC(=O)c1cccc(c1C)F 22a_100000756455_100011218272 [0,2,0,0,0,0|2,0,0]=4 6396 B14R1.16 CCNNC(=O)c1cccc(c1C)I 22a_100000756455_100000751865 [0,2,0,0,0,0|2,0,0]=4 6397 B14R1.16 CCNNC(=O)c1cccc(c1C)O 22a_100000756455_100000766327 [0,2,0,0,0,0|2,0,0]=4 6398 B14R1.16 CCNNC(=O)c1cccc(c1Cl)Br 22a_100000756455_100000760540 [0,2,0,0,0,0|2,0,0]=4 6399 B14R1.16 CCNNC(=O)c1cccc(c1Cl)C 22a_100000756455_100000693142 [0,2,0,0,0,0|2,0,0]=4 6400 B14R1.16 CCNNC(=O)c1cccc(c1Cl)Cl 22a_100000756455_100000183631 [0,2,0,0,0,0|2,0,0]=4 6401 B14R1.16 CCNNC(=O)c1cccc(c1Cl)F 22a_100000756455_100000759904 [0,2,0,0,0,0|2,0,0]=4 6402 B14R1.16 CCNNC(=O)c1cccc(c1Cl)I 22a_100000756455_100010176783 [0,2,0,0,0,0|2,0,0]=4 6403 B14R1.16 CCNNC(=O)c1cccc(c1Cl)O 22a_100000756455_100000092362 [0,2,0,0,0,0|2,0,0]=4 6404 B14R1.16 CCNNC(=O)c1cccc(c1F)Br 22a_100000756455_100000756403 [0,2,0,0,0,0|2,0,0]=4 6405 B14R1.16 CCNNC(=O)c1cccc(c1F)C 22a_100000756455_100000766181 [0,2,0,0,0,0|2,0,0]=4 6406 B14R1.16 CCNNC(=O)c1cccc(c1F)Cl 22a_100000756455_100000688816 [0,2,0,0,0,0|2,0,0]=4 6407 B14R1.16 CCNNC(=O)c1cccc(c1F)F 22a_100000756455_100000748134 [0,2,0,0,0,0|2,0,0]=4 6408 B14R1.16 CCNNC(=O)c1cccc(c1F)I 22a_100000756455_100010185205 [0,2,0,0,0,0|2,0,0]=4 6409 B14R1.16 CCNNC(=O)c1cccc(c1F)O 22a_100000756455_100000037433 [0,2,0,0,0,0|2,0,0]=4 6410 B14R1.16 CCNNC(=O)c1cccc(c1I)Br 22a_100000756455_100000688019 [0,2,0,0,0,0|2,0,0]=4 6411 B14R1.16 CCNNC(=O)c1cccc(c1I)C 22a_100000756455_100000739377 [0,2,0,0,0,0|2,0,0]=4 6412 B14R1.16 CCNNC(=O)c1cccc(c1I)Cl 22a_100000756455_100010176784 [0,2,0,0,0,0|2,0,0]=4 6413 B14R1.16 CCNNC(=O)c1cccc(c1I)F 22a_100000756455_100000690930 [0,2,0,0,0,0|2,0,0]=4 6414 B14R1.16 CCNNC(=O)c1cccc(c1I)O 22a_100000756455_100010084636 [0,2,0,0,0,0|2,0,0]=4 6415 B14R1.16 CCNNC(=O)c1cccc(c1O)Br 22a_100000756455_100000752940 [0,2,0,0,0,0|1,0,0]=3 6416 B14R1.16 CCNNC(=O)c1cccc(c1O)C 22a_100000756455_100000183896 [0,2,0,0,0,0|1,0,0]=3 6417 B14R1.16 CCNNC(=O)c1cccc(c1O)Cl 22a_100000756455_100000742801 [0,2,0,0,0,0|1,0,0]=3 6418 B14R1.16 CCNNC(=O)c1cccc(c1O)F 22a_100000756455_100011217230 [0,2,0,0,0,0|1,0,0]=3 6419 B14R1.16 CCNNC(=O)c1cccc(c1O)O 22a_100000756455_100000690420 [0,2,0,0,0,0|1,0,0]=3 6420 B14R1.16 CCOCC(=O)c1cccc(c1C)I 34a_100121572206_100160470822 [0,2,0,0,0,0|1,0,0]=3 6421 B14R1.16 CCOCC(=O)c1cccc(c1F)Br 34a_100121572206_100012356374 [0,2,0,0,0,0|1,0,0]=3 6422 B14R1.16 CCOCC(=O)c1cccc(c1F)Cl 34a_100121572206_200012351890 [0,2,0,0,0,0|1,0,0]=3 6423 B14R1.16 CCSCC(=O)c1cccc(c1C)I 62a_100000210202_100160470822 [0,2,0,0,0,0|1,1,0]=4 6424 B14R1.16 CCSCC(=O)c1cccc(c1C)I 62a_100160470822_100000210202 [0,2,0,0,0,0|1,1,0]=4 6425 B14R1.16 CCSCC(=O)c1cccc(c1F)Br 62a_100000210202_100012356374 [0,2,0,0,0,0|1,1,0]=4 6426 B14R1.16 CCSCC(=O)c1cccc(c1F)Br 62a_100012356374_100000210202 [0,2,0,0,0,0|1,1,0]=4 6427 B14R1.16 CCSCC(=O)c1cccc(c1F)Cl 62a_100000210202_200012351890 [0,2,0,0,0,0|1,1,0]=4 6428 B14R1.16 CCSCC(=O)c1cccc(c1F)Cl 62a_200012351890_100000210202 [0,2,0,0,0,0|1,1,0]=4 6429 B14R1.16 COCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000233755 [0,2,0,0,0,0|2,0,0]=4 6430 B14R1.16 COCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000233755 [0,2,0,0,0,0|2,0,0]=4 6431 B14R1.16 COCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000233755 [0,2,0,0,0,0|2,0,0]=4 6432 B14R1.16 COCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000233755 [0,2,0,0,0,0|2,0,0]=4 6433 B14R1.16 COCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000233755 [0,2,0,0,0,0|2,0,0]=4 6434 B14R1.16 COCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000233755 [0,2,0,0,0,0|2,0,0]=4 6435 B14R1.16 COCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000233755 [0,2,0,0,0,0|2,0,0]=4 6436 B14R1.16 COCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000233755 [0,2,0,0,0,0|2,0,0]=4 6437 B14R1.16 COCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000233755 [0,2,0,0,0,0|2,0,0]=4 6438 B14R1.16 COCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000233755 [0,2,0,0,0,0|2,0,0]=4 6439 B14R1.16 COCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000233755 [0,2,0,0,0,0|2,0,0]=4 6440 B14R1.16 COCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000233755 [0,2,0,0,0,0|2,0,0]=4 6441 B14R1.16 COCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000233755 [0,2,0,0,0,0|2,0,0]=4 6442 B14R1.16 COCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000233755 [0,2,0,0,0,0|2,0,0]=4 6443 B14R1.16 COCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000233755 [0,2,0,0,0,0|2,0,0]=4 6444 B14R1.16 COCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000233755 [0,2,0,0,0,0|2,0,0]=4 6445 B14R1.16 COCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000233755 [0,2,0,0,0,0|2,0,0]=4 6446 B14R1.16 COCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000233755 [0,2,0,0,0,0|2,0,0]=4 6447 B14R1.16 COCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000233755 [0,2,0,0,0,0|2,0,0]=4 6448 B14R1.16 COCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000233755 [0,2,0,0,0,0|2,0,0]=4 6449 B14R1.16 COCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000233755 [0,2,0,0,0,0|2,0,0]=4 6450 B14R1.16 COCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000233755 [0,2,0,0,0,0|2,0,0]=4 6451 B14R1.16 COCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000233755 [0,2,0,0,0,0|2,0,0]=4 6452 B14R1.16 COCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000233755 [0,2,0,0,0,0|2,0,0]=4 6453 B14R1.16 COCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000233755 [0,2,0,0,0,0|2,0,0]=4 6454 B14R1.16 COCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000233755 [0,2,0,0,0,0|2,0,0]=4 6455 B14R1.16 COCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000233755 [0,2,0,0,0,0|2,0,0]=4 6456 B14R1.16 COCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000233755 [0,2,0,0,0,0|2,0,0]=4 6457 B14R1.16 COCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000233755 [0,2,0,0,0,0|2,0,0]=4 6458 B14R1.16 COCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000233755 [0,2,0,0,0,0|1,0,0]=3 6459 B14R1.16 COCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000233755 [0,2,0,0,0,0|1,0,0]=3 6460 B14R1.16 COCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000233755 [0,2,0,0,0,0|1,0,0]=3 6461 B14R1.16 COCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000233755 [0,2,0,0,0,0|1,0,0]=3 6462 B14R1.16 COCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000233755 [0,2,0,0,0,0|1,0,0]=3 6463 B14R1.16 CSCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000751147 [0,2,0,0,0,0|2,0,0]=4 6464 B14R1.16 CSCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000751147 [0,2,0,0,0,0|2,0,0]=4 6465 B14R1.16 CSCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000751147 [0,2,0,0,0,0|2,0,0]=4 6466 B14R1.16 CSCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000751147 [0,2,0,0,0,0|2,0,0]=4 6467 B14R1.16 CSCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000751147 [0,2,0,0,0,0|2,0,0]=4 6468 B14R1.16 CSCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000751147 [0,2,0,0,0,0|2,0,0]=4 6469 B14R1.16 CSCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000751147 [0,2,0,0,0,0|2,0,0]=4 6470 B14R1.16 CSCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000751147 [0,2,0,0,0,0|2,0,0]=4 6471 B14R1.16 CSCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000751147 [0,2,0,0,0,0|2,0,0]=4 6472 B14R1.16 CSCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000751147 [0,2,0,0,0,0|2,0,0]=4 6473 B14R1.16 CSCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000751147 [0,2,0,0,0,0|2,0,0]=4 6474 B14R1.16 CSCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000751147 [0,2,0,0,0,0|2,0,0]=4 6475 B14R1.16 CSCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000751147 [0,2,0,0,0,0|2,0,0]=4 6476 B14R1.16 CSCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000751147 [0,2,0,0,0,0|2,0,0]=4 6477 B14R1.16 CSCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000751147 [0,2,0,0,0,0|2,0,0]=4 6478 B14R1.16 CSCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000751147 [0,2,0,0,0,0|2,0,0]=4 6479 B14R1.16 CSCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000751147 [0,2,0,0,0,0|2,0,0]=4 6480 B14R1.16 CSCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000751147 [0,2,0,0,0,0|2,0,0]=4 6481 B14R1.16 CSCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000751147 [0,2,0,0,0,0|2,0,0]=4 6482 B14R1.16 CSCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000751147 [0,2,0,0,0,0|2,0,0]=4 6483 B14R1.16 CSCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000751147 [0,2,0,0,0,0|2,0,0]=4 6484 B14R1.16 CSCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000751147 [0,2,0,0,0,0|2,0,0]=4 6485 B14R1.16 CSCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000751147 [0,2,0,0,0,0|2,0,0]=4 6486 B14R1.16 CSCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000751147 [0,2,0,0,0,0|2,0,0]=4 6487 B14R1.16 CSCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000751147 [0,2,0,0,0,0|2,0,0]=4 6488 B14R1.16 CSCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000751147 [0,2,0,0,0,0|2,0,0]=4 6489 B14R1.16 CSCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000751147 [0,2,0,0,0,0|2,0,0]=4 6490 B14R1.16 CSCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000751147 [0,2,0,0,0,0|2,0,0]=4 6491 B14R1.16 CSCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000751147 [0,2,0,0,0,0|2,0,0]=4 6492 B14R1.16 CSCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000751147 [0,2,0,0,0,0|1,0,0]=3 6493 B14R1.16 CSCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000751147 [0,2,0,0,0,0|1,0,0]=3 6494 B14R1.16 CSCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000751147 [0,2,0,0,0,0|1,0,0]=3 6495 B14R1.16 CSCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000751147 [0,2,0,0,0,0|1,0,0]=3 6496 B14R1.16 CSCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000751147 [0,2,0,0,0,0|1,0,0]=3 6497 B14R1.16 Cc1c(cccc1C(=O)CCCF)Br 1458a_100000760464_100011934791 [0,2,0,0,0,0|2,0,0]=4 6498 B14R1.16 Cc1c(cccc1C(=O)CCCF)Cl 1458a_100000690184_100011934791 [0,2,0,0,0,0|2,0,0]=4 6499 B14R1.16 Cc1c(cccc1C(=O)CCCF)F 1458a_100011218272_100011934791 [0,2,0,0,0,0|2,0,0]=4 6500 B14R1.16 Cc1c(cccc1C(=O)CCCF)I 1458a_100000751865_100011934791 [0,2,0,0,0,0|2,0,0]=4 6501 B14R1.16 Cc1c(cccc1C(=O)CCCF)O 1458a_100000766327_100011934791 [0,2,0,0,0,0|2,0,0]=4 6502 B14R1.16 Cc1c(cccc1C(=O)CCCO)Br 1458a_100000760464_100011215043 [0,2,0,0,0,0|2,0,0]=4 6503 B14R1.16 Cc1c(cccc1C(=O)CCCO)Cl 1458a_100000690184_100011215043 [0,2,0,0,0,0|2,0,0]=4 6504 B14R1.16 Cc1c(cccc1C(=O)CCCO)F 1458a_100011218272_100011215043 [0,2,0,0,0,0|2,0,0]=4 6505 B14R1.16 Cc1c(cccc1C(=O)CCCO)I 1458a_100000751865_100011215043 [0,2,0,0,0,0|2,0,0]=4 6506 B14R1.16 Cc1c(cccc1C(=O)CCCO)O 1458a_100000766327_100011215043 [0,2,0,0,0,0|2,0,0]=4 6507 B14R1.16 Cc1c(cccc1C(=O)NCCF)Br 11a_100000724931_100000760464 [0,2,0,0,0,0|2,0,0]=4 6508 B14R1.16 Cc1c(cccc1C(=O)NCCF)Br 1626a_100000724931_100000760464 [0,2,0,0,0,0|2,0,0]=4 6509 B14R1.16 Cc1c(cccc1C(=O)NCCF)Br 240690a_100000724931_100000760464 [0,2,0,0,0,0|2,0,0]=4 6510 B14R1.16 Cc1c(cccc1C(=O)NCCF)Br 527a_100000724931_100000760464 [0,2,0,0,0,0|2,0,0]=4 6511 B14R1.16 Cc1c(cccc1C(=O)NCCF)Cl 11a_100000724931_100000690184 [0,2,0,0,0,0|2,0,0]=4 6512 B14R1.16 Cc1c(cccc1C(=O)NCCF)Cl 1626a_100000724931_100000690184 [0,2,0,0,0,0|2,0,0]=4 6513 B14R1.16 Cc1c(cccc1C(=O)NCCF)Cl 240690a_100000724931_100000690184 [0,2,0,0,0,0|2,0,0]=4 6514 B14R1.16 Cc1c(cccc1C(=O)NCCF)Cl 527a_100000724931_100000690184 [0,2,0,0,0,0|2,0,0]=4 6515 B14R1.16 Cc1c(cccc1C(=O)NCCF)F 11a_100000724931_100011218272 [0,2,0,0,0,0|2,0,0]=4 6516 B14R1.16 Cc1c(cccc1C(=O)NCCF)F 1626a_100000724931_100011218272 [0,2,0,0,0,0|2,0,0]=4 6517 B14R1.16 Cc1c(cccc1C(=O)NCCF)F 240690a_100000724931_100011218272 [0,2,0,0,0,0|2,0,0]=4 6518 B14R1.16 Cc1c(cccc1C(=O)NCCF)F 527a_100000724931_100011218272 [0,2,0,0,0,0|2,0,0]=4 6519 B14R1.16 Cc1c(cccc1C(=O)NCCF)I 11a_100000724931_100000751865 [0,2,0,0,0,0|2,0,0]=4 6520 B14R1.16 Cc1c(cccc1C(=O)NCCF)I 1626a_100000724931_100000751865 [0,2,0,0,0,0|2,0,0]=4 6521 B14R1.16 Cc1c(cccc1C(=O)NCCF)I 240690a_100000724931_100000751865 [0,2,0,0,0,0|2,0,0]=4 6522 B14R1.16 Cc1c(cccc1C(=O)NCCF)I 527a_100000724931_100000751865 [0,2,0,0,0,0|2,0,0]=4 6523 B14R1.16 Cc1c(cccc1C(=O)NCCF)O 240690a_100000724931_100000766327 [0,2,0,0,0,0|2,0,0]=4 6524 B14R1.16 Cc1c(cccc1C(=O)NCCF)O 527a_100000724931_100000766327 [0,2,0,0,0,0|2,0,0]=4 6525 B14R1.16 Cc1c(cccc1C(=O)NCCO)Br 240690a_100000210304_100000760464 [0,2,0,0,0,0|2,0,0]=4 6526 B14R1.16 Cc1c(cccc1C(=O)NCCO)Br 527a_100000210304_100000760464 [0,2,0,0,0,0|2,0,0]=4 6527 B14R1.16 Cc1c(cccc1C(=O)NCCO)Cl 240690a_100000210304_100000690184 [0,2,0,0,0,0|2,0,0]=4 6528 B14R1.16 Cc1c(cccc1C(=O)NCCO)Cl 527a_100000210304_100000690184 [0,2,0,0,0,0|2,0,0]=4 6529 B14R1.16 Cc1c(cccc1C(=O)NCCO)F 240690a_100000210304_100011218272 [0,2,0,0,0,0|2,0,0]=4 6530 B14R1.16 Cc1c(cccc1C(=O)NCCO)F 527a_100000210304_100011218272 [0,2,0,0,0,0|2,0,0]=4 6531 B14R1.16 Cc1c(cccc1C(=O)NCCO)I 240690a_100000210304_100000751865 [0,2,0,0,0,0|2,0,0]=4 6532 B14R1.16 Cc1c(cccc1C(=O)NCCO)I 527a_100000210304_100000751865 [0,2,0,0,0,0|2,0,0]=4 6533 B14R1.16 Cc1c(cccc1C(=O)NCCO)O 240690a_100000210304_100000766327 [0,2,0,0,0,0|2,0,0]=4 6534 B14R1.16 Cc1c(cccc1C(=O)NCCO)O 527a_100000210304_100000766327 [0,2,0,0,0,0|2,0,0]=4 6535 B14R1.16 Cc1cccc(c1Br)C(=O)CCCF 1458a_100000692419_100011934791 [0,2,0,0,0,0|2,0,0]=4 6536 B14R1.16 Cc1cccc(c1Br)C(=O)CCCO 1458a_100000692419_100011215043 [0,2,0,0,0,0|2,0,0]=4 6537 B14R1.16 Cc1cccc(c1Br)C(=O)NCCF 11a_100000724931_100000692419 [0,2,0,0,0,0|2,0,0]=4 6538 B14R1.16 Cc1cccc(c1Br)C(=O)NCCF 1626a_100000724931_100000692419 [0,2,0,0,0,0|2,0,0]=4 6539 B14R1.16 Cc1cccc(c1Br)C(=O)NCCF 240690a_100000724931_100000692419 [0,2,0,0,0,0|2,0,0]=4 6540 B14R1.16 Cc1cccc(c1Br)C(=O)NCCF 527a_100000724931_100000692419 [0,2,0,0,0,0|2,0,0]=4 6541 B14R1.16 Cc1cccc(c1Br)C(=O)NCCO 240690a_100000210304_100000692419 [0,2,0,0,0,0|2,0,0]=4 6542 B14R1.16 Cc1cccc(c1Br)C(=O)NCCO 527a_100000210304_100000692419 [0,2,0,0,0,0|2,0,0]=4 6543 B14R1.16 Cc1cccc(c1C)C(=O)CCCF 1458a_100000183679_100011934791 [0,2,0,0,0,0|2,0,0]=4 6544 B14R1.16 Cc1cccc(c1C)C(=O)CCCO 1458a_100000183679_100011215043 [0,2,0,0,0,0|2,0,0]=4 6545 B14R1.16 Cc1cccc(c1C)C(=O)NCCF 11a_100000724931_100000183679 [0,2,0,0,0,0|2,0,0]=4 6546 B14R1.16 Cc1cccc(c1C)C(=O)NCCF 1626a_100000724931_100000183679 [0,2,0,0,0,0|2,0,0]=4 6547 B14R1.16 Cc1cccc(c1C)C(=O)NCCF 240690a_100000724931_100000183679 [0,2,0,0,0,0|2,0,0]=4 6548 B14R1.16 Cc1cccc(c1C)C(=O)NCCF 527a_100000724931_100000183679 [0,2,0,0,0,0|2,0,0]=4 6549 B14R1.16 Cc1cccc(c1C)C(=O)NCCO 240690a_100000210304_100000183679 [0,2,0,0,0,0|2,0,0]=4 6550 B14R1.16 Cc1cccc(c1C)C(=O)NCCO 527a_100000210304_100000183679 [0,2,0,0,0,0|2,0,0]=4 6551 B14R1.16 Cc1cccc(c1Cl)C(=O)CCCF 1458a_100000693142_100011934791 [0,2,0,0,0,0|2,0,0]=4 6552 B14R1.16 Cc1cccc(c1Cl)C(=O)CCCO 1458a_100000693142_100011215043 [0,2,0,0,0,0|2,0,0]=4 6553 B14R1.16 Cc1cccc(c1Cl)C(=O)NCCF 11a_100000724931_100000693142 [0,2,0,0,0,0|2,0,0]=4 6554 B14R1.16 Cc1cccc(c1Cl)C(=O)NCCF 1626a_100000724931_100000693142 [0,2,0,0,0,0|2,0,0]=4 6555 B14R1.16 Cc1cccc(c1Cl)C(=O)NCCF 240690a_100000724931_100000693142 [0,2,0,0,0,0|2,0,0]=4 6556 B14R1.16 Cc1cccc(c1Cl)C(=O)NCCF 527a_100000724931_100000693142 [0,2,0,0,0,0|2,0,0]=4 6557 B14R1.16 Cc1cccc(c1Cl)C(=O)NCCO 240690a_100000210304_100000693142 [0,2,0,0,0,0|2,0,0]=4 6558 B14R1.16 Cc1cccc(c1Cl)C(=O)NCCO 527a_100000210304_100000693142 [0,2,0,0,0,0|2,0,0]=4 6559 B14R1.16 Cc1cccc(c1F)C(=O)CCCF 1458a_100000766181_100011934791 [0,2,0,0,0,0|2,0,0]=4 6560 B14R1.16 Cc1cccc(c1F)C(=O)CCCO 1458a_100000766181_100011215043 [0,2,0,0,0,0|2,0,0]=4 6561 B14R1.16 Cc1cccc(c1F)C(=O)NCCF 11a_100000724931_100000766181 [0,2,0,0,0,0|2,0,0]=4 6562 B14R1.16 Cc1cccc(c1F)C(=O)NCCF 1626a_100000724931_100000766181 [0,2,0,0,0,0|2,0,0]=4 6563 B14R1.16 Cc1cccc(c1F)C(=O)NCCF 240690a_100000724931_100000766181 [0,2,0,0,0,0|2,0,0]=4 6564 B14R1.16 Cc1cccc(c1F)C(=O)NCCF 527a_100000724931_100000766181 [0,2,0,0,0,0|2,0,0]=4 6565 B14R1.16 Cc1cccc(c1F)C(=O)NCCO 240690a_100000210304_100000766181 [0,2,0,0,0,0|2,0,0]=4 6566 B14R1.16 Cc1cccc(c1F)C(=O)NCCO 527a_100000210304_100000766181 [0,2,0,0,0,0|2,0,0]=4 6567 B14R1.16 Cc1cccc(c1I)C(=O)CCCF 1458a_100000739377_100011934791 [0,2,0,0,0,0|2,0,0]=4 6568 B14R1.16 Cc1cccc(c1I)C(=O)CCCO 1458a_100000739377_100011215043 [0,2,0,0,0,0|2,0,0]=4 6569 B14R1.16 Cc1cccc(c1I)C(=O)NCCF 11a_100000724931_100000739377 [0,2,0,0,0,0|2,0,0]=4 6570 B14R1.16 Cc1cccc(c1I)C(=O)NCCF 1626a_100000724931_100000739377 [0,2,0,0,0,0|2,0,0]=4 6571 B14R1.16 Cc1cccc(c1I)C(=O)NCCF 240690a_100000724931_100000739377 [0,2,0,0,0,0|2,0,0]=4 6572 B14R1.16 Cc1cccc(c1I)C(=O)NCCF 527a_100000724931_100000739377 [0,2,0,0,0,0|2,0,0]=4 6573 B14R1.16 Cc1cccc(c1I)C(=O)NCCO 240690a_100000210304_100000739377 [0,2,0,0,0,0|2,0,0]=4 6574 B14R1.16 Cc1cccc(c1I)C(=O)NCCO 527a_100000210304_100000739377 [0,2,0,0,0,0|2,0,0]=4 6575 B14R1.16 Cc1cccc(c1O)C(=O)CCC#N 1458a_100000183896_100011215226 [0,2,0,0,0,0|1,0,1]=4 6576 B14R1.16 Cc1cccc(c1O)C(=O)CCCF 1458a_100000183896_100011934791 [0,2,0,0,0,0|1,0,0]=3 6577 B14R1.16 Cc1cccc(c1O)C(=O)CCCO 1458a_100000183896_100011215043 [0,2,0,0,0,0|1,0,0]=3 6578 B14R1.16 Cc1cccc(c1O)C(=O)NCC#N 527a_100000734998_100000183896 [0,2,0,0,0,0|1,0,1]=4 6579 B14R1.16 Cc1cccc(c1O)C(=O)NCCF 240690a_100000724931_100000183896 [0,2,0,0,0,0|1,0,0]=3 6580 B14R1.16 Cc1cccc(c1O)C(=O)NCCF 527a_100000724931_100000183896 [0,2,0,0,0,0|1,0,0]=3 6581 B14R1.16 Cc1cccc(c1O)C(=O)NCCO 240690a_100000210304_100000183896 [0,2,0,0,0,0|1,0,0]=3 6582 B14R1.16 Cc1cccc(c1O)C(=O)NCCO 527a_100000210304_100000183896 [0,2,0,0,0,0|1,0,0]=3 6583 B14R1.16 N#CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011215226 [0,2,0,0,0,0|1,0,1]=4 6584 B14R1.16 N#CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011215226 [0,2,0,0,0,0|1,0,1]=4 6585 B14R1.16 N#CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100011215226 [0,2,0,0,0,0|1,0,1]=4 6586 B14R1.16 N#CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100011215226 [0,2,0,0,0,0|1,0,1]=4 6587 B14R1.16 N#CCNC(=O)c1cccc(c1O)Br 527a_100000734998_100000752940 [0,2,0,0,0,0|1,0,1]=4 6588 B14R1.16 N#CCNC(=O)c1cccc(c1O)Cl 527a_100000734998_100000742801 [0,2,0,0,0,0|1,0,1]=4 6589 B14R1.16 N#CCNC(=O)c1cccc(c1O)F 527a_100000734998_100011217230 [0,2,0,0,0,0|1,0,1]=4 6590 B14R1.16 N#CCNC(=O)c1cccc(c1O)O 527a_100000734998_100000690420 [0,2,0,0,0,0|1,0,1]=4 6591 B14R1.16 O=C(CCCF)c1cccc(c1Br)Br 1458a_100012360534_100011934791 [0,2,0,0,0,0|2,0,0]=4 6592 B14R1.16 O=C(CCCF)c1cccc(c1Br)Cl 1458a_100012339722_100011934791 [0,2,0,0,0,0|2,0,0]=4 6593 B14R1.16 O=C(CCCF)c1cccc(c1Br)F 1458a_100011217547_100011934791 [0,2,0,0,0,0|2,0,0]=4 6594 B14R1.16 O=C(CCCF)c1cccc(c1Br)I 1458a_100010232522_100011934791 [0,2,0,0,0,0|2,0,0]=4 6595 B14R1.16 O=C(CCCF)c1cccc(c1Br)O 1458a_100010230362_100011934791 [0,2,0,0,0,0|2,0,0]=4 6596 B14R1.16 O=C(CCCF)c1cccc(c1Cl)Br 1458a_100000760540_100011934791 [0,2,0,0,0,0|2,0,0]=4 6597 B14R1.16 O=C(CCCF)c1cccc(c1Cl)Cl 1458a_100000183631_100011934791 [0,2,0,0,0,0|2,0,0]=4 6598 B14R1.16 O=C(CCCF)c1cccc(c1Cl)F 1458a_100000759904_100011934791 [0,2,0,0,0,0|2,0,0]=4 6599 B14R1.16 O=C(CCCF)c1cccc(c1Cl)I 1458a_100010176783_100011934791 [0,2,0,0,0,0|2,0,0]=4 6600 B14R1.16 O=C(CCCF)c1cccc(c1Cl)O 1458a_100000092362_100011934791 [0,2,0,0,0,0|2,0,0]=4 6601 B14R1.16 O=C(CCCF)c1cccc(c1F)Br 1458a_100000756403_100011934791 [0,2,0,0,0,0|2,0,0]=4 6602 B14R1.16 O=C(CCCF)c1cccc(c1F)Cl 1458a_100000688816_100011934791 [0,2,0,0,0,0|2,0,0]=4 6603 B14R1.16 O=C(CCCF)c1cccc(c1F)F 1458a_100000748134_100011934791 [0,2,0,0,0,0|2,0,0]=4 6604 B14R1.16 O=C(CCCF)c1cccc(c1F)I 1458a_100010185205_100011934791 [0,2,0,0,0,0|2,0,0]=4 6605 B14R1.16 O=C(CCCF)c1cccc(c1F)O 1458a_100000037433_100011934791 [0,2,0,0,0,0|2,0,0]=4 6606 B14R1.16 O=C(CCCF)c1cccc(c1I)Br 1458a_100000688019_100011934791 [0,2,0,0,0,0|2,0,0]=4 6607 B14R1.16 O=C(CCCF)c1cccc(c1I)Cl 1458a_100010176784_100011934791 [0,2,0,0,0,0|2,0,0]=4 6608 B14R1.16 O=C(CCCF)c1cccc(c1I)F 1458a_100000690930_100011934791 [0,2,0,0,0,0|2,0,0]=4 6609 B14R1.16 O=C(CCCF)c1cccc(c1I)O 1458a_100010084636_100011934791 [0,2,0,0,0,0|2,0,0]=4 6610 B14R1.16 O=C(CCCF)c1cccc(c1O)Br 1458a_100000752940_100011934791 [0,2,0,0,0,0|1,0,0]=3 6611 B14R1.16 O=C(CCCF)c1cccc(c1O)Cl 1458a_100000742801_100011934791 [0,2,0,0,0,0|1,0,0]=3 6612 B14R1.16 O=C(CCCF)c1cccc(c1O)F 1458a_100011217230_100011934791 [0,2,0,0,0,0|1,0,0]=3 6613 B14R1.16 O=C(CCCF)c1cccc(c1O)O 1458a_100000690420_100011934791 [0,2,0,0,0,0|1,0,0]=3 6614 B14R1.16 O=C(CCCO)c1cccc(c1Br)Br 1458a_100012360534_100011215043 [0,2,0,0,0,0|2,0,0]=4 6615 B14R1.16 O=C(CCCO)c1cccc(c1Br)Cl 1458a_100012339722_100011215043 [0,2,0,0,0,0|2,0,0]=4 6616 B14R1.16 O=C(CCCO)c1cccc(c1Br)F 1458a_100011217547_100011215043 [0,2,0,0,0,0|2,0,0]=4 6617 B14R1.16 O=C(CCCO)c1cccc(c1Br)I 1458a_100010232522_100011215043 [0,2,0,0,0,0|2,0,0]=4 6618 B14R1.16 O=C(CCCO)c1cccc(c1Br)O 1458a_100010230362_100011215043 [0,2,0,0,0,0|2,0,0]=4 6619 B14R1.16 O=C(CCCO)c1cccc(c1Cl)Br 1458a_100000760540_100011215043 [0,2,0,0,0,0|2,0,0]=4 6620 B14R1.16 O=C(CCCO)c1cccc(c1Cl)Cl 1458a_100000183631_100011215043 [0,2,0,0,0,0|2,0,0]=4 6621 B14R1.16 O=C(CCCO)c1cccc(c1Cl)F 1458a_100000759904_100011215043 [0,2,0,0,0,0|2,0,0]=4 6622 B14R1.16 O=C(CCCO)c1cccc(c1Cl)I 1458a_100010176783_100011215043 [0,2,0,0,0,0|2,0,0]=4 6623 B14R1.16 O=C(CCCO)c1cccc(c1Cl)O 1458a_100000092362_100011215043 [0,2,0,0,0,0|2,0,0]=4 6624 B14R1.16 O=C(CCCO)c1cccc(c1F)Br 1458a_100000756403_100011215043 [0,2,0,0,0,0|2,0,0]=4 6625 B14R1.16 O=C(CCCO)c1cccc(c1F)Cl 1458a_100000688816_100011215043 [0,2,0,0,0,0|2,0,0]=4 6626 B14R1.16 O=C(CCCO)c1cccc(c1F)F 1458a_100000748134_100011215043 [0,2,0,0,0,0|2,0,0]=4 6627 B14R1.16 O=C(CCCO)c1cccc(c1F)I 1458a_100010185205_100011215043 [0,2,0,0,0,0|2,0,0]=4 6628 B14R1.16 O=C(CCCO)c1cccc(c1F)O 1458a_100000037433_100011215043 [0,2,0,0,0,0|2,0,0]=4 6629 B14R1.16 O=C(CCCO)c1cccc(c1I)Br 1458a_100000688019_100011215043 [0,2,0,0,0,0|2,0,0]=4 6630 B14R1.16 O=C(CCCO)c1cccc(c1I)Cl 1458a_100010176784_100011215043 [0,2,0,0,0,0|2,0,0]=4 6631 B14R1.16 O=C(CCCO)c1cccc(c1I)F 1458a_100000690930_100011215043 [0,2,0,0,0,0|2,0,0]=4 6632 B14R1.16 O=C(CCCO)c1cccc(c1I)O 1458a_100010084636_100011215043 [0,2,0,0,0,0|2,0,0]=4 6633 B14R1.16 O=C(CCCO)c1cccc(c1O)Br 1458a_100000752940_100011215043 [0,2,0,0,0,0|1,0,0]=3 6634 B14R1.16 O=C(CCCO)c1cccc(c1O)Cl 1458a_100000742801_100011215043 [0,2,0,0,0,0|1,0,0]=3 6635 B14R1.16 O=C(CCCO)c1cccc(c1O)F 1458a_100011217230_100011215043 [0,2,0,0,0,0|1,0,0]=3 6636 B14R1.16 O=C(CCCO)c1cccc(c1O)O 1458a_100000690420_100011215043 [0,2,0,0,0,0|1,0,0]=3 6637 B14R1.16 O=C(NCCF)c1cccc(c1Br)Br 11a_100000724931_100012360534 [0,2,0,0,0,0|2,0,0]=4 6638 B14R1.16 O=C(NCCF)c1cccc(c1Br)Br 1626a_100000724931_100012360534 [0,2,0,0,0,0|2,0,0]=4 6639 B14R1.16 O=C(NCCF)c1cccc(c1Br)Br 240690a_100000724931_100012360534 [0,2,0,0,0,0|2,0,0]=4 6640 B14R1.16 O=C(NCCF)c1cccc(c1Br)Br 527a_100000724931_100012360534 [0,2,0,0,0,0|2,0,0]=4 6641 B14R1.16 O=C(NCCF)c1cccc(c1Br)Cl 11a_100000724931_100012339722 [0,2,0,0,0,0|2,0,0]=4 6642 B14R1.16 O=C(NCCF)c1cccc(c1Br)Cl 1626a_100000724931_100012339722 [0,2,0,0,0,0|2,0,0]=4 6643 B14R1.16 O=C(NCCF)c1cccc(c1Br)Cl 240690a_100000724931_100012339722 [0,2,0,0,0,0|2,0,0]=4 6644 B14R1.16 O=C(NCCF)c1cccc(c1Br)Cl 527a_100000724931_100012339722 [0,2,0,0,0,0|2,0,0]=4 6645 B14R1.16 O=C(NCCF)c1cccc(c1Br)F 11a_100000724931_100011217547 [0,2,0,0,0,0|2,0,0]=4 6646 B14R1.16 O=C(NCCF)c1cccc(c1Br)F 1626a_100000724931_100011217547 [0,2,0,0,0,0|2,0,0]=4 6647 B14R1.16 O=C(NCCF)c1cccc(c1Br)F 240690a_100000724931_100011217547 [0,2,0,0,0,0|2,0,0]=4 6648 B14R1.16 O=C(NCCF)c1cccc(c1Br)F 527a_100000724931_100011217547 [0,2,0,0,0,0|2,0,0]=4 6649 B14R1.16 O=C(NCCF)c1cccc(c1Br)I 11a_100000724931_100010232522 [0,2,0,0,0,0|2,0,0]=4 6650 B14R1.16 O=C(NCCF)c1cccc(c1Br)I 1626a_100000724931_100010232522 [0,2,0,0,0,0|2,0,0]=4 6651 B14R1.16 O=C(NCCF)c1cccc(c1Br)I 240690a_100000724931_100010232522 [0,2,0,0,0,0|2,0,0]=4 6652 B14R1.16 O=C(NCCF)c1cccc(c1Br)I 527a_100000724931_100010232522 [0,2,0,0,0,0|2,0,0]=4 6653 B14R1.16 O=C(NCCF)c1cccc(c1Br)O 240690a_100000724931_100010230362 [0,2,0,0,0,0|2,0,0]=4 6654 B14R1.16 O=C(NCCF)c1cccc(c1Br)O 527a_100000724931_100010230362 [0,2,0,0,0,0|2,0,0]=4 6655 B14R1.16 O=C(NCCF)c1cccc(c1Cl)Br 11a_100000724931_100000760540 [0,2,0,0,0,0|2,0,0]=4 6656 B14R1.16 O=C(NCCF)c1cccc(c1Cl)Br 1626a_100000724931_100000760540 [0,2,0,0,0,0|2,0,0]=4 6657 B14R1.16 O=C(NCCF)c1cccc(c1Cl)Br 240690a_100000724931_100000760540 [0,2,0,0,0,0|2,0,0]=4 6658 B14R1.16 O=C(NCCF)c1cccc(c1Cl)Br 527a_100000724931_100000760540 [0,2,0,0,0,0|2,0,0]=4 6659 B14R1.16 O=C(NCCF)c1cccc(c1Cl)Cl 11a_100000724931_100000183631 [0,2,0,0,0,0|2,0,0]=4 6660 B14R1.16 O=C(NCCF)c1cccc(c1Cl)Cl 1626a_100000724931_100000183631 [0,2,0,0,0,0|2,0,0]=4 6661 B14R1.16 O=C(NCCF)c1cccc(c1Cl)Cl 240690a_100000724931_100000183631 [0,2,0,0,0,0|2,0,0]=4 6662 B14R1.16 O=C(NCCF)c1cccc(c1Cl)Cl 527a_100000724931_100000183631 [0,2,0,0,0,0|2,0,0]=4 6663 B14R1.16 O=C(NCCF)c1cccc(c1Cl)F 11a_100000724931_100000759904 [0,2,0,0,0,0|2,0,0]=4 6664 B14R1.16 O=C(NCCF)c1cccc(c1Cl)F 1626a_100000724931_100000759904 [0,2,0,0,0,0|2,0,0]=4 6665 B14R1.16 O=C(NCCF)c1cccc(c1Cl)F 240690a_100000724931_100000759904 [0,2,0,0,0,0|2,0,0]=4 6666 B14R1.16 O=C(NCCF)c1cccc(c1Cl)F 527a_100000724931_100000759904 [0,2,0,0,0,0|2,0,0]=4 6667 B14R1.16 O=C(NCCF)c1cccc(c1Cl)I 11a_100000724931_100010176783 [0,2,0,0,0,0|2,0,0]=4 6668 B14R1.16 O=C(NCCF)c1cccc(c1Cl)I 1626a_100000724931_100010176783 [0,2,0,0,0,0|2,0,0]=4 6669 B14R1.16 O=C(NCCF)c1cccc(c1Cl)I 240690a_100000724931_100010176783 [0,2,0,0,0,0|2,0,0]=4 6670 B14R1.16 O=C(NCCF)c1cccc(c1Cl)I 527a_100000724931_100010176783 [0,2,0,0,0,0|2,0,0]=4 6671 B14R1.16 O=C(NCCF)c1cccc(c1Cl)O 240690a_100000724931_100000092362 [0,2,0,0,0,0|2,0,0]=4 6672 B14R1.16 O=C(NCCF)c1cccc(c1Cl)O 527a_100000724931_100000092362 [0,2,0,0,0,0|2,0,0]=4 6673 B14R1.16 O=C(NCCF)c1cccc(c1F)Br 11a_100000724931_100000756403 [0,2,0,0,0,0|2,0,0]=4 6674 B14R1.16 O=C(NCCF)c1cccc(c1F)Br 1626a_100000724931_100000756403 [0,2,0,0,0,0|2,0,0]=4 6675 B14R1.16 O=C(NCCF)c1cccc(c1F)Br 240690a_100000724931_100000756403 [0,2,0,0,0,0|2,0,0]=4 6676 B14R1.16 O=C(NCCF)c1cccc(c1F)Br 527a_100000724931_100000756403 [0,2,0,0,0,0|2,0,0]=4 6677 B14R1.16 O=C(NCCF)c1cccc(c1F)Cl 11a_100000724931_100000688816 [0,2,0,0,0,0|2,0,0]=4 6678 B14R1.16 O=C(NCCF)c1cccc(c1F)Cl 1626a_100000724931_100000688816 [0,2,0,0,0,0|2,0,0]=4 6679 B14R1.16 O=C(NCCF)c1cccc(c1F)Cl 240690a_100000724931_100000688816 [0,2,0,0,0,0|2,0,0]=4 6680 B14R1.16 O=C(NCCF)c1cccc(c1F)Cl 527a_100000724931_100000688816 [0,2,0,0,0,0|2,0,0]=4 6681 B14R1.16 O=C(NCCF)c1cccc(c1F)F 11a_100000724931_100000748134 [0,2,0,0,0,0|2,0,0]=4 6682 B14R1.16 O=C(NCCF)c1cccc(c1F)F 1626a_100000724931_100000748134 [0,2,0,0,0,0|2,0,0]=4 6683 B14R1.16 O=C(NCCF)c1cccc(c1F)F 240690a_100000724931_100000748134 [0,2,0,0,0,0|2,0,0]=4 6684 B14R1.16 O=C(NCCF)c1cccc(c1F)F 527a_100000724931_100000748134 [0,2,0,0,0,0|2,0,0]=4 6685 B14R1.16 O=C(NCCF)c1cccc(c1F)I 11a_100000724931_100010185205 [0,2,0,0,0,0|2,0,0]=4 6686 B14R1.16 O=C(NCCF)c1cccc(c1F)I 1626a_100000724931_100010185205 [0,2,0,0,0,0|2,0,0]=4 6687 B14R1.16 O=C(NCCF)c1cccc(c1F)I 240690a_100000724931_100010185205 [0,2,0,0,0,0|2,0,0]=4 6688 B14R1.16 O=C(NCCF)c1cccc(c1F)I 527a_100000724931_100010185205 [0,2,0,0,0,0|2,0,0]=4 6689 B14R1.16 O=C(NCCF)c1cccc(c1F)O 240690a_100000724931_100000037433 [0,2,0,0,0,0|2,0,0]=4 6690 B14R1.16 O=C(NCCF)c1cccc(c1F)O 527a_100000724931_100000037433 [0,2,0,0,0,0|2,0,0]=4 6691 B14R1.16 O=C(NCCF)c1cccc(c1I)Br 11a_100000724931_100000688019 [0,2,0,0,0,0|2,0,0]=4 6692 B14R1.16 O=C(NCCF)c1cccc(c1I)Br 1626a_100000724931_100000688019 [0,2,0,0,0,0|2,0,0]=4 6693 B14R1.16 O=C(NCCF)c1cccc(c1I)Br 240690a_100000724931_100000688019 [0,2,0,0,0,0|2,0,0]=4 6694 B14R1.16 O=C(NCCF)c1cccc(c1I)Br 527a_100000724931_100000688019 [0,2,0,0,0,0|2,0,0]=4 6695 B14R1.16 O=C(NCCF)c1cccc(c1I)Cl 11a_100000724931_100010176784 [0,2,0,0,0,0|2,0,0]=4 6696 B14R1.16 O=C(NCCF)c1cccc(c1I)Cl 1626a_100000724931_100010176784 [0,2,0,0,0,0|2,0,0]=4 6697 B14R1.16 O=C(NCCF)c1cccc(c1I)Cl 240690a_100000724931_100010176784 [0,2,0,0,0,0|2,0,0]=4 6698 B14R1.16 O=C(NCCF)c1cccc(c1I)Cl 527a_100000724931_100010176784 [0,2,0,0,0,0|2,0,0]=4 6699 B14R1.16 O=C(NCCF)c1cccc(c1I)F 11a_100000724931_100000690930 [0,2,0,0,0,0|2,0,0]=4 6700 B14R1.16 O=C(NCCF)c1cccc(c1I)F 1626a_100000724931_100000690930 [0,2,0,0,0,0|2,0,0]=4 6701 B14R1.16 O=C(NCCF)c1cccc(c1I)F 240690a_100000724931_100000690930 [0,2,0,0,0,0|2,0,0]=4 6702 B14R1.16 O=C(NCCF)c1cccc(c1I)F 527a_100000724931_100000690930 [0,2,0,0,0,0|2,0,0]=4 6703 B14R1.16 O=C(NCCF)c1cccc(c1I)O 527a_100000724931_100010084636 [0,2,0,0,0,0|2,0,0]=4 6704 B14R1.16 O=C(NCCF)c1cccc(c1O)Br 240690a_100000724931_100000752940 [0,2,0,0,0,0|1,0,0]=3 6705 B14R1.16 O=C(NCCF)c1cccc(c1O)Br 527a_100000724931_100000752940 [0,2,0,0,0,0|1,0,0]=3 6706 B14R1.16 O=C(NCCF)c1cccc(c1O)Cl 240690a_100000724931_100000742801 [0,2,0,0,0,0|1,0,0]=3 6707 B14R1.16 O=C(NCCF)c1cccc(c1O)Cl 527a_100000724931_100000742801 [0,2,0,0,0,0|1,0,0]=3 6708 B14R1.16 O=C(NCCF)c1cccc(c1O)F 240690a_100000724931_100011217230 [0,2,0,0,0,0|1,0,0]=3 6709 B14R1.16 O=C(NCCF)c1cccc(c1O)F 527a_100000724931_100011217230 [0,2,0,0,0,0|1,0,0]=3 6710 B14R1.16 O=C(NCCF)c1cccc(c1O)O 527a_100000724931_100000690420 [0,2,0,0,0,0|1,0,0]=3 6711 B14R1.16 O=C(NCCO)c1cccc(c1Br)Br 240690a_100000210304_100012360534 [0,2,0,0,0,0|2,0,0]=4 6712 B14R1.16 O=C(NCCO)c1cccc(c1Br)Br 527a_100000210304_100012360534 [0,2,0,0,0,0|2,0,0]=4 6713 B14R1.16 O=C(NCCO)c1cccc(c1Br)Cl 240690a_100000210304_100012339722 [0,2,0,0,0,0|2,0,0]=4 6714 B14R1.16 O=C(NCCO)c1cccc(c1Br)Cl 527a_100000210304_100012339722 [0,2,0,0,0,0|2,0,0]=4 6715 B14R1.16 O=C(NCCO)c1cccc(c1Br)F 240690a_100000210304_100011217547 [0,2,0,0,0,0|2,0,0]=4 6716 B14R1.16 O=C(NCCO)c1cccc(c1Br)F 527a_100000210304_100011217547 [0,2,0,0,0,0|2,0,0]=4 6717 B14R1.16 O=C(NCCO)c1cccc(c1Br)I 240690a_100000210304_100010232522 [0,2,0,0,0,0|2,0,0]=4 6718 B14R1.16 O=C(NCCO)c1cccc(c1Br)I 527a_100000210304_100010232522 [0,2,0,0,0,0|2,0,0]=4 6719 B14R1.16 O=C(NCCO)c1cccc(c1Br)O 240690a_100000210304_100010230362 [0,2,0,0,0,0|2,0,0]=4 6720 B14R1.16 O=C(NCCO)c1cccc(c1Br)O 527a_100000210304_100010230362 [0,2,0,0,0,0|2,0,0]=4 6721 B14R1.16 O=C(NCCO)c1cccc(c1Cl)Br 240690a_100000210304_100000760540 [0,2,0,0,0,0|2,0,0]=4 6722 B14R1.16 O=C(NCCO)c1cccc(c1Cl)Br 527a_100000210304_100000760540 [0,2,0,0,0,0|2,0,0]=4 6723 B14R1.16 O=C(NCCO)c1cccc(c1Cl)Cl 240690a_100000210304_100000183631 [0,2,0,0,0,0|2,0,0]=4 6724 B14R1.16 O=C(NCCO)c1cccc(c1Cl)Cl 527a_100000210304_100000183631 [0,2,0,0,0,0|2,0,0]=4 6725 B14R1.16 O=C(NCCO)c1cccc(c1Cl)F 240690a_100000210304_100000759904 [0,2,0,0,0,0|2,0,0]=4 6726 B14R1.16 O=C(NCCO)c1cccc(c1Cl)F 527a_100000210304_100000759904 [0,2,0,0,0,0|2,0,0]=4 6727 B14R1.16 O=C(NCCO)c1cccc(c1Cl)I 240690a_100000210304_100010176783 [0,2,0,0,0,0|2,0,0]=4 6728 B14R1.16 O=C(NCCO)c1cccc(c1Cl)I 527a_100000210304_100010176783 [0,2,0,0,0,0|2,0,0]=4 6729 B14R1.16 O=C(NCCO)c1cccc(c1Cl)O 240690a_100000210304_100000092362 [0,2,0,0,0,0|2,0,0]=4 6730 B14R1.16 O=C(NCCO)c1cccc(c1Cl)O 527a_100000210304_100000092362 [0,2,0,0,0,0|2,0,0]=4 6731 B14R1.16 O=C(NCCO)c1cccc(c1F)Br 240690a_100000210304_100000756403 [0,2,0,0,0,0|2,0,0]=4 6732 B14R1.16 O=C(NCCO)c1cccc(c1F)Br 527a_100000210304_100000756403 [0,2,0,0,0,0|2,0,0]=4 6733 B14R1.16 O=C(NCCO)c1cccc(c1F)Cl 240690a_100000210304_100000688816 [0,2,0,0,0,0|2,0,0]=4 6734 B14R1.16 O=C(NCCO)c1cccc(c1F)Cl 527a_100000210304_100000688816 [0,2,0,0,0,0|2,0,0]=4 6735 B14R1.16 O=C(NCCO)c1cccc(c1F)F 240690a_100000210304_100000748134 [0,2,0,0,0,0|2,0,0]=4 6736 B14R1.16 O=C(NCCO)c1cccc(c1F)F 527a_100000210304_100000748134 [0,2,0,0,0,0|2,0,0]=4 6737 B14R1.16 O=C(NCCO)c1cccc(c1F)I 240690a_100000210304_100010185205 [0,2,0,0,0,0|2,0,0]=4 6738 B14R1.16 O=C(NCCO)c1cccc(c1F)I 527a_100000210304_100010185205 [0,2,0,0,0,0|2,0,0]=4 6739 B14R1.16 O=C(NCCO)c1cccc(c1F)O 240690a_100000210304_100000037433 [0,2,0,0,0,0|2,0,0]=4 6740 B14R1.16 O=C(NCCO)c1cccc(c1F)O 527a_100000210304_100000037433 [0,2,0,0,0,0|2,0,0]=4 6741 B14R1.16 O=C(NCCO)c1cccc(c1I)Br 240690a_100000210304_100000688019 [0,2,0,0,0,0|2,0,0]=4 6742 B14R1.16 O=C(NCCO)c1cccc(c1I)Br 527a_100000210304_100000688019 [0,2,0,0,0,0|2,0,0]=4 6743 B14R1.16 O=C(NCCO)c1cccc(c1I)Cl 240690a_100000210304_100010176784 [0,2,0,0,0,0|2,0,0]=4 6744 B14R1.16 O=C(NCCO)c1cccc(c1I)Cl 527a_100000210304_100010176784 [0,2,0,0,0,0|2,0,0]=4 6745 B14R1.16 O=C(NCCO)c1cccc(c1I)F 240690a_100000210304_100000690930 [0,2,0,0,0,0|2,0,0]=4 6746 B14R1.16 O=C(NCCO)c1cccc(c1I)F 527a_100000210304_100000690930 [0,2,0,0,0,0|2,0,0]=4 6747 B14R1.16 O=C(NCCO)c1cccc(c1I)O 527a_100000210304_100010084636 [0,2,0,0,0,0|2,0,0]=4 6748 B14R1.16 O=C(NCCO)c1cccc(c1O)Br 240690a_100000210304_100000752940 [0,2,0,0,0,0|1,0,0]=3 6749 B14R1.16 O=C(NCCO)c1cccc(c1O)Br 527a_100000210304_100000752940 [0,2,0,0,0,0|1,0,0]=3 6750 B14R1.16 O=C(NCCO)c1cccc(c1O)Cl 240690a_100000210304_100000742801 [0,2,0,0,0,0|1,0,0]=3 6751 B14R1.16 O=C(NCCO)c1cccc(c1O)Cl 527a_100000210304_100000742801 [0,2,0,0,0,0|1,0,0]=3 6752 B14R1.16 O=C(NCCO)c1cccc(c1O)F 240690a_100000210304_100011217230 [0,2,0,0,0,0|1,0,0]=3 6753 B14R1.16 O=C(NCCO)c1cccc(c1O)F 527a_100000210304_100011217230 [0,2,0,0,0,0|1,0,0]=3 6754 B14R1.16 O=C(NCCO)c1cccc(c1O)O 527a_100000210304_100000690420 [0,2,0,0,0,0|1,0,0]=3 6755 B14R1.18 CCC(C)C(=O)c1cccc(c1Br)Br 1458a_100012360534_100000758301 [0,2,0,0,0,0|2,0,0]=4 6756 B14R1.18 CCC(C)C(=O)c1cccc(c1Br)C 1458a_100000692419_100000758301 [0,2,0,0,0,0|2,0,0]=4 6757 B14R1.18 CCC(C)C(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000758301 [0,2,0,0,0,0|2,0,0]=4 6758 B14R1.18 CCC(C)C(=O)c1cccc(c1Br)F 1458a_100011217547_100000758301 [0,2,0,0,0,0|2,0,0]=4 6759 B14R1.18 CCC(C)C(=O)c1cccc(c1Br)I 1458a_100010232522_100000758301 [0,2,0,0,0,0|2,0,0]=4 6760 B14R1.18 CCC(C)C(=O)c1cccc(c1Br)O 1458a_100010230362_100000758301 [0,2,0,0,0,0|2,0,0]=4 6761 B14R1.18 CCC(C)C(=O)c1cccc(c1C)Br 1458a_100000760464_100000758301 [0,2,0,0,0,0|2,0,0]=4 6762 B14R1.18 CCC(C)C(=O)c1cccc(c1C)C 1458a_100000183679_100000758301 [0,2,0,0,0,0|2,0,0]=4 6763 B14R1.18 CCC(C)C(=O)c1cccc(c1C)Cl 1458a_100000690184_100000758301 [0,2,0,0,0,0|2,0,0]=4 6764 B14R1.18 CCC(C)C(=O)c1cccc(c1C)F 1458a_100011218272_100000758301 [0,2,0,0,0,0|2,0,0]=4 6765 B14R1.18 CCC(C)C(=O)c1cccc(c1C)I 1458a_100000751865_100000758301 [0,2,0,0,0,0|2,0,0]=4 6766 B14R1.18 CCC(C)C(=O)c1cccc(c1C)O 1458a_100000766327_100000758301 [0,2,0,0,0,0|2,0,0]=4 6767 B14R1.18 CCC(C)C(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000758301 [0,2,0,0,0,0|2,0,0]=4 6768 B14R1.18 CCC(C)C(=O)c1cccc(c1Cl)C 1458a_100000693142_100000758301 [0,2,0,0,0,0|2,0,0]=4 6769 B14R1.18 CCC(C)C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000758301 [0,2,0,0,0,0|2,0,0]=4 6770 B14R1.18 CCC(C)C(=O)c1cccc(c1Cl)F 1458a_100000759904_100000758301 [0,2,0,0,0,0|2,0,0]=4 6771 B14R1.18 CCC(C)C(=O)c1cccc(c1Cl)I 1458a_100010176783_100000758301 [0,2,0,0,0,0|2,0,0]=4 6772 B14R1.18 CCC(C)C(=O)c1cccc(c1Cl)O 1458a_100000092362_100000758301 [0,2,0,0,0,0|2,0,0]=4 6773 B14R1.18 CCC(C)C(=O)c1cccc(c1F)Br 1458a_100000756403_100000758301 [0,2,0,0,0,0|2,0,0]=4 6774 B14R1.18 CCC(C)C(=O)c1cccc(c1F)C 1458a_100000766181_100000758301 [0,2,0,0,0,0|2,0,0]=4 6775 B14R1.18 CCC(C)C(=O)c1cccc(c1F)Cl 1458a_100000688816_100000758301 [0,2,0,0,0,0|2,0,0]=4 6776 B14R1.18 CCC(C)C(=O)c1cccc(c1F)F 1458a_100000748134_100000758301 [0,2,0,0,0,0|2,0,0]=4 6777 B14R1.18 CCC(C)C(=O)c1cccc(c1F)I 1458a_100010185205_100000758301 [0,2,0,0,0,0|2,0,0]=4 6778 B14R1.18 CCC(C)C(=O)c1cccc(c1F)O 1458a_100000037433_100000758301 [0,2,0,0,0,0|2,0,0]=4 6779 B14R1.18 CCC(C)C(=O)c1cccc(c1I)Br 1458a_100000688019_100000758301 [0,2,0,0,0,0|2,0,0]=4 6780 B14R1.18 CCC(C)C(=O)c1cccc(c1I)C 1458a_100000739377_100000758301 [0,2,0,0,0,0|2,0,0]=4 6781 B14R1.18 CCC(C)C(=O)c1cccc(c1I)Cl 1458a_100010176784_100000758301 [0,2,0,0,0,0|2,0,0]=4 6782 B14R1.18 CCC(C)C(=O)c1cccc(c1I)F 1458a_100000690930_100000758301 [0,2,0,0,0,0|2,0,0]=4 6783 B14R1.18 CCC(C)C(=O)c1cccc(c1I)O 1458a_100010084636_100000758301 [0,2,0,0,0,0|2,0,0]=4 6784 B14R1.18 CCC(C)C(=O)c1cccc(c1O)Br 1458a_100000752940_100000758301 [0,2,0,0,0,0|1,0,0]=3 6785 B14R1.18 CCC(C)C(=O)c1cccc(c1O)C 1458a_100000183896_100000758301 [0,2,0,0,0,0|1,0,0]=3 6786 B14R1.18 CCC(C)C(=O)c1cccc(c1O)Cl 1458a_100000742801_100000758301 [0,2,0,0,0,0|1,0,0]=3 6787 B14R1.18 CCC(C)C(=O)c1cccc(c1O)F 1458a_100011217230_100000758301 [0,2,0,0,0,0|1,0,0]=3 6788 B14R1.18 CCC(C)C(=O)c1cccc(c1O)O 1458a_100000690420_100000758301 [0,2,0,0,0,0|1,0,0]=3 6789 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)Br 11a_100000225621_100012360534 [0,2,0,0,0,0|2,0,0]=4 6790 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)Br 1626a_100000225621_100012360534 [0,2,0,0,0,0|2,0,0]=4 6791 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)Br 240690a_100000225621_100012360534 [0,2,0,0,0,0|2,0,0]=4 6792 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)Br 527a_100000225621_100012360534 [0,2,0,0,0,0|2,0,0]=4 6793 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)C 11a_100000225621_100000692419 [0,2,0,0,0,0|2,0,0]=4 6794 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)C 1626a_100000225621_100000692419 [0,2,0,0,0,0|2,0,0]=4 6795 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)C 240690a_100000225621_100000692419 [0,2,0,0,0,0|2,0,0]=4 6796 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)C 527a_100000225621_100000692419 [0,2,0,0,0,0|2,0,0]=4 6797 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)Cl 11a_100000225621_100012339722 [0,2,0,0,0,0|2,0,0]=4 6798 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)Cl 1626a_100000225621_100012339722 [0,2,0,0,0,0|2,0,0]=4 6799 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)Cl 240690a_100000225621_100012339722 [0,2,0,0,0,0|2,0,0]=4 6800 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)Cl 527a_100000225621_100012339722 [0,2,0,0,0,0|2,0,0]=4 6801 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)F 11a_100000225621_100011217547 [0,2,0,0,0,0|2,0,0]=4 6802 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)F 1626a_100000225621_100011217547 [0,2,0,0,0,0|2,0,0]=4 6803 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)F 240690a_100000225621_100011217547 [0,2,0,0,0,0|2,0,0]=4 6804 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)F 527a_100000225621_100011217547 [0,2,0,0,0,0|2,0,0]=4 6805 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)I 11a_100000225621_100010232522 [0,2,0,0,0,0|2,0,0]=4 6806 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)I 1626a_100000225621_100010232522 [0,2,0,0,0,0|2,0,0]=4 6807 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)I 240690a_100000225621_100010232522 [0,2,0,0,0,0|2,0,0]=4 6808 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)I 527a_100000225621_100010232522 [0,2,0,0,0,0|2,0,0]=4 6809 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)O 240690a_100000225621_100010230362 [0,2,0,0,0,0|2,0,0]=4 6810 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)O 527a_100000225621_100010230362 [0,2,0,0,0,0|2,0,0]=4 6811 B14R1.18 CCN(C)C(=O)c1cccc(c1C)Br 11a_100000225621_100000760464 [0,2,0,0,0,0|2,0,0]=4 6812 B14R1.18 CCN(C)C(=O)c1cccc(c1C)Br 1626a_100000225621_100000760464 [0,2,0,0,0,0|2,0,0]=4 6813 B14R1.18 CCN(C)C(=O)c1cccc(c1C)Br 240690a_100000225621_100000760464 [0,2,0,0,0,0|2,0,0]=4 6814 B14R1.18 CCN(C)C(=O)c1cccc(c1C)Br 527a_100000225621_100000760464 [0,2,0,0,0,0|2,0,0]=4 6815 B14R1.18 CCN(C)C(=O)c1cccc(c1C)C 11a_100000225621_100000183679 [0,2,0,0,0,0|2,0,0]=4 6816 B14R1.18 CCN(C)C(=O)c1cccc(c1C)C 1626a_100000225621_100000183679 [0,2,0,0,0,0|2,0,0]=4 6817 B14R1.18 CCN(C)C(=O)c1cccc(c1C)C 240690a_100000225621_100000183679 [0,2,0,0,0,0|2,0,0]=4 6818 B14R1.18 CCN(C)C(=O)c1cccc(c1C)C 527a_100000225621_100000183679 [0,2,0,0,0,0|2,0,0]=4 6819 B14R1.18 CCN(C)C(=O)c1cccc(c1C)Cl 11a_100000225621_100000690184 [0,2,0,0,0,0|2,0,0]=4 6820 B14R1.18 CCN(C)C(=O)c1cccc(c1C)Cl 1626a_100000225621_100000690184 [0,2,0,0,0,0|2,0,0]=4 6821 B14R1.18 CCN(C)C(=O)c1cccc(c1C)Cl 240690a_100000225621_100000690184 [0,2,0,0,0,0|2,0,0]=4 6822 B14R1.18 CCN(C)C(=O)c1cccc(c1C)Cl 527a_100000225621_100000690184 [0,2,0,0,0,0|2,0,0]=4 6823 B14R1.18 CCN(C)C(=O)c1cccc(c1C)F 11a_100000225621_100011218272 [0,2,0,0,0,0|2,0,0]=4 6824 B14R1.18 CCN(C)C(=O)c1cccc(c1C)F 1626a_100000225621_100011218272 [0,2,0,0,0,0|2,0,0]=4 6825 B14R1.18 CCN(C)C(=O)c1cccc(c1C)F 240690a_100000225621_100011218272 [0,2,0,0,0,0|2,0,0]=4 6826 B14R1.18 CCN(C)C(=O)c1cccc(c1C)F 527a_100000225621_100011218272 [0,2,0,0,0,0|2,0,0]=4 6827 B14R1.18 CCN(C)C(=O)c1cccc(c1C)I 11a_100000225621_100000751865 [0,2,0,0,0,0|2,0,0]=4 6828 B14R1.18 CCN(C)C(=O)c1cccc(c1C)I 1626a_100000225621_100000751865 [0,2,0,0,0,0|2,0,0]=4 6829 B14R1.18 CCN(C)C(=O)c1cccc(c1C)I 240690a_100000225621_100000751865 [0,2,0,0,0,0|2,0,0]=4 6830 B14R1.18 CCN(C)C(=O)c1cccc(c1C)I 527a_100000225621_100000751865 [0,2,0,0,0,0|2,0,0]=4 6831 B14R1.18 CCN(C)C(=O)c1cccc(c1C)O 240690a_100000225621_100000766327 [0,2,0,0,0,0|2,0,0]=4 6832 B14R1.18 CCN(C)C(=O)c1cccc(c1C)O 527a_100000225621_100000766327 [0,2,0,0,0,0|2,0,0]=4 6833 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)Br 11a_100000225621_100000760540 [0,2,0,0,0,0|2,0,0]=4 6834 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)Br 1626a_100000225621_100000760540 [0,2,0,0,0,0|2,0,0]=4 6835 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)Br 240690a_100000225621_100000760540 [0,2,0,0,0,0|2,0,0]=4 6836 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)Br 527a_100000225621_100000760540 [0,2,0,0,0,0|2,0,0]=4 6837 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)C 11a_100000225621_100000693142 [0,2,0,0,0,0|2,0,0]=4 6838 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)C 1626a_100000225621_100000693142 [0,2,0,0,0,0|2,0,0]=4 6839 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)C 240690a_100000225621_100000693142 [0,2,0,0,0,0|2,0,0]=4 6840 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)C 527a_100000225621_100000693142 [0,2,0,0,0,0|2,0,0]=4 6841 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)Cl 11a_100000225621_100000183631 [0,2,0,0,0,0|2,0,0]=4 6842 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)Cl 1626a_100000225621_100000183631 [0,2,0,0,0,0|2,0,0]=4 6843 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)Cl 240690a_100000225621_100000183631 [0,2,0,0,0,0|2,0,0]=4 6844 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)Cl 527a_100000225621_100000183631 [0,2,0,0,0,0|2,0,0]=4 6845 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)F 11a_100000225621_100000759904 [0,2,0,0,0,0|2,0,0]=4 6846 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)F 1626a_100000225621_100000759904 [0,2,0,0,0,0|2,0,0]=4 6847 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)F 240690a_100000225621_100000759904 [0,2,0,0,0,0|2,0,0]=4 6848 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)F 527a_100000225621_100000759904 [0,2,0,0,0,0|2,0,0]=4 6849 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)I 11a_100000225621_100010176783 [0,2,0,0,0,0|2,0,0]=4 6850 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)I 1626a_100000225621_100010176783 [0,2,0,0,0,0|2,0,0]=4 6851 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)I 240690a_100000225621_100010176783 [0,2,0,0,0,0|2,0,0]=4 6852 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)I 527a_100000225621_100010176783 [0,2,0,0,0,0|2,0,0]=4 6853 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)O 240690a_100000225621_100000092362 [0,2,0,0,0,0|2,0,0]=4 6854 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)O 527a_100000225621_100000092362 [0,2,0,0,0,0|2,0,0]=4 6855 B14R1.18 CCN(C)C(=O)c1cccc(c1F)Br 11a_100000225621_100000756403 [0,2,0,0,0,0|2,0,0]=4 6856 B14R1.18 CCN(C)C(=O)c1cccc(c1F)Br 1626a_100000225621_100000756403 [0,2,0,0,0,0|2,0,0]=4 6857 B14R1.18 CCN(C)C(=O)c1cccc(c1F)Br 240690a_100000225621_100000756403 [0,2,0,0,0,0|2,0,0]=4 6858 B14R1.18 CCN(C)C(=O)c1cccc(c1F)Br 527a_100000225621_100000756403 [0,2,0,0,0,0|2,0,0]=4 6859 B14R1.18 CCN(C)C(=O)c1cccc(c1F)C 11a_100000225621_100000766181 [0,2,0,0,0,0|2,0,0]=4 6860 B14R1.18 CCN(C)C(=O)c1cccc(c1F)C 1626a_100000225621_100000766181 [0,2,0,0,0,0|2,0,0]=4 6861 B14R1.18 CCN(C)C(=O)c1cccc(c1F)C 240690a_100000225621_100000766181 [0,2,0,0,0,0|2,0,0]=4 6862 B14R1.18 CCN(C)C(=O)c1cccc(c1F)C 527a_100000225621_100000766181 [0,2,0,0,0,0|2,0,0]=4 6863 B14R1.18 CCN(C)C(=O)c1cccc(c1F)Cl 11a_100000225621_100000688816 [0,2,0,0,0,0|2,0,0]=4 6864 B14R1.18 CCN(C)C(=O)c1cccc(c1F)Cl 1626a_100000225621_100000688816 [0,2,0,0,0,0|2,0,0]=4 6865 B14R1.18 CCN(C)C(=O)c1cccc(c1F)Cl 240690a_100000225621_100000688816 [0,2,0,0,0,0|2,0,0]=4 6866 B14R1.18 CCN(C)C(=O)c1cccc(c1F)Cl 527a_100000225621_100000688816 [0,2,0,0,0,0|2,0,0]=4 6867 B14R1.18 CCN(C)C(=O)c1cccc(c1F)F 11a_100000225621_100000748134 [0,2,0,0,0,0|2,0,0]=4 6868 B14R1.18 CCN(C)C(=O)c1cccc(c1F)F 1626a_100000225621_100000748134 [0,2,0,0,0,0|2,0,0]=4 6869 B14R1.18 CCN(C)C(=O)c1cccc(c1F)F 240690a_100000225621_100000748134 [0,2,0,0,0,0|2,0,0]=4 6870 B14R1.18 CCN(C)C(=O)c1cccc(c1F)F 527a_100000225621_100000748134 [0,2,0,0,0,0|2,0,0]=4 6871 B14R1.18 CCN(C)C(=O)c1cccc(c1F)I 11a_100000225621_100010185205 [0,2,0,0,0,0|2,0,0]=4 6872 B14R1.18 CCN(C)C(=O)c1cccc(c1F)I 1626a_100000225621_100010185205 [0,2,0,0,0,0|2,0,0]=4 6873 B14R1.18 CCN(C)C(=O)c1cccc(c1F)I 240690a_100000225621_100010185205 [0,2,0,0,0,0|2,0,0]=4 6874 B14R1.18 CCN(C)C(=O)c1cccc(c1F)I 527a_100000225621_100010185205 [0,2,0,0,0,0|2,0,0]=4 6875 B14R1.18 CCN(C)C(=O)c1cccc(c1F)O 240690a_100000225621_100000037433 [0,2,0,0,0,0|2,0,0]=4 6876 B14R1.18 CCN(C)C(=O)c1cccc(c1F)O 527a_100000225621_100000037433 [0,2,0,0,0,0|2,0,0]=4 6877 B14R1.18 CCN(C)C(=O)c1cccc(c1I)Br 11a_100000225621_100000688019 [0,2,0,0,0,0|2,0,0]=4 6878 B14R1.18 CCN(C)C(=O)c1cccc(c1I)Br 1626a_100000225621_100000688019 [0,2,0,0,0,0|2,0,0]=4 6879 B14R1.18 CCN(C)C(=O)c1cccc(c1I)Br 240690a_100000225621_100000688019 [0,2,0,0,0,0|2,0,0]=4 6880 B14R1.18 CCN(C)C(=O)c1cccc(c1I)Br 527a_100000225621_100000688019 [0,2,0,0,0,0|2,0,0]=4 6881 B14R1.18 CCN(C)C(=O)c1cccc(c1I)C 11a_100000225621_100000739377 [0,2,0,0,0,0|2,0,0]=4 6882 B14R1.18 CCN(C)C(=O)c1cccc(c1I)C 1626a_100000225621_100000739377 [0,2,0,0,0,0|2,0,0]=4 6883 B14R1.18 CCN(C)C(=O)c1cccc(c1I)C 240690a_100000225621_100000739377 [0,2,0,0,0,0|2,0,0]=4 6884 B14R1.18 CCN(C)C(=O)c1cccc(c1I)C 527a_100000225621_100000739377 [0,2,0,0,0,0|2,0,0]=4 6885 B14R1.18 CCN(C)C(=O)c1cccc(c1I)Cl 11a_100000225621_100010176784 [0,2,0,0,0,0|2,0,0]=4 6886 B14R1.18 CCN(C)C(=O)c1cccc(c1I)Cl 1626a_100000225621_100010176784 [0,2,0,0,0,0|2,0,0]=4 6887 B14R1.18 CCN(C)C(=O)c1cccc(c1I)Cl 240690a_100000225621_100010176784 [0,2,0,0,0,0|2,0,0]=4 6888 B14R1.18 CCN(C)C(=O)c1cccc(c1I)Cl 527a_100000225621_100010176784 [0,2,0,0,0,0|2,0,0]=4 6889 B14R1.18 CCN(C)C(=O)c1cccc(c1I)F 11a_100000225621_100000690930 [0,2,0,0,0,0|2,0,0]=4 6890 B14R1.18 CCN(C)C(=O)c1cccc(c1I)F 1626a_100000225621_100000690930 [0,2,0,0,0,0|2,0,0]=4 6891 B14R1.18 CCN(C)C(=O)c1cccc(c1I)F 240690a_100000225621_100000690930 [0,2,0,0,0,0|2,0,0]=4 6892 B14R1.18 CCN(C)C(=O)c1cccc(c1I)F 527a_100000225621_100000690930 [0,2,0,0,0,0|2,0,0]=4 6893 B14R1.18 CCN(C)C(=O)c1cccc(c1I)O 527a_100000225621_100010084636 [0,2,0,0,0,0|2,0,0]=4 6894 B14R1.18 CCN(C)C(=O)c1cccc(c1O)Br 240690a_100000225621_100000752940 [0,2,0,0,0,0|1,0,0]=3 6895 B14R1.18 CCN(C)C(=O)c1cccc(c1O)Br 527a_100000225621_100000752940 [0,2,0,0,0,0|1,0,0]=3 6896 B14R1.18 CCN(C)C(=O)c1cccc(c1O)C 240690a_100000225621_100000183896 [0,2,0,0,0,0|1,0,0]=3 6897 B14R1.18 CCN(C)C(=O)c1cccc(c1O)C 527a_100000225621_100000183896 [0,2,0,0,0,0|1,0,0]=3 6898 B14R1.18 CCN(C)C(=O)c1cccc(c1O)Cl 240690a_100000225621_100000742801 [0,2,0,0,0,0|1,0,0]=3 6899 B14R1.18 CCN(C)C(=O)c1cccc(c1O)Cl 527a_100000225621_100000742801 [0,2,0,0,0,0|1,0,0]=3 6900 B14R1.18 CCN(C)C(=O)c1cccc(c1O)F 240690a_100000225621_100011217230 [0,2,0,0,0,0|1,0,0]=3 6901 B14R1.18 CCN(C)C(=O)c1cccc(c1O)F 527a_100000225621_100011217230 [0,2,0,0,0,0|1,0,0]=3 6902 B14R1.18 CCN(C)C(=O)c1cccc(c1O)O 527a_100000225621_100000690420 [0,2,0,0,0,0|1,0,0]=3 6903 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100000748629 [0,2,0,0,0,0|1,0,1]=4 6904 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)C 1458a_100000183896_100000748629 [0,2,0,0,0,0|1,0,1]=4 6905 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000748629 [0,2,0,0,0,0|1,0,1]=4 6906 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)F 1458a_100011217230_100000748629 [0,2,0,0,0,0|1,0,1]=4 6907 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)O 1458a_100000690420_100000748629 [0,2,0,0,0,0|1,0,1]=4 6908 B14R1.152 CC(C)CC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210624 [0,2,0,0,0,0|2,0,0]=4 6909 B14R1.152 CC(C)CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210624 [0,2,0,0,0,0|2,0,0]=4 6910 B14R1.152 CC(C)CC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210624 [0,2,0,0,0,0|2,0,0]=4 6911 B14R1.152 CC(C)CC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210624 [0,2,0,0,0,0|2,0,0]=4 6912 B14R1.152 CC(C)CC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210624 [0,2,0,0,0,0|2,0,0]=4 6913 B14R1.152 CC(C)CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210624 [0,2,0,0,0,0|2,0,0]=4 6914 B14R1.152 CC(C)CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210624 [0,2,0,0,0,0|2,0,0]=4 6915 B14R1.152 CC(C)CC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210624 [0,2,0,0,0,0|2,0,0]=4 6916 B14R1.152 CC(C)CC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210624 [0,2,0,0,0,0|2,0,0]=4 6917 B14R1.152 CC(C)CC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210624 [0,2,0,0,0,0|2,0,0]=4 6918 B14R1.152 CC(C)CC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210624 [0,2,0,0,0,0|2,0,0]=4 6919 B14R1.152 CC(C)CC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210624 [0,2,0,0,0,0|2,0,0]=4 6920 B14R1.152 CC(C)CC(=O)c1cccc(c1F)F 1458a_100000748134_100000210624 [0,2,0,0,0,0|2,0,0]=4 6921 B14R1.152 CC(C)CC(=O)c1cccc(c1F)I 1458a_100010185205_100000210624 [0,2,0,0,0,0|2,0,0]=4 6922 B14R1.152 CC(C)CC(=O)c1cccc(c1F)O 1458a_100000037433_100000210624 [0,2,0,0,0,0|2,0,0]=4 6923 B14R1.152 CC(C)CC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210624 [0,2,0,0,0,0|2,0,0]=4 6924 B14R1.152 CC(C)CC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210624 [0,2,0,0,0,0|2,0,0]=4 6925 B14R1.152 CC(C)CC(=O)c1cccc(c1I)F 1458a_100000690930_100000210624 [0,2,0,0,0,0|2,0,0]=4 6926 B14R1.152 CC(C)CC(=O)c1cccc(c1I)O 1458a_100010084636_100000210624 [0,2,0,0,0,0|2,0,0]=4 6927 B14R1.152 CC(C)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210624 [0,2,0,0,0,0|1,0,0]=3 6928 B14R1.152 CC(C)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210624 [0,2,0,0,0,0|1,0,0]=3 6929 B14R1.152 CC(C)CC(=O)c1cccc(c1O)F 1458a_100011217230_100000210624 [0,2,0,0,0,0|1,0,0]=3 6930 B14R1.152 CC(C)CC(=O)c1cccc(c1O)O 1458a_100000690420_100000210624 [0,2,0,0,0,0|1,0,0]=3 6931 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)Br 11a_100138425928_100012360534 [0,2,0,0,0,0|2,0,0]=4 6932 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)Br 1626a_100138425928_100012360534 [0,2,0,0,0,0|2,0,0]=4 6933 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)Br 240690a_100138425928_100012360534 [0,2,0,0,0,0|2,0,0]=4 6934 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)Br 527a_100138425928_100012360534 [0,2,0,0,0,0|2,0,0]=4 6935 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)Cl 11a_100138425928_100012339722 [0,2,0,0,0,0|2,0,0]=4 6936 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)Cl 1626a_100138425928_100012339722 [0,2,0,0,0,0|2,0,0]=4 6937 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)Cl 240690a_100138425928_100012339722 [0,2,0,0,0,0|2,0,0]=4 6938 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)Cl 527a_100138425928_100012339722 [0,2,0,0,0,0|2,0,0]=4 6939 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)F 11a_100138425928_100011217547 [0,2,0,0,0,0|2,0,0]=4 6940 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)F 1626a_100138425928_100011217547 [0,2,0,0,0,0|2,0,0]=4 6941 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)F 240690a_100138425928_100011217547 [0,2,0,0,0,0|2,0,0]=4 6942 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)F 527a_100138425928_100011217547 [0,2,0,0,0,0|2,0,0]=4 6943 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)I 11a_100138425928_100010232522 [0,2,0,0,0,0|2,0,0]=4 6944 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)I 1626a_100138425928_100010232522 [0,2,0,0,0,0|2,0,0]=4 6945 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)I 240690a_100138425928_100010232522 [0,2,0,0,0,0|2,0,0]=4 6946 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)I 527a_100138425928_100010232522 [0,2,0,0,0,0|2,0,0]=4 6947 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)O 240690a_100138425928_100010230362 [0,2,0,0,0,0|2,0,0]=4 6948 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)O 527a_100138425928_100010230362 [0,2,0,0,0,0|2,0,0]=4 6949 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)Br 11a_100138425928_100000760540 [0,2,0,0,0,0|2,0,0]=4 6950 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)Br 1626a_100138425928_100000760540 [0,2,0,0,0,0|2,0,0]=4 6951 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)Br 240690a_100138425928_100000760540 [0,2,0,0,0,0|2,0,0]=4 6952 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)Br 527a_100138425928_100000760540 [0,2,0,0,0,0|2,0,0]=4 6953 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)Cl 11a_100138425928_100000183631 [0,2,0,0,0,0|2,0,0]=4 6954 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)Cl 1626a_100138425928_100000183631 [0,2,0,0,0,0|2,0,0]=4 6955 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)Cl 240690a_100138425928_100000183631 [0,2,0,0,0,0|2,0,0]=4 6956 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)Cl 527a_100138425928_100000183631 [0,2,0,0,0,0|2,0,0]=4 6957 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)F 11a_100138425928_100000759904 [0,2,0,0,0,0|2,0,0]=4 6958 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)F 1626a_100138425928_100000759904 [0,2,0,0,0,0|2,0,0]=4 6959 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)F 240690a_100138425928_100000759904 [0,2,0,0,0,0|2,0,0]=4 6960 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)F 527a_100138425928_100000759904 [0,2,0,0,0,0|2,0,0]=4 6961 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)I 11a_100138425928_100010176783 [0,2,0,0,0,0|2,0,0]=4 6962 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)I 1626a_100138425928_100010176783 [0,2,0,0,0,0|2,0,0]=4 6963 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)I 240690a_100138425928_100010176783 [0,2,0,0,0,0|2,0,0]=4 6964 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)I 527a_100138425928_100010176783 [0,2,0,0,0,0|2,0,0]=4 6965 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)O 240690a_100138425928_100000092362 [0,2,0,0,0,0|2,0,0]=4 6966 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)O 527a_100138425928_100000092362 [0,2,0,0,0,0|2,0,0]=4 6967 B14R1.152 CC(C)NC(=O)c1cccc(c1F)Br 11a_100138425928_100000756403 [0,2,0,0,0,0|2,0,0]=4 6968 B14R1.152 CC(C)NC(=O)c1cccc(c1F)Br 1626a_100138425928_100000756403 [0,2,0,0,0,0|2,0,0]=4 6969 B14R1.152 CC(C)NC(=O)c1cccc(c1F)Br 240690a_100138425928_100000756403 [0,2,0,0,0,0|2,0,0]=4 6970 B14R1.152 CC(C)NC(=O)c1cccc(c1F)Br 527a_100138425928_100000756403 [0,2,0,0,0,0|2,0,0]=4 6971 B14R1.152 CC(C)NC(=O)c1cccc(c1F)Cl 11a_100138425928_100000688816 [0,2,0,0,0,0|2,0,0]=4 6972 B14R1.152 CC(C)NC(=O)c1cccc(c1F)Cl 1626a_100138425928_100000688816 [0,2,0,0,0,0|2,0,0]=4 6973 B14R1.152 CC(C)NC(=O)c1cccc(c1F)Cl 240690a_100138425928_100000688816 [0,2,0,0,0,0|2,0,0]=4 6974 B14R1.152 CC(C)NC(=O)c1cccc(c1F)Cl 527a_100138425928_100000688816 [0,2,0,0,0,0|2,0,0]=4 6975 B14R1.152 CC(C)NC(=O)c1cccc(c1F)F 11a_100138425928_100000748134 [0,2,0,0,0,0|2,0,0]=4 6976 B14R1.152 CC(C)NC(=O)c1cccc(c1F)F 1626a_100138425928_100000748134 [0,2,0,0,0,0|2,0,0]=4 6977 B14R1.152 CC(C)NC(=O)c1cccc(c1F)F 240690a_100138425928_100000748134 [0,2,0,0,0,0|2,0,0]=4 6978 B14R1.152 CC(C)NC(=O)c1cccc(c1F)F 527a_100138425928_100000748134 [0,2,0,0,0,0|2,0,0]=4 6979 B14R1.152 CC(C)NC(=O)c1cccc(c1F)I 11a_100138425928_100010185205 [0,2,0,0,0,0|2,0,0]=4 6980 B14R1.152 CC(C)NC(=O)c1cccc(c1F)I 1626a_100138425928_100010185205 [0,2,0,0,0,0|2,0,0]=4 6981 B14R1.152 CC(C)NC(=O)c1cccc(c1F)I 240690a_100138425928_100010185205 [0,2,0,0,0,0|2,0,0]=4 6982 B14R1.152 CC(C)NC(=O)c1cccc(c1F)I 527a_100138425928_100010185205 [0,2,0,0,0,0|2,0,0]=4 6983 B14R1.152 CC(C)NC(=O)c1cccc(c1F)O 240690a_100138425928_100000037433 [0,2,0,0,0,0|2,0,0]=4 6984 B14R1.152 CC(C)NC(=O)c1cccc(c1F)O 527a_100138425928_100000037433 [0,2,0,0,0,0|2,0,0]=4 6985 B14R1.152 CC(C)NC(=O)c1cccc(c1I)Br 11a_100138425928_100000688019 [0,2,0,0,0,0|2,0,0]=4 6986 B14R1.152 CC(C)NC(=O)c1cccc(c1I)Br 1626a_100138425928_100000688019 [0,2,0,0,0,0|2,0,0]=4 6987 B14R1.152 CC(C)NC(=O)c1cccc(c1I)Br 240690a_100138425928_100000688019 [0,2,0,0,0,0|2,0,0]=4 6988 B14R1.152 CC(C)NC(=O)c1cccc(c1I)Br 527a_100138425928_100000688019 [0,2,0,0,0,0|2,0,0]=4 6989 B14R1.152 CC(C)NC(=O)c1cccc(c1I)Cl 11a_100138425928_100010176784 [0,2,0,0,0,0|2,0,0]=4 6990 B14R1.152 CC(C)NC(=O)c1cccc(c1I)Cl 1626a_100138425928_100010176784 [0,2,0,0,0,0|2,0,0]=4 6991 B14R1.152 CC(C)NC(=O)c1cccc(c1I)Cl 240690a_100138425928_100010176784 [0,2,0,0,0,0|2,0,0]=4 6992 B14R1.152 CC(C)NC(=O)c1cccc(c1I)Cl 527a_100138425928_100010176784 [0,2,0,0,0,0|2,0,0]=4 6993 B14R1.152 CC(C)NC(=O)c1cccc(c1I)F 11a_100138425928_100000690930 [0,2,0,0,0,0|2,0,0]=4 6994 B14R1.152 CC(C)NC(=O)c1cccc(c1I)F 1626a_100138425928_100000690930 [0,2,0,0,0,0|2,0,0]=4 6995 B14R1.152 CC(C)NC(=O)c1cccc(c1I)F 240690a_100138425928_100000690930 [0,2,0,0,0,0|2,0,0]=4 6996 B14R1.152 CC(C)NC(=O)c1cccc(c1I)F 527a_100138425928_100000690930 [0,2,0,0,0,0|2,0,0]=4 6997 B14R1.152 CC(C)NC(=O)c1cccc(c1I)O 527a_100138425928_100010084636 [0,2,0,0,0,0|2,0,0]=4 6998 B14R1.152 CC(C)NC(=O)c1cccc(c1O)Br 240690a_100138425928_100000752940 [0,2,0,0,0,0|1,0,0]=3 6999 B14R1.152 CC(C)NC(=O)c1cccc(c1O)Br 527a_100138425928_100000752940 [0,2,0,0,0,0|1,0,0]=3 7000 B14R1.152 CC(C)NC(=O)c1cccc(c1O)Cl 240690a_100138425928_100000742801 [0,2,0,0,0,0|1,0,0]=3 7001 B14R1.152 CC(C)NC(=O)c1cccc(c1O)Cl 527a_100138425928_100000742801 [0,2,0,0,0,0|1,0,0]=3 7002 B14R1.152 CC(C)NC(=O)c1cccc(c1O)F 240690a_100138425928_100011217230 [0,2,0,0,0,0|1,0,0]=3 7003 B14R1.152 CC(C)NC(=O)c1cccc(c1O)F 527a_100138425928_100011217230 [0,2,0,0,0,0|1,0,0]=3 7004 B14R1.152 CC(C)NC(=O)c1cccc(c1O)O 527a_100138425928_100000690420 [0,2,0,0,0,0|1,0,0]=3 7005 B14R1.152 CC(O)CC(=O)c1cccc(c1Br)Br 1458a_100012360534_100011218427 [0,2,0,0,0,0|2,0,0]=4 7006 B14R1.152 CC(O)CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100011218427 [0,2,0,0,0,0|2,0,0]=4 7007 B14R1.152 CC(O)CC(=O)c1cccc(c1Br)F 1458a_100011217547_100011218427 [0,2,0,0,0,0|2,0,0]=4 7008 B14R1.152 CC(O)CC(=O)c1cccc(c1Br)I 1458a_100010232522_100011218427 [0,2,0,0,0,0|2,0,0]=4 7009 B14R1.152 CC(O)CC(=O)c1cccc(c1Br)O 1458a_100010230362_100011218427 [0,2,0,0,0,0|2,0,0]=4 7010 B14R1.152 CC(O)CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100011218427 [0,2,0,0,0,0|2,0,0]=4 7011 B14R1.152 CC(O)CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100011218427 [0,2,0,0,0,0|2,0,0]=4 7012 B14R1.152 CC(O)CC(=O)c1cccc(c1Cl)F 1458a_100000759904_100011218427 [0,2,0,0,0,0|2,0,0]=4 7013 B14R1.152 CC(O)CC(=O)c1cccc(c1Cl)I 1458a_100010176783_100011218427 [0,2,0,0,0,0|2,0,0]=4 7014 B14R1.152 CC(O)CC(=O)c1cccc(c1Cl)O 1458a_100000092362_100011218427 [0,2,0,0,0,0|2,0,0]=4 7015 B14R1.152 CC(O)CC(=O)c1cccc(c1F)Br 1458a_100000756403_100011218427 [0,2,0,0,0,0|2,0,0]=4 7016 B14R1.152 CC(O)CC(=O)c1cccc(c1F)Cl 1458a_100000688816_100011218427 [0,2,0,0,0,0|2,0,0]=4 7017 B14R1.152 CC(O)CC(=O)c1cccc(c1F)F 1458a_100000748134_100011218427 [0,2,0,0,0,0|2,0,0]=4 7018 B14R1.152 CC(O)CC(=O)c1cccc(c1F)I 1458a_100010185205_100011218427 [0,2,0,0,0,0|2,0,0]=4 7019 B14R1.152 CC(O)CC(=O)c1cccc(c1F)O 1458a_100000037433_100011218427 [0,2,0,0,0,0|2,0,0]=4 7020 B14R1.152 CC(O)CC(=O)c1cccc(c1I)Br 1458a_100000688019_100011218427 [0,2,0,0,0,0|2,0,0]=4 7021 B14R1.152 CC(O)CC(=O)c1cccc(c1I)Cl 1458a_100010176784_100011218427 [0,2,0,0,0,0|2,0,0]=4 7022 B14R1.152 CC(O)CC(=O)c1cccc(c1I)F 1458a_100000690930_100011218427 [0,2,0,0,0,0|2,0,0]=4 7023 B14R1.152 CC(O)CC(=O)c1cccc(c1I)O 1458a_100010084636_100011218427 [0,2,0,0,0,0|2,0,0]=4 7024 B14R1.152 CC(O)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100011218427 [0,2,0,0,0,0|1,0,0]=3 7025 B14R1.152 CC(O)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011218427 [0,2,0,0,0,0|1,0,0]=3 7026 B14R1.152 CC(O)CC(=O)c1cccc(c1O)F 1458a_100011217230_100011218427 [0,2,0,0,0,0|1,0,0]=3 7027 B14R1.152 CC(O)CC(=O)c1cccc(c1O)O 1458a_100000690420_100011218427 [0,2,0,0,0,0|1,0,0]=3 7028 B14R1.152 Cc1c(cccc1C(=O)CC(C)C)Br 1458a_100000760464_100000210624 [0,2,0,0,0,0|2,0,0]=4 7029 B14R1.152 Cc1c(cccc1C(=O)CC(C)C)Cl 1458a_100000690184_100000210624 [0,2,0,0,0,0|2,0,0]=4 7030 B14R1.152 Cc1c(cccc1C(=O)CC(C)C)F 1458a_100011218272_100000210624 [0,2,0,0,0,0|2,0,0]=4 7031 B14R1.152 Cc1c(cccc1C(=O)CC(C)C)I 1458a_100000751865_100000210624 [0,2,0,0,0,0|2,0,0]=4 7032 B14R1.152 Cc1c(cccc1C(=O)CC(C)C)O 1458a_100000766327_100000210624 [0,2,0,0,0,0|2,0,0]=4 7033 B14R1.152 Cc1c(cccc1C(=O)CC(C)O)Br 1458a_100000760464_100011218427 [0,2,0,0,0,0|2,0,0]=4 7034 B14R1.152 Cc1c(cccc1C(=O)CC(C)O)Cl 1458a_100000690184_100011218427 [0,2,0,0,0,0|2,0,0]=4 7035 B14R1.152 Cc1c(cccc1C(=O)CC(C)O)F 1458a_100011218272_100011218427 [0,2,0,0,0,0|2,0,0]=4 7036 B14R1.152 Cc1c(cccc1C(=O)CC(C)O)I 1458a_100000751865_100011218427 [0,2,0,0,0,0|2,0,0]=4 7037 B14R1.152 Cc1c(cccc1C(=O)CC(C)O)O 1458a_100000766327_100011218427 [0,2,0,0,0,0|2,0,0]=4 7038 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)Br 11a_100138425928_100000760464 [0,2,0,0,0,0|2,0,0]=4 7039 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)Br 1626a_100138425928_100000760464 [0,2,0,0,0,0|2,0,0]=4 7040 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)Br 240690a_100138425928_100000760464 [0,2,0,0,0,0|2,0,0]=4 7041 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)Br 527a_100138425928_100000760464 [0,2,0,0,0,0|2,0,0]=4 7042 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)Cl 11a_100138425928_100000690184 [0,2,0,0,0,0|2,0,0]=4 7043 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)Cl 1626a_100138425928_100000690184 [0,2,0,0,0,0|2,0,0]=4 7044 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)Cl 240690a_100138425928_100000690184 [0,2,0,0,0,0|2,0,0]=4 7045 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)Cl 527a_100138425928_100000690184 [0,2,0,0,0,0|2,0,0]=4 7046 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)F 11a_100138425928_100011218272 [0,2,0,0,0,0|2,0,0]=4 7047 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)F 1626a_100138425928_100011218272 [0,2,0,0,0,0|2,0,0]=4 7048 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)F 240690a_100138425928_100011218272 [0,2,0,0,0,0|2,0,0]=4 7049 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)F 527a_100138425928_100011218272 [0,2,0,0,0,0|2,0,0]=4 7050 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)I 11a_100138425928_100000751865 [0,2,0,0,0,0|2,0,0]=4 7051 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)I 1626a_100138425928_100000751865 [0,2,0,0,0,0|2,0,0]=4 7052 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)I 240690a_100138425928_100000751865 [0,2,0,0,0,0|2,0,0]=4 7053 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)I 527a_100138425928_100000751865 [0,2,0,0,0,0|2,0,0]=4 7054 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)O 240690a_100138425928_100000766327 [0,2,0,0,0,0|2,0,0]=4 7055 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)O 527a_100138425928_100000766327 [0,2,0,0,0,0|2,0,0]=4 7056 B14R1.152 Cc1cccc(c1Br)C(=O)CC(C)C 1458a_100000692419_100000210624 [0,2,0,0,0,0|2,0,0]=4 7057 B14R1.152 Cc1cccc(c1Br)C(=O)CC(C)O 1458a_100000692419_100011218427 [0,2,0,0,0,0|2,0,0]=4 7058 B14R1.152 Cc1cccc(c1Br)C(=O)NC(C)C 11a_100138425928_100000692419 [0,2,0,0,0,0|2,0,0]=4 7059 B14R1.152 Cc1cccc(c1Br)C(=O)NC(C)C 1626a_100138425928_100000692419 [0,2,0,0,0,0|2,0,0]=4 7060 B14R1.152 Cc1cccc(c1Br)C(=O)NC(C)C 240690a_100138425928_100000692419 [0,2,0,0,0,0|2,0,0]=4 7061 B14R1.152 Cc1cccc(c1Br)C(=O)NC(C)C 527a_100138425928_100000692419 [0,2,0,0,0,0|2,0,0]=4 7062 B14R1.152 Cc1cccc(c1C)C(=O)CC(C)C 1458a_100000183679_100000210624 [0,2,0,0,0,0|2,0,0]=4 7063 B14R1.152 Cc1cccc(c1C)C(=O)CC(C)O 1458a_100000183679_100011218427 [0,2,0,0,0,0|2,0,0]=4 7064 B14R1.152 Cc1cccc(c1C)C(=O)NC(C)C 11a_100138425928_100000183679 [0,2,0,0,0,0|2,0,0]=4 7065 B14R1.152 Cc1cccc(c1C)C(=O)NC(C)C 1626a_100138425928_100000183679 [0,2,0,0,0,0|2,0,0]=4 7066 B14R1.152 Cc1cccc(c1C)C(=O)NC(C)C 240690a_100138425928_100000183679 [0,2,0,0,0,0|2,0,0]=4 7067 B14R1.152 Cc1cccc(c1C)C(=O)NC(C)C 527a_100138425928_100000183679 [0,2,0,0,0,0|2,0,0]=4 7068 B14R1.152 Cc1cccc(c1Cl)C(=O)CC(C)C 1458a_100000693142_100000210624 [0,2,0,0,0,0|2,0,0]=4 7069 B14R1.152 Cc1cccc(c1Cl)C(=O)CC(C)O 1458a_100000693142_100011218427 [0,2,0,0,0,0|2,0,0]=4 7070 B14R1.152 Cc1cccc(c1Cl)C(=O)NC(C)C 11a_100138425928_100000693142 [0,2,0,0,0,0|2,0,0]=4 7071 B14R1.152 Cc1cccc(c1Cl)C(=O)NC(C)C 1626a_100138425928_100000693142 [0,2,0,0,0,0|2,0,0]=4 7072 B14R1.152 Cc1cccc(c1Cl)C(=O)NC(C)C 240690a_100138425928_100000693142 [0,2,0,0,0,0|2,0,0]=4 7073 B14R1.152 Cc1cccc(c1Cl)C(=O)NC(C)C 527a_100138425928_100000693142 [0,2,0,0,0,0|2,0,0]=4 7074 B14R1.152 Cc1cccc(c1F)C(=O)CC(C)C 1458a_100000766181_100000210624 [0,2,0,0,0,0|2,0,0]=4 7075 B14R1.152 Cc1cccc(c1F)C(=O)CC(C)O 1458a_100000766181_100011218427 [0,2,0,0,0,0|2,0,0]=4 7076 B14R1.152 Cc1cccc(c1F)C(=O)NC(C)C 11a_100138425928_100000766181 [0,2,0,0,0,0|2,0,0]=4 7077 B14R1.152 Cc1cccc(c1F)C(=O)NC(C)C 1626a_100138425928_100000766181 [0,2,0,0,0,0|2,0,0]=4 7078 B14R1.152 Cc1cccc(c1F)C(=O)NC(C)C 240690a_100138425928_100000766181 [0,2,0,0,0,0|2,0,0]=4 7079 B14R1.152 Cc1cccc(c1F)C(=O)NC(C)C 527a_100138425928_100000766181 [0,2,0,0,0,0|2,0,0]=4 7080 B14R1.152 Cc1cccc(c1I)C(=O)CC(C)C 1458a_100000739377_100000210624 [0,2,0,0,0,0|2,0,0]=4 7081 B14R1.152 Cc1cccc(c1I)C(=O)CC(C)O 1458a_100000739377_100011218427 [0,2,0,0,0,0|2,0,0]=4 7082 B14R1.152 Cc1cccc(c1I)C(=O)NC(C)C 11a_100138425928_100000739377 [0,2,0,0,0,0|2,0,0]=4 7083 B14R1.152 Cc1cccc(c1I)C(=O)NC(C)C 1626a_100138425928_100000739377 [0,2,0,0,0,0|2,0,0]=4 7084 B14R1.152 Cc1cccc(c1I)C(=O)NC(C)C 240690a_100138425928_100000739377 [0,2,0,0,0,0|2,0,0]=4 7085 B14R1.152 Cc1cccc(c1I)C(=O)NC(C)C 527a_100138425928_100000739377 [0,2,0,0,0,0|2,0,0]=4 7086 B14R1.152 Cc1cccc(c1O)C(=O)CC(C)C 1458a_100000183896_100000210624 [0,2,0,0,0,0|1,0,0]=3 7087 B14R1.152 Cc1cccc(c1O)C(=O)CC(C)O 1458a_100000183896_100011218427 [0,2,0,0,0,0|1,0,0]=3 7088 B14R1.152 Cc1cccc(c1O)C(=O)CC(F)F 1458a_100000183896_100011934356 [0,2,0,0,0,0|2,0,0]=4 7089 B14R1.152 Cc1cccc(c1O)C(=O)NC(C)C 240690a_100138425928_100000183896 [0,2,0,0,0,0|1,0,0]=3 7090 B14R1.152 Cc1cccc(c1O)C(=O)NC(C)C 527a_100138425928_100000183896 [0,2,0,0,0,0|1,0,0]=3 7091 B14R1.152 O=C(CC(F)F)c1cccc(c1O)Br 1458a_100000752940_100011934356 [0,2,0,0,0,0|2,0,0]=4 7092 B14R1.152 O=C(CC(F)F)c1cccc(c1O)Cl 1458a_100000742801_100011934356 [0,2,0,0,0,0|2,0,0]=4 7093 B14R1.152 O=C(CC(F)F)c1cccc(c1O)F 1458a_100011217230_100011934356 [0,2,0,0,0,0|2,0,0]=4 7094 B14R1.152 O=C(CC(F)F)c1cccc(c1O)O 1458a_100000690420_100011934356 [0,2,0,0,0,0|2,0,0]=4 7095 B14R1.618 C=Cc1cccc(c1C)C(=O)OCC 271570a_100011290941_100012298221 [0,2,0,0,0,0|1,0,0]=3 7096 B14R1.618 C=Cc1cccc(c1F)C(=O)OCC 271570a_100011290941_100012350793 [0,2,0,0,0,0|1,0,0]=3 7097 B14R1.618 C=Cc1cccc(c1N)C(=O)OCC 271570a_100011290941_200011356557 [0,2,0,0,0,0|1,0,0]=3 7098 B14R1.618 C=Cc1ccnc(c1F)C(=O)OCC 271570a_100011290941_100010222487 [0,2,0,0,0,0|2,0,0]=4 7099 B14R1.618 C=Cc1cncc(c1C)C(=O)OCC 271570a_100011290941_100000726969 [0,2,0,0,0,0|2,0,0]=4 7100 B14R1.618 C=Cc1cncc(c1N)C(=O)OCC 271570a_100011290941_100010080842 [0,2,0,0,0,0|2,0,0]=4 7101 B14R1.618 C=Cc1nccc(c1C)C(=O)OCC 271570a_100011290941_100000080207 [0,2,0,0,0,0|2,0,0]=4 7102 B14R1.618 CCCC(=O)c1cccc(c1Br)OC 1458a_100010245468_100000210303 [0,2,0,0,0,0|2,0,0]=4 7103 B14R1.618 CCCC(=O)c1cccc(c1C)OC 1458a_100011217801_100000210303 [0,2,0,0,0,0|2,0,0]=4 7104 B14R1.618 CCCC(=O)c1cccc(c1Cl)C#N 1458a_100009860865_100000210303 [0,2,0,0,0,0|2,0,0]=4 7105 B14R1.618 CCCC(=O)c1cccc(c1Cl)OC 1458a_100000068443_100000210303 [0,2,0,0,0,0|2,0,0]=4 7106 B14R1.618 CCCC(=O)c1cccc(c1F)C#N 1458a_100011999812_100000210303 [0,2,0,0,0,0|2,0,0]=4 7107 B14R1.618 CCCC(=O)c1cccc(c1F)OC 1458a_100000766180_100000210303 [0,2,0,0,0,0|2,0,0]=4 7108 B14R1.618 CCCC(=O)c1cccc(c1I)OC 1458a_100010075502_100000210303 [0,2,0,0,0,0|2,0,0]=4 7109 B14R1.618 CCCC(=O)c1cccc(c1O)C#N 1458a_100009886288_100000210303 [0,2,0,0,0,0|1,0,0]=3 7110 B14R1.618 CCCC(=O)c1cccc(c1O)OC 1458a_100000212136_100000210303 [0,2,0,0,0,0|1,0,0]=3 7111 B14R1.618 CCNC(=O)c1cccc(c1Br)OC 11a_100015525214_100010245468 [0,2,0,0,0,0|2,0,0]=4 7112 B14R1.618 CCNC(=O)c1cccc(c1Br)OC 240690a_100015525214_100010245468 [0,2,0,0,0,0|2,0,0]=4 7113 B14R1.618 CCNC(=O)c1cccc(c1Br)OC 527a_100015525214_100010245468 [0,2,0,0,0,0|2,0,0]=4 7114 B14R1.618 CCNC(=O)c1cccc(c1C)NC 34a_200011193780_200000210301 [0,2,0,0,0,0|2,0,0]=4 7115 B14R1.618 CCNC(=O)c1cccc(c1C)NC 7a_200011193780_200000210301 [0,2,0,0,0,0|2,0,0]=4 7116 B14R1.618 CCNC(=O)c1cccc(c1C)N[13CH3] 34a_200011193780_200025704644 [0,2,0,0,0,0|2,0,0]=4 7117 B14R1.618 CCNC(=O)c1cccc(c1C)N[13CH3] 7a_200011193780_200025704644 [0,2,0,0,0,0|2,0,0]=4 7118 B14R1.618 CCNC(=O)c1cccc(c1C)OC 11a_100015525214_100011217801 [0,2,0,0,0,0|2,0,0]=4 7119 B14R1.618 CCNC(=O)c1cccc(c1C)OC 240690a_100015525214_100011217801 [0,2,0,0,0,0|2,0,0]=4 7120 B14R1.618 CCNC(=O)c1cccc(c1C)OC 527a_100015525214_100011217801 [0,2,0,0,0,0|2,0,0]=4 7121 B14R1.618 CCNC(=O)c1cccc(c1Cl)C#N 11a_100015525214_100009860865 [0,2,0,0,0,0|2,0,0]=4 7122 B14R1.618 CCNC(=O)c1cccc(c1Cl)C#N 527a_100015525214_100009860865 [0,2,0,0,0,0|2,0,0]=4 7123 B14R1.618 CCNC(=O)c1cccc(c1Cl)OC 11a_100015525214_100000068443 [0,2,0,0,0,0|2,0,0]=4 7124 B14R1.618 CCNC(=O)c1cccc(c1Cl)OC 240690a_100015525214_100000068443 [0,2,0,0,0,0|2,0,0]=4 7125 B14R1.618 CCNC(=O)c1cccc(c1Cl)OC 527a_100015525214_100000068443 [0,2,0,0,0,0|2,0,0]=4 7126 B14R1.618 CCNC(=O)c1cccc(c1F)C#N 11a_100015525214_100011999812 [0,2,0,0,0,0|2,0,0]=4 7127 B14R1.618 CCNC(=O)c1cccc(c1F)C#N 240690a_100015525214_100011999812 [0,2,0,0,0,0|2,0,0]=4 7128 B14R1.618 CCNC(=O)c1cccc(c1F)C#N 527a_100015525214_100011999812 [0,2,0,0,0,0|2,0,0]=4 7129 B14R1.618 CCNC(=O)c1cccc(c1F)OC 11a_100015525214_100000766180 [0,2,0,0,0,0|2,0,0]=4 7130 B14R1.618 CCNC(=O)c1cccc(c1F)OC 240690a_100015525214_100000766180 [0,2,0,0,0,0|2,0,0]=4 7131 B14R1.618 CCNC(=O)c1cccc(c1F)OC 527a_100015525214_100000766180 [0,2,0,0,0,0|2,0,0]=4 7132 B14R1.618 CCNC(=O)c1cccc(c1I)OC 11a_100015525214_100010075502 [0,2,0,0,0,0|2,0,0]=4 7133 B14R1.618 CCNC(=O)c1cccc(c1I)OC 240690a_100015525214_100010075502 [0,2,0,0,0,0|2,0,0]=4 7134 B14R1.618 CCNC(=O)c1cccc(c1I)OC 527a_100015525214_100010075502 [0,2,0,0,0,0|2,0,0]=4 7135 B14R1.618 CCNC(=O)c1cccc(c1O)C#N 527a_100015525214_100009886288 [0,2,0,0,0,0|1,0,0]=3 7136 B14R1.618 CCNC(=O)c1cccc(c1O)OC 240690a_100015525214_100000212136 [0,2,0,0,0,0|1,0,0]=3 7137 B14R1.618 CCNC(=O)c1cccc(c1O)OC 527a_100015525214_100000212136 [0,2,0,0,0,0|1,0,0]=3 7138 B14R1.618 CCOC(=O)c1cccc(c1C)OC 7a_100012185227_200000210301 [0,2,0,0,0,0|1,0,0]=3 7139 B14R1.618 CCOC(=O)c1cccc(c1C)O[13CH3] 7a_100012185227_200025704644 [0,2,0,0,0,0|1,0,0]=3 7140 B14R1.618 CCOC(=O)c1cccc(c1C)SC 62a_100012298221_200000210301 [0,2,0,0,0,0|1,0,0]=3 7141 B14R1.618 CCOC(=O)c1cccc(c1C)SC 62a_200000210301_100012298221 [0,2,0,0,0,0|1,0,0]=3 7142 B14R1.618 CCOC(=O)c1cccc(c1C)S[13CH3] 62a_100012298221_200025704644 [0,2,0,0,0,0|1,0,0]=3 7143 B14R1.618 CCOC(=O)c1cccc(c1C)S[13CH3] 62a_200025704644_100012298221 [0,2,0,0,0,0|1,0,0]=3 7144 B14R1.618 CCOC(=O)c1cccc(c1F)SC 62a_100012350793_200000210301 [0,2,0,0,0,0|1,0,0]=3 7145 B14R1.618 CCOC(=O)c1cccc(c1F)SC 62a_200000210301_100012350793 [0,2,0,0,0,0|1,0,0]=3 7146 B14R1.618 CCOC(=O)c1cccc(c1F)S[13CH3] 62a_100012350793_200025704644 [0,2,0,0,0,0|1,0,0]=3 7147 B14R1.618 CCOC(=O)c1cccc(c1F)S[13CH3] 62a_200025704644_100012350793 [0,2,0,0,0,0|1,0,0]=3 7148 B14R1.618 CCOC(=O)c1cccc(c1N)OC 7a_100012001980_200000210301 [0,2,0,0,0,0|1,0,0]=3 7149 B14R1.618 CCOC(=O)c1cccc(c1N)O[13CH3] 7a_100012001980_200025704644 [0,2,0,0,0,0|1,0,0]=3 7150 B14R1.618 CCOC(=O)c1cccc(c1N)SC 62a_200011356557_200000210301 [0,2,0,0,0,0|1,0,0]=3 7151 B14R1.618 CCOC(=O)c1cccc(c1N)S[13CH3] 62a_200011356557_200025704644 [0,2,0,0,0,0|1,0,0]=3 7152 B14R1.618 CCOC(=O)c1ccnc(c1C)SC 62a_200000210301_100000080207 [0,2,0,0,0,0|2,0,0]=4 7153 B14R1.618 CCOC(=O)c1ccnc(c1C)S[13CH3] 62a_200025704644_100000080207 [0,2,0,0,0,0|2,0,0]=4 7154 B14R1.618 CCOC(=O)c1cncc(c1C)SC 62a_100000726969_200000210301 [0,2,0,0,0,0|2,0,0]=4 7155 B14R1.618 CCOC(=O)c1cncc(c1C)SC 62a_200000210301_100000726969 [0,2,0,0,0,0|2,0,0]=4 7156 B14R1.618 CCOC(=O)c1cncc(c1C)S[13CH3] 62a_100000726969_200025704644 [0,2,0,0,0,0|2,0,0]=4 7157 B14R1.618 CCOC(=O)c1cncc(c1C)S[13CH3] 62a_200025704644_100000726969 [0,2,0,0,0,0|2,0,0]=4 7158 B14R1.618 CCOC(=O)c1cncc(c1N)SC 62a_100010080842_200000210301 [0,2,0,0,0,0|2,0,0]=4 7159 B14R1.618 CCOC(=O)c1cncc(c1N)SC 62a_200000210301_100010080842 [0,2,0,0,0,0|2,0,0]=4 7160 B14R1.618 CCOC(=O)c1cncc(c1N)S[13CH3] 62a_100010080842_200025704644 [0,2,0,0,0,0|2,0,0]=4 7161 B14R1.618 CCOC(=O)c1cncc(c1N)S[13CH3] 62a_200025704644_100010080842 [0,2,0,0,0,0|2,0,0]=4 7162 B14R1.618 CCOC(=O)c1nccc(c1F)SC 62a_100010222487_200000210301 [0,2,0,0,0,0|2,0,0]=4 7163 B14R1.618 CCOC(=O)c1nccc(c1F)SC 62a_200000210301_100010222487 [0,2,0,0,0,0|2,0,0]=4 7164 B14R1.618 CCOC(=O)c1nccc(c1F)S[13CH3] 62a_100010222487_200025704644 [0,2,0,0,0,0|2,0,0]=4 7165 B14R1.618 CCOC(=O)c1nccc(c1F)S[13CH3] 62a_200025704644_100010222487 [0,2,0,0,0,0|2,0,0]=4 7166 B14R1.618 CNNC(=O)c1cccc(c1O)OC 22a_100016993582_100000212136 [0,2,0,0,0,0|2,0,0]=4 7167 B14R1.618 COc1cccc(c1O)C(=O)CCF 1458a_100000212136_100011217306 [0,2,0,0,0,0|2,0,0]=4 7168 B14R1.618 COc1cccc(c1O)C(=O)CCO 1458a_100000212136_100000211926 [0,2,0,0,0,0|2,0,0]=4 7169 B14R1.618 N#Cc1cccc(c1O)C(=O)CCF 1458a_100009886288_100011217306 [0,2,0,0,0,0|2,0,0]=4 7170 B14R1.618 N#Cc1cccc(c1O)C(=O)CCO 1458a_100009886288_100000211926 [0,2,0,0,0,0|2,0,0]=4 7171 B14R1.7255 C=Cc1c(cccc1C(=O)OCC)C 271570a_100011290941_200012184857 [0,2,0,0,0,0|1,0,0]=3 7172 B14R1.7255 C=Cc1c(cccc1C(=O)OCC)F 271570a_100011290941_100012357632 [0,2,0,0,0,0|1,0,0]=3 7173 B14R1.7255 CCCC(=O)c1cccc(c1C#N)F 1458a_100000702252_100000210303 [0,2,0,0,0,0|2,0,0]=4 7174 B14R1.7255 CCCC(=O)c1cccc(c1CC)Br 1458a_100010125490_100000210303 [0,2,0,0,0,0|2,0,0]=4 7175 B14R1.7255 CCCC(=O)c1cccc(c1OC)Br 1458a_100000689802_100000210303 [0,2,0,0,0,0|1,0,0]=3 7176 B14R1.7255 CCCC(=O)c1cccc(c1OC)C 1458a_100000187929_100000210303 [0,2,0,0,0,0|1,0,0]=3 7177 B14R1.7255 CCCC(=O)c1cccc(c1OC)Cl 1458a_100011934004_100000210303 [0,2,0,0,0,0|1,0,0]=3 7178 B14R1.7255 CCCC(=O)c1cccc(c1OC)F 1458a_100011218433_100000210303 [0,2,0,0,0,0|1,0,0]=3 7179 B14R1.7255 CCCC(=O)c1cccc(c1OC)O 1458a_100000080799_100000210303 [0,2,0,0,0,0|1,0,0]=3 7180 B14R1.7255 CCNC(=O)c1cccc(c1C#N)F 240690a_100015525214_100000702252 [0,2,0,0,0,0|2,0,0]=4 7181 B14R1.7255 CCNC(=O)c1cccc(c1C#N)F 527a_100015525214_100000702252 [0,2,0,0,0,0|2,0,0]=4 7182 B14R1.7255 CCNC(=O)c1cccc(c1CC)Br 11a_100015525214_100010125490 [0,2,0,0,0,0|2,0,0]=4 7183 B14R1.7255 CCNC(=O)c1cccc(c1CC)Br 240690a_100015525214_100010125490 [0,2,0,0,0,0|2,0,0]=4 7184 B14R1.7255 CCNC(=O)c1cccc(c1CC)Br 527a_100015525214_100010125490 [0,2,0,0,0,0|2,0,0]=4 7185 B14R1.7255 CCNC(=O)c1cccc(c1OC)Br 11a_100015525214_100000689802 [0,2,0,0,0,0|1,0,0]=3 7186 B14R1.7255 CCNC(=O)c1cccc(c1OC)Br 240690a_100015525214_100000689802 [0,2,0,0,0,0|1,0,0]=3 7187 B14R1.7255 CCNC(=O)c1cccc(c1OC)Br 527a_100015525214_100000689802 [0,2,0,0,0,0|1,0,0]=3 7188 B14R1.7255 CCNC(=O)c1cccc(c1OC)C 11a_100015525214_100000187929 [0,2,0,0,0,0|1,0,0]=3 7189 B14R1.7255 CCNC(=O)c1cccc(c1OC)C 240690a_100015525214_100000187929 [0,2,0,0,0,0|1,0,0]=3 7190 B14R1.7255 CCNC(=O)c1cccc(c1OC)C 527a_100015525214_100000187929 [0,2,0,0,0,0|1,0,0]=3 7191 B14R1.7255 CCNC(=O)c1cccc(c1OC)Cl 11a_100015525214_100011934004 [0,2,0,0,0,0|1,0,0]=3 7192 B14R1.7255 CCNC(=O)c1cccc(c1OC)Cl 240690a_100015525214_100011934004 [0,2,0,0,0,0|1,0,0]=3 7193 B14R1.7255 CCNC(=O)c1cccc(c1OC)Cl 527a_100015525214_100011934004 [0,2,0,0,0,0|1,0,0]=3 7194 B14R1.7255 CCNC(=O)c1cccc(c1OC)F 11a_100015525214_100011218433 [0,2,0,0,0,0|1,0,0]=3 7195 B14R1.7255 CCNC(=O)c1cccc(c1OC)F 240690a_100015525214_100011218433 [0,2,0,0,0,0|1,0,0]=3 7196 B14R1.7255 CCNC(=O)c1cccc(c1OC)F 527a_100015525214_100011218433 [0,2,0,0,0,0|1,0,0]=3 7197 B14R1.7255 CCOC(=O)c1cccc(c1SC)C 62a_200000210301_200012353711 [0,2,0,0,0,0|0,1,0]=3 7198 B14R1.7255 CCOC(=O)c1cccc(c1SC)C 62a_200012353711_200000210301 [0,2,0,0,0,0|0,1,0]=3 7199 B14R1.7255 CCOC(=O)c1cccc(c1SC)F 62a_100012357632_200000210301 [0,2,0,0,0,0|0,1,0]=3 7200 B14R1.7255 CCOC(=O)c1cccc(c1SC)F 62a_200000210301_100012357632 [0,2,0,0,0,0|0,1,0]=3 7201 B14R1.7255 CCOC(=O)c1cccc(c1S[13CH3])C 62a_200012353711_200025704644 [0,2,0,0,0,0|0,1,0]=3 7202 B14R1.7255 CCOC(=O)c1cccc(c1S[13CH3])C 62a_200025704644_200012353711 [0,2,0,0,0,0|0,1,0]=3 7203 B14R1.7255 CCOC(=O)c1cccc(c1S[13CH3])F 62a_100012357632_200025704644 [0,2,0,0,0,0|0,1,0]=3 7204 B14R1.7255 CCOC(=O)c1cccc(c1S[13CH3])F 62a_200025704644_100012357632 [0,2,0,0,0,0|0,1,0]=3 7205 B14R1.7255 CNNC(=O)c1cccc(c1OC)Br 22a_100016993582_100000689802 [0,2,0,0,0,0|2,0,0]=4 7206 B14R1.7255 CNNC(=O)c1cccc(c1OC)C 22a_100016993582_100000187929 [0,2,0,0,0,0|2,0,0]=4 7207 B14R1.7255 CNNC(=O)c1cccc(c1OC)Cl 22a_100016993582_100011934004 [0,2,0,0,0,0|2,0,0]=4 7208 B14R1.7255 CNNC(=O)c1cccc(c1OC)F 22a_100016993582_100011218433 [0,2,0,0,0,0|2,0,0]=4 7209 B14R1.7255 CNNC(=O)c1cccc(c1OC)O 22a_100016993582_100000080799 [0,2,0,0,0,0|2,0,0]=4 7210 B14R1.7255 COc1c(cccc1C(=O)CCF)Br 1458a_100000689802_100011217306 [0,2,0,0,0,0|2,0,0]=4 7211 B14R1.7255 COc1c(cccc1C(=O)CCF)C 1458a_100000187929_100011217306 [0,2,0,0,0,0|2,0,0]=4 7212 B14R1.7255 COc1c(cccc1C(=O)CCF)Cl 1458a_100011934004_100011217306 [0,2,0,0,0,0|2,0,0]=4 7213 B14R1.7255 COc1c(cccc1C(=O)CCF)F 1458a_100011218433_100011217306 [0,2,0,0,0,0|2,0,0]=4 7214 B14R1.7255 COc1c(cccc1C(=O)CCF)O 1458a_100000080799_100011217306 [0,2,0,0,0,0|2,0,0]=4 7215 B14R1.7255 COc1c(cccc1C(=O)CCO)Br 1458a_100000689802_100000211926 [0,2,0,0,0,0|2,0,0]=4 7216 B14R1.7255 COc1c(cccc1C(=O)CCO)C 1458a_100000187929_100000211926 [0,2,0,0,0,0|2,0,0]=4 7217 B14R1.7255 COc1c(cccc1C(=O)CCO)Cl 1458a_100011934004_100000211926 [0,2,0,0,0,0|2,0,0]=4 7218 B14R1.7255 COc1c(cccc1C(=O)CCO)F 1458a_100011218433_100000211926 [0,2,0,0,0,0|2,0,0]=4 7219 B14R1.7255 COc1c(cccc1C(=O)CCO)O 1458a_100000080799_100000211926 [0,2,0,0,0,0|2,0,0]=4 7220 B14R1.7265 CCCC(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_100000210303 [0,2,0,0,0,0|2,0,0]=4 7221 B14R1.7265 CCCC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_100000210303 [0,2,0,0,0,0|2,0,0]=4 7222 B14R1.7265 CCCC(=O)c1ccc(c(c1C)F)F 1458a_100000061971_100000210303 [0,2,0,0,0,0|2,0,0]=4 7223 B14R1.7265 CCCC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_100000210303 [0,2,0,0,0,0|2,0,0]=4 7224 B14R1.7265 CCCC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_100000210303 [0,2,0,0,0,0|2,0,0]=4 7225 B14R1.7265 CCCC(=O)c1ccc(c(c1Cl)C)F 1458a_100000061447_100000210303 [0,2,0,0,0,0|2,0,0]=4 7226 B14R1.7265 CCCC(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_100000210303 [0,2,0,0,0,0|2,0,0]=4 7227 B14R1.7265 CCCC(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_100000210303 [0,2,0,0,0,0|2,0,0]=4 7228 B14R1.7265 CCCC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_100000210303 [0,2,0,0,0,0|2,0,0]=4 7229 B14R1.7265 CCCC(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_100000210303 [0,2,0,0,0,0|2,0,0]=4 7230 B14R1.7265 CCCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210303 [0,2,0,0,0,0|2,0,0]=4 7231 B14R1.7265 CCCC(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_100000210303 [0,2,0,0,0,0|2,0,0]=4 7232 B14R1.7265 CCCC(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_100000210303 [0,2,0,0,0,0|2,0,0]=4 7233 B14R1.7265 CCCC(=O)c1ccc(c(c1F)C)Br 1458a_100000722919_100000210303 [0,2,0,0,0,0|2,0,0]=4 7234 B14R1.7265 CCCC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_100000210303 [0,2,0,0,0,0|2,0,0]=4 7235 B14R1.7265 CCCC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_100000210303 [0,2,0,0,0,0|2,0,0]=4 7236 B14R1.7265 CCCC(=O)c1ccc(c(c1F)C)F 1458a_100000067293_100000210303 [0,2,0,0,0,0|2,0,0]=4 7237 B14R1.7265 CCCC(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_100000210303 [0,2,0,0,0,0|2,0,0]=4 7238 B14R1.7265 CCCC(=O)c1ccc(c(c1F)Cl)C 1458a_100000722910_100000210303 [0,2,0,0,0,0|2,0,0]=4 7239 B14R1.7265 CCCC(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_100000210303 [0,2,0,0,0,0|2,0,0]=4 7240 B14R1.7265 CCCC(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_100000210303 [0,2,0,0,0,0|2,0,0]=4 7241 B14R1.7265 CCCC(=O)c1ccc(c(c1F)F)C 1458a_100011219789_100000210303 [0,2,0,0,0,0|2,0,0]=4 7242 B14R1.7265 CCCC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_100000210303 [0,2,0,0,0,0|2,0,0]=4 7243 B14R1.7265 CCCC(=O)c1ccc(c(c1F)F)F 1458a_100000766628_100000210303 [0,2,0,0,0,0|2,0,0]=4 7244 B14R1.7265 CCCC(=O)c1ccc(c(c1F)F)I 1458a_100010177778_100000210303 [0,2,0,0,0,0|2,0,0]=4 7245 B14R1.7265 CCCC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_100000210303 [0,2,0,0,0,0|2,0,0]=4 7246 B14R1.7265 CCCC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_100000210303 [0,2,0,0,0,0|2,0,0]=4 7247 B14R1.7265 CCCC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_100000210303 [0,2,0,0,0,0|2,0,0]=4 7248 B14R1.7265 CCCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000210303 [0,2,0,0,0,0|1,0,0]=3 7249 B14R1.7265 CCCC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_100000210303 [0,2,0,0,0,0|1,0,0]=3 7250 B14R1.7265 CCCC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_100000210303 [0,2,0,0,0,0|1,0,0]=3 7251 B14R1.7265 CCCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210303 [0,2,0,0,0,0|1,0,0]=3 7252 B14R1.7265 CCNC(=O)c1ccc(c(c1Br)F)F 11a_100015525214_100012356454 [0,2,0,0,0,0|2,0,0]=4 7253 B14R1.7265 CCNC(=O)c1ccc(c(c1Br)F)F 240690a_100015525214_100012356454 [0,2,0,0,0,0|2,0,0]=4 7254 B14R1.7265 CCNC(=O)c1ccc(c(c1Br)F)F 527a_100015525214_100012356454 [0,2,0,0,0,0|2,0,0]=4 7255 B14R1.7265 CCNC(=O)c1ccc(c(c1Br)O)Br 240690a_100015525214_100016068111 [0,2,0,0,0,0|2,0,0]=4 7256 B14R1.7265 CCNC(=O)c1ccc(c(c1Br)O)Br 527a_100015525214_100016068111 [0,2,0,0,0,0|2,0,0]=4 7257 B14R1.7265 CCNC(=O)c1ccc(c(c1C)F)F 11a_100015525214_100000061971 [0,2,0,0,0,0|2,0,0]=4 7258 B14R1.7265 CCNC(=O)c1ccc(c(c1C)F)F 240690a_100015525214_100000061971 [0,2,0,0,0,0|2,0,0]=4 7259 B14R1.7265 CCNC(=O)c1ccc(c(c1C)F)F 527a_100015525214_100000061971 [0,2,0,0,0,0|2,0,0]=4 7260 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)Br)Cl 11a_100015525214_100010208263 [0,2,0,0,0,0|2,0,0]=4 7261 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)Br)Cl 240690a_100015525214_100010208263 [0,2,0,0,0,0|2,0,0]=4 7262 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)Br)Cl 527a_100015525214_100010208263 [0,2,0,0,0,0|2,0,0]=4 7263 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)C)Cl 11a_100015525214_100010074829 [0,2,0,0,0,0|2,0,0]=4 7264 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)C)Cl 240690a_100015525214_100010074829 [0,2,0,0,0,0|2,0,0]=4 7265 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)C)Cl 527a_100015525214_100010074829 [0,2,0,0,0,0|2,0,0]=4 7266 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)C)F 11a_100015525214_100000061447 [0,2,0,0,0,0|2,0,0]=4 7267 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)C)F 240690a_100015525214_100000061447 [0,2,0,0,0,0|2,0,0]=4 7268 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)C)F 527a_100015525214_100000061447 [0,2,0,0,0,0|2,0,0]=4 7269 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)Cl)Br 11a_100015525214_200012347731 [0,2,0,0,0,0|2,0,0]=4 7270 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)Cl)Br 240690a_100015525214_200012347731 [0,2,0,0,0,0|2,0,0]=4 7271 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)Cl)Br 527a_100015525214_200012347731 [0,2,0,0,0,0|2,0,0]=4 7272 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)Cl)F 11a_100015525214_100010209669 [0,2,0,0,0,0|2,0,0]=4 7273 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)Cl)F 240690a_100015525214_100010209669 [0,2,0,0,0,0|2,0,0]=4 7274 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)Cl)F 527a_100015525214_100010209669 [0,2,0,0,0,0|2,0,0]=4 7275 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)F)Cl 11a_100015525214_200010192171 [0,2,0,0,0,0|2,0,0]=4 7276 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)F)Cl 240690a_100015525214_200010192171 [0,2,0,0,0,0|2,0,0]=4 7277 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)F)Cl 527a_100015525214_200010192171 [0,2,0,0,0,0|2,0,0]=4 7278 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)F)F 11a_100015525214_100009888510 [0,2,0,0,0,0|2,0,0]=4 7279 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)F)F 240690a_100015525214_100009888510 [0,2,0,0,0,0|2,0,0]=4 7280 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)F)F 527a_100015525214_100009888510 [0,2,0,0,0,0|2,0,0]=4 7281 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)O)O 240690a_100015525214_100009910189 [0,2,0,0,0,0|2,0,0]=4 7282 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Br)Br 11a_100015525214_200016032200 [0,2,0,0,0,0|2,0,0]=4 7283 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Br)Br 240690a_100015525214_200016032200 [0,2,0,0,0,0|2,0,0]=4 7284 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Br)Br 527a_100015525214_200016032200 [0,2,0,0,0,0|2,0,0]=4 7285 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Br)F 11a_100015525214_100010204296 [0,2,0,0,0,0|2,0,0]=4 7286 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Br)F 240690a_100015525214_100010204296 [0,2,0,0,0,0|2,0,0]=4 7287 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Br)F 527a_100015525214_100010204296 [0,2,0,0,0,0|2,0,0]=4 7288 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)Br 11a_100015525214_100000722919 [0,2,0,0,0,0|2,0,0]=4 7289 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)Br 240690a_100015525214_100000722919 [0,2,0,0,0,0|2,0,0]=4 7290 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)Br 527a_100015525214_100000722919 [0,2,0,0,0,0|2,0,0]=4 7291 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)C 11a_100015525214_100010768504 [0,2,0,0,0,0|2,0,0]=4 7292 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)C 240690a_100015525214_100010768504 [0,2,0,0,0,0|2,0,0]=4 7293 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)C 527a_100015525214_100010768504 [0,2,0,0,0,0|2,0,0]=4 7294 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)Cl 11a_100015525214_100012183103 [0,2,0,0,0,0|2,0,0]=4 7295 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)Cl 240690a_100015525214_100012183103 [0,2,0,0,0,0|2,0,0]=4 7296 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)Cl 527a_100015525214_100012183103 [0,2,0,0,0,0|2,0,0]=4 7297 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)F 11a_100015525214_100000067293 [0,2,0,0,0,0|2,0,0]=4 7298 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)F 240690a_100015525214_100000067293 [0,2,0,0,0,0|2,0,0]=4 7299 B14R1.7265 CCNC(=O)c1ccc(c(c1F)C)F 527a_100015525214_100000067293 [0,2,0,0,0,0|2,0,0]=4 7300 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Cl)Br 11a_100015525214_100000719840 [0,2,0,0,0,0|2,0,0]=4 7301 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Cl)Br 240690a_100015525214_100000719840 [0,2,0,0,0,0|2,0,0]=4 7302 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Cl)Br 527a_100015525214_100000719840 [0,2,0,0,0,0|2,0,0]=4 7303 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Cl)C 11a_100015525214_100000722910 [0,2,0,0,0,0|2,0,0]=4 7304 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Cl)C 240690a_100015525214_100000722910 [0,2,0,0,0,0|2,0,0]=4 7305 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Cl)C 527a_100015525214_100000722910 [0,2,0,0,0,0|2,0,0]=4 7306 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Cl)F 11a_100015525214_100000034381 [0,2,0,0,0,0|2,0,0]=4 7307 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Cl)F 240690a_100015525214_100000034381 [0,2,0,0,0,0|2,0,0]=4 7308 B14R1.7265 CCNC(=O)c1ccc(c(c1F)Cl)F 527a_100015525214_100000034381 [0,2,0,0,0,0|2,0,0]=4 7309 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)Br 11a_100015525214_100009816880 [0,2,0,0,0,0|2,0,0]=4 7310 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)Br 240690a_100015525214_100009816880 [0,2,0,0,0,0|2,0,0]=4 7311 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)Br 527a_100015525214_100009816880 [0,2,0,0,0,0|2,0,0]=4 7312 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)C 11a_100015525214_100011219789 [0,2,0,0,0,0|2,0,0]=4 7313 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)C 240690a_100015525214_100011219789 [0,2,0,0,0,0|2,0,0]=4 7314 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)C 527a_100015525214_100011219789 [0,2,0,0,0,0|2,0,0]=4 7315 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)Cl 11a_100015525214_100000085317 [0,2,0,0,0,0|2,0,0]=4 7316 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)Cl 240690a_100015525214_100000085317 [0,2,0,0,0,0|2,0,0]=4 7317 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)Cl 527a_100015525214_100000085317 [0,2,0,0,0,0|2,0,0]=4 7318 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)F 11a_100015525214_100000766628 [0,2,0,0,0,0|2,0,0]=4 7319 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)F 240690a_100015525214_100000766628 [0,2,0,0,0,0|2,0,0]=4 7320 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)F 527a_100015525214_100000766628 [0,2,0,0,0,0|2,0,0]=4 7321 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)I 11a_100015525214_100010177778 [0,2,0,0,0,0|2,0,0]=4 7322 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)I 240690a_100015525214_100010177778 [0,2,0,0,0,0|2,0,0]=4 7323 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)I 527a_100015525214_100010177778 [0,2,0,0,0,0|2,0,0]=4 7324 B14R1.7265 CCNC(=O)c1ccc(c(c1F)F)O 240690a_100015525214_100000036740 [0,2,0,0,0,0|2,0,0]=4 7325 B14R1.7265 CCNC(=O)c1ccc(c(c1F)O)F 240690a_100015525214_100000084588 [0,2,0,0,0,0|2,0,0]=4 7326 B14R1.7265 CCNC(=O)c1ccc(c(c1I)C)C 11a_100015525214_100010188221 [0,2,0,0,0,0|2,0,0]=4 7327 B14R1.7265 CCNC(=O)c1ccc(c(c1I)C)C 240690a_100015525214_100010188221 [0,2,0,0,0,0|2,0,0]=4 7328 B14R1.7265 CCNC(=O)c1ccc(c(c1I)C)C 527a_100015525214_100010188221 [0,2,0,0,0,0|2,0,0]=4 7329 B14R1.7265 CCNC(=O)c1ccc(c(c1O)C)C 240690a_100015525214_100000742916 [0,2,0,0,0,0|1,0,0]=3 7330 B14R1.7265 CCNC(=O)c1ccc(c(c1O)C)C 527a_100015525214_100000742916 [0,2,0,0,0,0|1,0,0]=3 7331 B14R1.7265 CCNC(=O)c1ccc(c(c1O)F)Br 240690a_100015525214_100010761495 [0,2,0,0,0,0|1,0,0]=3 7332 B14R1.7265 CCNC(=O)c1ccc(c(c1O)F)Br 527a_100015525214_100010761495 [0,2,0,0,0,0|1,0,0]=3 7333 B14R1.7265 CCNC(=O)c1ccc(c(c1O)F)F 240690a_100015525214_100011799213 [0,2,0,0,0,0|1,0,0]=3 7334 B14R1.7265 CCOC(=O)c1ccc(c(c1C)O)F 271570a_203496583355_200000729658 [0,2,0,0,0,0|1,0,0]=3 7335 B14R1.7265 CNNC(=O)c1ccc(c(c1O)C)C 22a_100016993582_100000742916 [0,2,0,0,0,0|2,0,0]=4 7336 B14R1.7265 CNNC(=O)c1ccc(c(c1O)F)Br 22a_100016993582_100010761495 [0,2,0,0,0,0|2,0,0]=4 7337 B14R1.7265 CNNC(=O)c1ccc(c(c1O)F)F 22a_100016993582_100011799213 [0,2,0,0,0,0|2,0,0]=4 7338 B14R1.7265 Cc1ccc(c(c1C)O)C(=O)CCF 1458a_100000742916_100011217306 [0,2,0,0,0,0|2,0,0]=4 7339 B14R1.7265 Cc1ccc(c(c1C)O)C(=O)CCO 1458a_100000742916_100000211926 [0,2,0,0,0,0|2,0,0]=4 7340 B14R1.7265 O=C(CCF)c1ccc(c(c1O)F)Br 1458a_100010761495_100011217306 [0,2,0,0,0,0|2,0,0]=4 7341 B14R1.7265 O=C(CCF)c1ccc(c(c1O)F)F 1458a_100011799213_100011217306 [0,2,0,0,0,0|2,0,0]=4 7342 B14R1.7265 O=C(CCF)c1ccc(c(c1O)O)O 1458a_100000037941_100011217306 [0,2,0,0,0,0|2,0,0]=4 7343 B14R1.7265 O=C(CCO)c1ccc(c(c1O)F)Br 1458a_100010761495_100000211926 [0,2,0,0,0,0|2,0,0]=4 7344 B14R1.7265 O=C(CCO)c1ccc(c(c1O)F)F 1458a_100011799213_100000211926 [0,2,0,0,0,0|2,0,0]=4 7345 B14R1.7265 O=C(CCO)c1ccc(c(c1O)O)O 1458a_100000037941_100000211926 [0,2,0,0,0,0|2,0,0]=4 7346 B14R1.7281 CCCC(=O)c1c(ccc(c1Br)C)F 1458a_100000720849_100000210303 [0,2,0,0,0,0|2,0,0]=4 7347 B14R1.7281 CCCC(=O)c1c(ccc(c1Br)F)F 1458a_100010245744_100000210303 [0,2,0,0,0,0|2,0,0]=4 7348 B14R1.7281 CCCC(=O)c1c(ccc(c1C)Br)C 1458a_100012355652_100000210303 [0,2,0,0,0,0|2,0,0]=4 7349 B14R1.7281 CCCC(=O)c1c(ccc(c1C)Br)F 1458a_100010768519_100000210303 [0,2,0,0,0,0|2,0,0]=4 7350 B14R1.7281 CCCC(=O)c1c(ccc(c1C)F)Br 1458a_100010768524_100000210303 [0,2,0,0,0,0|2,0,0]=4 7351 B14R1.7281 CCCC(=O)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_100000210303 [0,2,0,0,0,0|2,0,0]=4 7352 B14R1.7281 CCCC(=O)c1c(ccc(c1Cl)Br)F 1458a_100010245877_100000210303 [0,2,0,0,0,0|2,0,0]=4 7353 B14R1.7281 CCCC(=O)c1c(ccc(c1Cl)C)Br 1458a_200010769262_100000210303 [0,2,0,0,0,0|2,0,0]=4 7354 B14R1.7281 CCCC(=O)c1c(ccc(c1Cl)C)F 1458a_100000036856_100000210303 [0,2,0,0,0,0|2,0,0]=4 7355 B14R1.7281 CCCC(=O)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_100000210303 [0,2,0,0,0,0|2,0,0]=4 7356 B14R1.7281 CCCC(=O)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_100000210303 [0,2,0,0,0,0|2,0,0]=4 7357 B14R1.7281 CCCC(=O)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_100000210303 [0,2,0,0,0,0|2,0,0]=4 7358 B14R1.7281 CCCC(=O)c1c(ccc(c1Cl)F)F 1458a_100000043044_100000210303 [0,2,0,0,0,0|2,0,0]=4 7359 B14R1.7281 CCCC(=O)c1c(ccc(c1F)Br)Br 1458a_100010233042_100000210303 [0,2,0,0,0,0|2,0,0]=4 7360 B14R1.7281 CCCC(=O)c1c(ccc(c1F)Br)Cl 1458a_100010235752_100000210303 [0,2,0,0,0,0|2,0,0]=4 7361 B14R1.7281 CCCC(=O)c1c(ccc(c1F)Br)F 1458a_100000721511_100000210303 [0,2,0,0,0,0|2,0,0]=4 7362 B14R1.7281 CCCC(=O)c1c(ccc(c1F)C)Br 1458a_100010271678_100000210303 [0,2,0,0,0,0|2,0,0]=4 7363 B14R1.7281 CCCC(=O)c1c(ccc(c1F)C)Cl 1458a_100000039063_100000210303 [0,2,0,0,0,0|2,0,0]=4 7364 B14R1.7281 CCCC(=O)c1c(ccc(c1F)C)F 1458a_100000692215_100000210303 [0,2,0,0,0,0|2,0,0]=4 7365 B14R1.7281 CCCC(=O)c1c(ccc(c1F)Cl)Br 1458a_100010769261_100000210303 [0,2,0,0,0,0|2,0,0]=4 7366 B14R1.7281 CCCC(=O)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_100000210303 [0,2,0,0,0,0|2,0,0]=4 7367 B14R1.7281 CCCC(=O)c1c(ccc(c1F)Cl)F 1458a_100011219569_100000210303 [0,2,0,0,0,0|2,0,0]=4 7368 B14R1.7281 CCCC(=O)c1c(ccc(c1F)F)Br 1458a_100010177765_100000210303 [0,2,0,0,0,0|2,0,0]=4 7369 B14R1.7281 CCCC(=O)c1c(ccc(c1F)F)Cl 1458a_100011998153_100000210303 [0,2,0,0,0,0|2,0,0]=4 7370 B14R1.7281 CCCC(=O)c1c(ccc(c1F)F)F 1458a_100000031524_100000210303 [0,2,0,0,0,0|2,0,0]=4 7371 B14R1.7281 CCCC(=O)c1c(ccc(c1F)F)I 1458a_100010177766_100000210303 [0,2,0,0,0,0|2,0,0]=4 7372 B14R1.7281 CCCC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_100000210303 [0,2,0,0,0,0|1,0,0]=3 7373 B14R1.7281 CCCC(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_100000210303 [0,2,0,0,0,0|2,0,0]=4 7374 B14R1.7281 CCCC(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_100000210303 [0,2,0,0,0,0|2,0,0]=4 7375 B14R1.7281 CCCC(=O)c1c(ccc(c1F)I)F 1458a_100012359589_100000210303 [0,2,0,0,0,0|2,0,0]=4 7376 B14R1.7281 CCCC(=O)c1c(ccc(c1F)O)F 1458a_100000068660_100000210303 [0,2,0,0,0,0|2,0,0]=4 7377 B14R1.7281 CCCC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_100000210303 [0,2,0,0,0,0|1,0,0]=3 7378 B14R1.7281 CCCC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_100000210303 [0,2,0,0,0,0|1,0,0]=3 7379 B14R1.7281 CCCC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100000210303 [0,2,0,0,0,0|1,0,0]=3 7380 B14R1.7281 CCCC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_100000210303 [0,2,0,0,0,0|1,0,0]=3 7381 B14R1.7281 CCCC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_100000210303 [0,2,0,0,0,0|1,0,0]=3 7382 B14R1.7281 CCNC(=O)c1c(ccc(c1Br)C)F 11a_100015525214_100000720849 [0,2,0,0,0,0|2,0,0]=4 7383 B14R1.7281 CCNC(=O)c1c(ccc(c1Br)C)F 240690a_100015525214_100000720849 [0,2,0,0,0,0|2,0,0]=4 7384 B14R1.7281 CCNC(=O)c1c(ccc(c1Br)C)F 527a_100015525214_100000720849 [0,2,0,0,0,0|2,0,0]=4 7385 B14R1.7281 CCNC(=O)c1c(ccc(c1Br)F)F 11a_100015525214_100010245744 [0,2,0,0,0,0|2,0,0]=4 7386 B14R1.7281 CCNC(=O)c1c(ccc(c1Br)F)F 240690a_100015525214_100010245744 [0,2,0,0,0,0|2,0,0]=4 7387 B14R1.7281 CCNC(=O)c1c(ccc(c1Br)F)F 527a_100015525214_100010245744 [0,2,0,0,0,0|2,0,0]=4 7388 B14R1.7281 CCNC(=O)c1c(ccc(c1C)Br)C 11a_100015525214_100012355652 [0,2,0,0,0,0|2,0,0]=4 7389 B14R1.7281 CCNC(=O)c1c(ccc(c1C)Br)C 240690a_100015525214_100012355652 [0,2,0,0,0,0|2,0,0]=4 7390 B14R1.7281 CCNC(=O)c1c(ccc(c1C)Br)C 527a_100015525214_100012355652 [0,2,0,0,0,0|2,0,0]=4 7391 B14R1.7281 CCNC(=O)c1c(ccc(c1C)Br)F 11a_100015525214_100010768519 [0,2,0,0,0,0|2,0,0]=4 7392 B14R1.7281 CCNC(=O)c1c(ccc(c1C)Br)F 240690a_100015525214_100010768519 [0,2,0,0,0,0|2,0,0]=4 7393 B14R1.7281 CCNC(=O)c1c(ccc(c1C)Br)F 527a_100015525214_100010768519 [0,2,0,0,0,0|2,0,0]=4 7394 B14R1.7281 CCNC(=O)c1c(ccc(c1C)F)Br 11a_100015525214_100010768524 [0,2,0,0,0,0|2,0,0]=4 7395 B14R1.7281 CCNC(=O)c1c(ccc(c1C)F)Br 240690a_100015525214_100010768524 [0,2,0,0,0,0|2,0,0]=4 7396 B14R1.7281 CCNC(=O)c1c(ccc(c1C)F)Br 527a_100015525214_100010768524 [0,2,0,0,0,0|2,0,0]=4 7397 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Br)Cl 11a_100015525214_100012350121 [0,2,0,0,0,0|2,0,0]=4 7398 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Br)Cl 240690a_100015525214_100012350121 [0,2,0,0,0,0|2,0,0]=4 7399 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Br)Cl 527a_100015525214_100012350121 [0,2,0,0,0,0|2,0,0]=4 7400 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Br)F 11a_100015525214_100010245877 [0,2,0,0,0,0|2,0,0]=4 7401 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Br)F 240690a_100015525214_100010245877 [0,2,0,0,0,0|2,0,0]=4 7402 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Br)F 527a_100015525214_100010245877 [0,2,0,0,0,0|2,0,0]=4 7403 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)C)Br 11a_100015525214_200010769262 [0,2,0,0,0,0|2,0,0]=4 7404 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)C)Br 240690a_100015525214_200010769262 [0,2,0,0,0,0|2,0,0]=4 7405 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)C)Br 527a_100015525214_200010769262 [0,2,0,0,0,0|2,0,0]=4 7406 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)C)F 11a_100015525214_100000036856 [0,2,0,0,0,0|2,0,0]=4 7407 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)C)F 240690a_100015525214_100000036856 [0,2,0,0,0,0|2,0,0]=4 7408 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)C)F 527a_100015525214_100000036856 [0,2,0,0,0,0|2,0,0]=4 7409 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Cl)Cl 11a_100015525214_100000182695 [0,2,0,0,0,0|2,0,0]=4 7410 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Cl)Cl 240690a_100015525214_100000182695 [0,2,0,0,0,0|2,0,0]=4 7411 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Cl)Cl 527a_100015525214_100000182695 [0,2,0,0,0,0|2,0,0]=4 7412 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Cl)F 11a_100015525214_100000061834 [0,2,0,0,0,0|2,0,0]=4 7413 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Cl)F 240690a_100015525214_100000061834 [0,2,0,0,0,0|2,0,0]=4 7414 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)Cl)F 527a_100015525214_100000061834 [0,2,0,0,0,0|2,0,0]=4 7415 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)F)Cl 11a_100015525214_100000068355 [0,2,0,0,0,0|2,0,0]=4 7416 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)F)Cl 240690a_100015525214_100000068355 [0,2,0,0,0,0|2,0,0]=4 7417 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)F)F 11a_100015525214_100000043044 [0,2,0,0,0,0|2,0,0]=4 7418 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)F)F 240690a_100015525214_100000043044 [0,2,0,0,0,0|2,0,0]=4 7419 B14R1.7281 CCNC(=O)c1c(ccc(c1Cl)F)F 527a_100015525214_100000043044 [0,2,0,0,0,0|2,0,0]=4 7420 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Br)Br 11a_100015525214_100010233042 [0,2,0,0,0,0|2,0,0]=4 7421 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Br)Br 240690a_100015525214_100010233042 [0,2,0,0,0,0|2,0,0]=4 7422 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Br)Br 527a_100015525214_100010233042 [0,2,0,0,0,0|2,0,0]=4 7423 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Br)Cl 11a_100015525214_100010235752 [0,2,0,0,0,0|2,0,0]=4 7424 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Br)Cl 240690a_100015525214_100010235752 [0,2,0,0,0,0|2,0,0]=4 7425 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Br)Cl 527a_100015525214_100010235752 [0,2,0,0,0,0|2,0,0]=4 7426 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Br)F 11a_100015525214_100000721511 [0,2,0,0,0,0|2,0,0]=4 7427 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Br)F 240690a_100015525214_100000721511 [0,2,0,0,0,0|2,0,0]=4 7428 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Br)F 527a_100015525214_100000721511 [0,2,0,0,0,0|2,0,0]=4 7429 B14R1.7281 CCNC(=O)c1c(ccc(c1F)C)Br 11a_100015525214_100010271678 [0,2,0,0,0,0|2,0,0]=4 7430 B14R1.7281 CCNC(=O)c1c(ccc(c1F)C)Br 240690a_100015525214_100010271678 [0,2,0,0,0,0|2,0,0]=4 7431 B14R1.7281 CCNC(=O)c1c(ccc(c1F)C)Br 527a_100015525214_100010271678 [0,2,0,0,0,0|2,0,0]=4 7432 B14R1.7281 CCNC(=O)c1c(ccc(c1F)C)Cl 11a_100015525214_100000039063 [0,2,0,0,0,0|2,0,0]=4 7433 B14R1.7281 CCNC(=O)c1c(ccc(c1F)C)Cl 240690a_100015525214_100000039063 [0,2,0,0,0,0|2,0,0]=4 7434 B14R1.7281 CCNC(=O)c1c(ccc(c1F)C)Cl 527a_100015525214_100000039063 [0,2,0,0,0,0|2,0,0]=4 7435 B14R1.7281 CCNC(=O)c1c(ccc(c1F)C)F 11a_100015525214_100000692215 [0,2,0,0,0,0|2,0,0]=4 7436 B14R1.7281 CCNC(=O)c1c(ccc(c1F)C)F 240690a_100015525214_100000692215 [0,2,0,0,0,0|2,0,0]=4 7437 B14R1.7281 CCNC(=O)c1c(ccc(c1F)C)F 527a_100015525214_100000692215 [0,2,0,0,0,0|2,0,0]=4 7438 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Cl)Br 11a_100015525214_100010769261 [0,2,0,0,0,0|2,0,0]=4 7439 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Cl)Br 240690a_100015525214_100010769261 [0,2,0,0,0,0|2,0,0]=4 7440 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Cl)Br 527a_100015525214_100010769261 [0,2,0,0,0,0|2,0,0]=4 7441 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Cl)Cl 11a_100015525214_100000061686 [0,2,0,0,0,0|2,0,0]=4 7442 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Cl)Cl 240690a_100015525214_100000061686 [0,2,0,0,0,0|2,0,0]=4 7443 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Cl)Cl 527a_100015525214_100000061686 [0,2,0,0,0,0|2,0,0]=4 7444 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Cl)F 11a_100015525214_100011219569 [0,2,0,0,0,0|2,0,0]=4 7445 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Cl)F 240690a_100015525214_100011219569 [0,2,0,0,0,0|2,0,0]=4 7446 B14R1.7281 CCNC(=O)c1c(ccc(c1F)Cl)F 527a_100015525214_100011219569 [0,2,0,0,0,0|2,0,0]=4 7447 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)Br 11a_100015525214_100010177765 [0,2,0,0,0,0|2,0,0]=4 7448 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)Br 240690a_100015525214_100010177765 [0,2,0,0,0,0|2,0,0]=4 7449 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)Br 527a_100015525214_100010177765 [0,2,0,0,0,0|2,0,0]=4 7450 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)Cl 11a_100015525214_100011998153 [0,2,0,0,0,0|2,0,0]=4 7451 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)Cl 240690a_100015525214_100011998153 [0,2,0,0,0,0|2,0,0]=4 7452 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)Cl 527a_100015525214_100011998153 [0,2,0,0,0,0|2,0,0]=4 7453 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)F 11a_100015525214_100000031524 [0,2,0,0,0,0|2,0,0]=4 7454 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)F 240690a_100015525214_100000031524 [0,2,0,0,0,0|2,0,0]=4 7455 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)F 527a_100015525214_100000031524 [0,2,0,0,0,0|2,0,0]=4 7456 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)I 11a_100015525214_100010177766 [0,2,0,0,0,0|2,0,0]=4 7457 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)I 240690a_100015525214_100010177766 [0,2,0,0,0,0|2,0,0]=4 7458 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)I 527a_100015525214_100010177766 [0,2,0,0,0,0|2,0,0]=4 7459 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)O 240690a_100015525214_100000062415 [0,2,0,0,0,0|1,0,0]=3 7460 B14R1.7281 CCNC(=O)c1c(ccc(c1F)F)O 527a_100015525214_100000062415 [0,2,0,0,0,0|1,0,0]=3 7461 B14R1.7281 CCNC(=O)c1c(ccc(c1F)I)Br 11a_100015525214_100010782274 [0,2,0,0,0,0|2,0,0]=4 7462 B14R1.7281 CCNC(=O)c1c(ccc(c1F)I)Br 240690a_100015525214_100010782274 [0,2,0,0,0,0|2,0,0]=4 7463 B14R1.7281 CCNC(=O)c1c(ccc(c1F)I)Br 527a_100015525214_100010782274 [0,2,0,0,0,0|2,0,0]=4 7464 B14R1.7281 CCNC(=O)c1c(ccc(c1F)I)Cl 11a_100015525214_100021583479 [0,2,0,0,0,0|2,0,0]=4 7465 B14R1.7281 CCNC(=O)c1c(ccc(c1F)I)Cl 240690a_100015525214_100021583479 [0,2,0,0,0,0|2,0,0]=4 7466 B14R1.7281 CCNC(=O)c1c(ccc(c1F)I)Cl 527a_100015525214_100021583479 [0,2,0,0,0,0|2,0,0]=4 7467 B14R1.7281 CCNC(=O)c1c(ccc(c1F)I)F 11a_100015525214_100012359589 [0,2,0,0,0,0|2,0,0]=4 7468 B14R1.7281 CCNC(=O)c1c(ccc(c1F)I)F 240690a_100015525214_100012359589 [0,2,0,0,0,0|2,0,0]=4 7469 B14R1.7281 CCNC(=O)c1c(ccc(c1F)I)F 527a_100015525214_100012359589 [0,2,0,0,0,0|2,0,0]=4 7470 B14R1.7281 CCNC(=O)c1c(ccc(c1F)O)F 240690a_100015525214_100000068660 [0,2,0,0,0,0|2,0,0]=4 7471 B14R1.7281 CCNC(=O)c1c(ccc(c1F)O)F 527a_100015525214_100000068660 [0,2,0,0,0,0|2,0,0]=4 7472 B14R1.7281 CCNC(=O)c1c(ccc(c1O)Br)O 240690a_100015525214_100010008628 [0,2,0,0,0,0|1,0,0]=3 7473 B14R1.7281 CCNC(=O)c1c(ccc(c1O)Br)O 527a_100015525214_100010008628 [0,2,0,0,0,0|1,0,0]=3 7474 B14R1.7281 CCNC(=O)c1c(ccc(c1O)C)C 240690a_100015525214_100011255215 [0,2,0,0,0,0|1,0,0]=3 7475 B14R1.7281 CCNC(=O)c1c(ccc(c1O)Cl)Cl 240690a_100015525214_100011255222 [0,2,0,0,0,0|1,0,0]=3 7476 B14R1.7281 CCNC(=O)c1c(ccc(c1O)Cl)Cl 527a_100015525214_100011255222 [0,2,0,0,0,0|1,0,0]=3 7477 B14R1.7281 CCNC(=O)c1c(ccc(c1O)Cl)O 240690a_100015525214_100000080727 [0,2,0,0,0,0|1,0,0]=3 7478 B14R1.7281 CCNC(=O)c1c(ccc(c1O)Cl)O 527a_100015525214_100000080727 [0,2,0,0,0,0|1,0,0]=3 7479 B14R1.7281 CCNC(=O)c1c(ccc(c1O)F)F 240690a_100015525214_100011830443 [0,2,0,0,0,0|1,0,0]=3 7480 B14R1.7281 CCNC(=O)c1c(ccc(c1O)F)F 527a_100015525214_100011830443 [0,2,0,0,0,0|1,0,0]=3 7481 B14R1.7281 CNNC(=O)c1c(ccc(c1F)F)O 22a_100016993582_100000062415 [0,2,0,0,0,0|2,0,0]=4 7482 B14R1.7281 CNNC(=O)c1c(ccc(c1O)C)C 22a_100016993582_100011255215 [0,2,0,0,0,0|2,0,0]=4 7483 B14R1.7281 CNNC(=O)c1c(ccc(c1O)Cl)Cl 22a_100016993582_100011255222 [0,2,0,0,0,0|2,0,0]=4 7484 B14R1.7281 CNNC(=O)c1c(ccc(c1O)F)F 22a_100016993582_100011830443 [0,2,0,0,0,0|2,0,0]=4 7485 B14R1.7281 Cc1ccc(c(c1O)C(=O)CCF)C 1458a_100011255215_100011217306 [0,2,0,0,0,0|2,0,0]=4 7486 B14R1.7281 Cc1ccc(c(c1O)C(=O)CCO)C 1458a_100011255215_100000211926 [0,2,0,0,0,0|2,0,0]=4 7487 B14R1.7281 O=C(CCF)c1c(ccc(c1F)F)O 1458a_100000062415_100011217306 [0,2,0,0,0,0|2,0,0]=4 7488 B14R1.7281 O=C(CCF)c1c(ccc(c1O)Br)O 1458a_100010008628_100011217306 [0,2,0,0,0,0|2,0,0]=4 7489 B14R1.7281 O=C(CCF)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100011217306 [0,2,0,0,0,0|2,0,0]=4 7490 B14R1.7281 O=C(CCF)c1c(ccc(c1O)Cl)O 1458a_100000080727_100011217306 [0,2,0,0,0,0|2,0,0]=4 7491 B14R1.7281 O=C(CCF)c1c(ccc(c1O)F)F 1458a_100011830443_100011217306 [0,2,0,0,0,0|2,0,0]=4 7492 B14R1.7281 O=C(CCO)c1c(ccc(c1F)F)O 1458a_100000062415_100000211926 [0,2,0,0,0,0|2,0,0]=4 7493 B14R1.7281 O=C(CCO)c1c(ccc(c1O)Br)O 1458a_100010008628_100000211926 [0,2,0,0,0,0|2,0,0]=4 7494 B14R1.7281 O=C(CCO)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100000211926 [0,2,0,0,0,0|2,0,0]=4 7495 B14R1.7281 O=C(CCO)c1c(ccc(c1O)Cl)O 1458a_100000080727_100000211926 [0,2,0,0,0,0|2,0,0]=4 7496 B14R1.7281 O=C(CCO)c1c(ccc(c1O)F)F 1458a_100011830443_100000211926 [0,2,0,0,0,0|2,0,0]=4 7497 B14R1.18985 CCCC(=O)c1cc(cc(c1Br)Br)C 1458a_200012920551_100000210303 [0,2,0,0,0,0|2,0,0]=4 7498 B14R1.18985 CCCC(=O)c1cc(cc(c1Br)C)C 1458a_200000701928_100000210303 [0,2,0,0,0,0|2,0,0]=4 7499 B14R1.18985 CCCC(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_100000210303 [0,2,0,0,0,0|2,0,0]=4 7500 B14R1.18985 CCCC(=O)c1cc(cc(c1C)Br)Br 1458a_100012356187_100000210303 [0,2,0,0,0,0|2,0,0]=4 7501 B14R1.18985 CCCC(=O)c1cc(cc(c1C)Br)F 1458a_100012347597_100000210303 [0,2,0,0,0,0|2,0,0]=4 7502 B14R1.18985 CCCC(=O)c1cc(cc(c1C)C)Br 1458a_100012920495_100000210303 [0,2,0,0,0,0|2,0,0]=4 7503 B14R1.18985 CCCC(=O)c1cc(cc(c1C)Cl)Br 1458a_100012921640_100000210303 [0,2,0,0,0,0|2,0,0]=4 7504 B14R1.18985 CCCC(=O)c1cc(cc(c1C)Cl)F 1458a_100012177191_100000210303 [0,2,0,0,0,0|2,0,0]=4 7505 B14R1.18985 CCCC(=O)c1cc(cc(c1C)F)Br 1458a_100010768523_100000210303 [0,2,0,0,0,0|2,0,0]=4 7506 B14R1.18985 CCCC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_100000210303 [0,2,0,0,0,0|2,0,0]=4 7507 B14R1.18985 CCCC(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_100000210303 [0,2,0,0,0,0|2,0,0]=4 7508 B14R1.18985 CCCC(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_100000210303 [0,2,0,0,0,0|2,0,0]=4 7509 B14R1.18985 CCCC(=O)c1cc(cc(c1Cl)C)F 1458a_200010768536_100000210303 [0,2,0,0,0,0|2,0,0]=4 7510 B14R1.18985 CCCC(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_100000210303 [0,2,0,0,0,0|2,0,0]=4 7511 B14R1.18985 CCCC(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_100000210303 [0,2,0,0,0,0|2,0,0]=4 7512 B14R1.18985 CCCC(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_100000210303 [0,2,0,0,0,0|2,0,0]=4 7513 B14R1.18985 CCCC(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_100000210303 [0,2,0,0,0,0|2,0,0]=4 7514 B14R1.18985 CCCC(=O)c1cc(cc(c1F)Br)C 1458a_100009996753_100000210303 [0,2,0,0,0,0|2,0,0]=4 7515 B14R1.18985 CCCC(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_100000210303 [0,2,0,0,0,0|2,0,0]=4 7516 B14R1.18985 CCCC(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_100000210303 [0,2,0,0,0,0|2,0,0]=4 7517 B14R1.18985 CCCC(=O)c1cc(cc(c1F)C)Br 1458a_100012928937_100000210303 [0,2,0,0,0,0|2,0,0]=4 7518 B14R1.18985 CCCC(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_100000210303 [0,2,0,0,0,0|2,0,0]=4 7519 B14R1.18985 CCCC(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_100000210303 [0,2,0,0,0,0|2,0,0]=4 7520 B14R1.18985 CCCC(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_100000210303 [0,2,0,0,0,0|2,0,0]=4 7521 B14R1.18985 CCCC(=O)c1cc(cc(c1F)F)C 1458a_100000094381_100000210303 [0,2,0,0,0,0|2,0,0]=4 7522 B14R1.18985 CCCC(=O)c1cc(cc(c1F)F)F 1458a_100011217470_100000210303 [0,2,0,0,0,0|2,0,0]=4 7523 B14R1.18985 CCCC(=O)c1cc(cc(c1F)F)I 1458a_100012344719_100000210303 [0,2,0,0,0,0|2,0,0]=4 7524 B14R1.18985 CCCC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000210303 [0,2,0,0,0,0|1,0,0]=3 7525 B14R1.18985 CCCC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000210303 [0,2,0,0,0,0|1,0,0]=3 7526 B14R1.18985 CCCC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_100000210303 [0,2,0,0,0,0|1,0,0]=3 7527 B14R1.18985 CCCC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_100000210303 [0,2,0,0,0,0|1,0,0]=3 7528 B14R1.18985 CCCC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000210303 [0,2,0,0,0,0|1,0,0]=3 7529 B14R1.18985 CCCC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_100000210303 [0,2,0,0,0,0|1,0,0]=3 7530 B14R1.18985 CCCC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_100000210303 [0,2,0,0,0,0|1,0,0]=3 7531 B14R1.18985 CCCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000210303 [0,2,0,0,0,0|1,0,0]=3 7532 B14R1.18985 CCCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100000210303 [0,2,0,0,0,0|1,0,0]=3 7533 B14R1.18985 CCNC(=O)c1cc(cc(c1Br)Br)C 11a_100015525214_200012920551 [0,2,0,0,0,0|2,0,0]=4 7534 B14R1.18985 CCNC(=O)c1cc(cc(c1Br)Br)C 240690a_100015525214_200012920551 [0,2,0,0,0,0|2,0,0]=4 7535 B14R1.18985 CCNC(=O)c1cc(cc(c1Br)Br)C 527a_100015525214_200012920551 [0,2,0,0,0,0|2,0,0]=4 7536 B14R1.18985 CCNC(=O)c1cc(cc(c1Br)C)C 11a_100015525214_200000701928 [0,2,0,0,0,0|2,0,0]=4 7537 B14R1.18985 CCNC(=O)c1cc(cc(c1Br)C)C 240690a_100015525214_200000701928 [0,2,0,0,0,0|2,0,0]=4 7538 B14R1.18985 CCNC(=O)c1cc(cc(c1Br)C)C 527a_100015525214_200000701928 [0,2,0,0,0,0|2,0,0]=4 7539 B14R1.18985 CCNC(=O)c1cc(cc(c1Br)F)F 11a_100015525214_100010209673 [0,2,0,0,0,0|2,0,0]=4 7540 B14R1.18985 CCNC(=O)c1cc(cc(c1Br)F)F 240690a_100015525214_100010209673 [0,2,0,0,0,0|2,0,0]=4 7541 B14R1.18985 CCNC(=O)c1cc(cc(c1Br)F)F 527a_100015525214_100010209673 [0,2,0,0,0,0|2,0,0]=4 7542 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Br)Br 11a_100015525214_100012356187 [0,2,0,0,0,0|2,0,0]=4 7543 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Br)Br 240690a_100015525214_100012356187 [0,2,0,0,0,0|2,0,0]=4 7544 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Br)Br 527a_100015525214_100012356187 [0,2,0,0,0,0|2,0,0]=4 7545 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Br)F 11a_100015525214_100012347597 [0,2,0,0,0,0|2,0,0]=4 7546 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Br)F 240690a_100015525214_100012347597 [0,2,0,0,0,0|2,0,0]=4 7547 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Br)F 527a_100015525214_100012347597 [0,2,0,0,0,0|2,0,0]=4 7548 B14R1.18985 CCNC(=O)c1cc(cc(c1C)C)Br 11a_100015525214_100012920495 [0,2,0,0,0,0|2,0,0]=4 7549 B14R1.18985 CCNC(=O)c1cc(cc(c1C)C)Br 240690a_100015525214_100012920495 [0,2,0,0,0,0|2,0,0]=4 7550 B14R1.18985 CCNC(=O)c1cc(cc(c1C)C)Br 527a_100015525214_100012920495 [0,2,0,0,0,0|2,0,0]=4 7551 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Cl)Br 11a_100015525214_100012921640 [0,2,0,0,0,0|2,0,0]=4 7552 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Cl)Br 240690a_100015525214_100012921640 [0,2,0,0,0,0|2,0,0]=4 7553 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Cl)Br 527a_100015525214_100012921640 [0,2,0,0,0,0|2,0,0]=4 7554 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Cl)F 11a_100015525214_100012177191 [0,2,0,0,0,0|2,0,0]=4 7555 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Cl)F 240690a_100015525214_100012177191 [0,2,0,0,0,0|2,0,0]=4 7556 B14R1.18985 CCNC(=O)c1cc(cc(c1C)Cl)F 527a_100015525214_100012177191 [0,2,0,0,0,0|2,0,0]=4 7557 B14R1.18985 CCNC(=O)c1cc(cc(c1C)F)Br 11a_100015525214_100010768523 [0,2,0,0,0,0|2,0,0]=4 7558 B14R1.18985 CCNC(=O)c1cc(cc(c1C)F)Br 240690a_100015525214_100010768523 [0,2,0,0,0,0|2,0,0]=4 7559 B14R1.18985 CCNC(=O)c1cc(cc(c1C)F)Br 527a_100015525214_100010768523 [0,2,0,0,0,0|2,0,0]=4 7560 B14R1.18985 CCNC(=O)c1cc(cc(c1C)O)Br 240690a_100015525214_100011101721 [0,2,0,0,0,0|2,0,0]=4 7561 B14R1.18985 CCNC(=O)c1cc(cc(c1C)O)Br 527a_100015525214_100011101721 [0,2,0,0,0,0|2,0,0]=4 7562 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Br)Cl 11a_100015525214_200012920481 [0,2,0,0,0,0|2,0,0]=4 7563 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Br)Cl 240690a_100015525214_200012920481 [0,2,0,0,0,0|2,0,0]=4 7564 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Br)Cl 527a_100015525214_200012920481 [0,2,0,0,0,0|2,0,0]=4 7565 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Br)F 11a_100015525214_100011105905 [0,2,0,0,0,0|2,0,0]=4 7566 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Br)F 240690a_100015525214_100011105905 [0,2,0,0,0,0|2,0,0]=4 7567 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Br)F 527a_100015525214_100011105905 [0,2,0,0,0,0|2,0,0]=4 7568 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)C)F 11a_100015525214_200010768536 [0,2,0,0,0,0|2,0,0]=4 7569 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)C)F 240690a_100015525214_200010768536 [0,2,0,0,0,0|2,0,0]=4 7570 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)C)F 527a_100015525214_200010768536 [0,2,0,0,0,0|2,0,0]=4 7571 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Cl)Cl 11a_100015525214_100011215521 [0,2,0,0,0,0|2,0,0]=4 7572 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Cl)Cl 240690a_100015525214_100011215521 [0,2,0,0,0,0|2,0,0]=4 7573 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Cl)Cl 527a_100015525214_100011215521 [0,2,0,0,0,0|2,0,0]=4 7574 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Cl)F 11a_100015525214_200010244589 [0,2,0,0,0,0|2,0,0]=4 7575 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Cl)F 240690a_100015525214_200010244589 [0,2,0,0,0,0|2,0,0]=4 7576 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)Cl)F 527a_100015525214_200010244589 [0,2,0,0,0,0|2,0,0]=4 7577 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)F)Cl 11a_100015525214_200012352169 [0,2,0,0,0,0|2,0,0]=4 7578 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)F)Cl 240690a_100015525214_200012352169 [0,2,0,0,0,0|2,0,0]=4 7579 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)F)Cl 527a_100015525214_200012352169 [0,2,0,0,0,0|2,0,0]=4 7580 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)F)F 11a_100015525214_100009888511 [0,2,0,0,0,0|2,0,0]=4 7581 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)F)F 240690a_100015525214_100009888511 [0,2,0,0,0,0|2,0,0]=4 7582 B14R1.18985 CCNC(=O)c1cc(cc(c1Cl)F)F 527a_100015525214_100009888511 [0,2,0,0,0,0|2,0,0]=4 7583 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Br)C 11a_100015525214_100009996753 [0,2,0,0,0,0|2,0,0]=4 7584 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Br)C 240690a_100015525214_100009996753 [0,2,0,0,0,0|2,0,0]=4 7585 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Br)C 527a_100015525214_100009996753 [0,2,0,0,0,0|2,0,0]=4 7586 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Br)Cl 11a_100015525214_100000720295 [0,2,0,0,0,0|2,0,0]=4 7587 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Br)Cl 240690a_100015525214_100000720295 [0,2,0,0,0,0|2,0,0]=4 7588 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Br)Cl 527a_100015525214_100000720295 [0,2,0,0,0,0|2,0,0]=4 7589 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Br)F 11a_100015525214_100012920464 [0,2,0,0,0,0|2,0,0]=4 7590 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Br)F 240690a_100015525214_100012920464 [0,2,0,0,0,0|2,0,0]=4 7591 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Br)F 527a_100015525214_100012920464 [0,2,0,0,0,0|2,0,0]=4 7592 B14R1.18985 CCNC(=O)c1cc(cc(c1F)C)Br 11a_100015525214_100012928937 [0,2,0,0,0,0|2,0,0]=4 7593 B14R1.18985 CCNC(=O)c1cc(cc(c1F)C)Br 240690a_100015525214_100012928937 [0,2,0,0,0,0|2,0,0]=4 7594 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Cl)Br 11a_100015525214_100012920557 [0,2,0,0,0,0|2,0,0]=4 7595 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Cl)Br 240690a_100015525214_100012920557 [0,2,0,0,0,0|2,0,0]=4 7596 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Cl)I 11a_100015525214_100012920558 [0,2,0,0,0,0|2,0,0]=4 7597 B14R1.18985 CCNC(=O)c1cc(cc(c1F)Cl)I 240690a_100015525214_100012920558 [0,2,0,0,0,0|2,0,0]=4 7598 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)Br 11a_100015525214_100012349847 [0,2,0,0,0,0|2,0,0]=4 7599 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)Br 240690a_100015525214_100012349847 [0,2,0,0,0,0|2,0,0]=4 7600 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)Br 527a_100015525214_100012349847 [0,2,0,0,0,0|2,0,0]=4 7601 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)C 11a_100015525214_100000094381 [0,2,0,0,0,0|2,0,0]=4 7602 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)C 240690a_100015525214_100000094381 [0,2,0,0,0,0|2,0,0]=4 7603 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)C 527a_100015525214_100000094381 [0,2,0,0,0,0|2,0,0]=4 7604 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)F 11a_100015525214_100011217470 [0,2,0,0,0,0|2,0,0]=4 7605 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)F 240690a_100015525214_100011217470 [0,2,0,0,0,0|2,0,0]=4 7606 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)F 527a_100015525214_100011217470 [0,2,0,0,0,0|2,0,0]=4 7607 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)I 11a_100015525214_100012344719 [0,2,0,0,0,0|2,0,0]=4 7608 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)I 240690a_100015525214_100012344719 [0,2,0,0,0,0|2,0,0]=4 7609 B14R1.18985 CCNC(=O)c1cc(cc(c1F)F)I 527a_100015525214_100012344719 [0,2,0,0,0,0|2,0,0]=4 7610 B14R1.18985 CCNC(=O)c1cc(cc(c1O)Br)Br 240690a_100015525214_100000212120 [0,2,0,0,0,0|1,0,0]=3 7611 B14R1.18985 CCNC(=O)c1cc(cc(c1O)Br)Br 527a_100015525214_100000212120 [0,2,0,0,0,0|1,0,0]=3 7612 B14R1.18985 CCNC(=O)c1cc(cc(c1O)Br)Cl 240690a_100015525214_100000765379 [0,2,0,0,0,0|1,0,0]=3 7613 B14R1.18985 CCNC(=O)c1cc(cc(c1O)Br)Cl 527a_100015525214_100000765379 [0,2,0,0,0,0|1,0,0]=3 7614 B14R1.18985 CCNC(=O)c1cc(cc(c1O)C)Br 240690a_100015525214_100011825902 [0,2,0,0,0,0|1,0,0]=3 7615 B14R1.18985 CCNC(=O)c1cc(cc(c1O)C)Cl 240690a_100015525214_100011255218 [0,2,0,0,0,0|1,0,0]=3 7616 B14R1.18985 CCNC(=O)c1cc(cc(c1O)C)Cl 527a_100015525214_100011255218 [0,2,0,0,0,0|1,0,0]=3 7617 B14R1.18985 CCNC(=O)c1cc(cc(c1O)Cl)Cl 240690a_100015525214_100000215963 [0,2,0,0,0,0|1,0,0]=3 7618 B14R1.18985 CCNC(=O)c1cc(cc(c1O)Cl)Cl 527a_100015525214_100000215963 [0,2,0,0,0,0|1,0,0]=3 7619 B14R1.18985 CCNC(=O)c1cc(cc(c1O)F)Br 240690a_100015525214_100011255233 [0,2,0,0,0,0|1,0,0]=3 7620 B14R1.18985 CCNC(=O)c1cc(cc(c1O)F)Br 527a_100015525214_100011255233 [0,2,0,0,0,0|1,0,0]=3 7621 B14R1.18985 CCNC(=O)c1cc(cc(c1O)F)F 240690a_100015525214_100011255242 [0,2,0,0,0,0|1,0,0]=3 7622 B14R1.18985 CCNC(=O)c1cc(cc(c1O)F)F 527a_100015525214_100011255242 [0,2,0,0,0,0|1,0,0]=3 7623 B14R1.18985 CCNC(=O)c1cc(cc(c1O)I)I 240690a_100015525214_100000748652 [0,2,0,0,0,0|1,0,0]=3 7624 B14R1.18985 CCOC(=O)c1cc(cc(c1F)C)O 271570a_203496583355_100012928944 [0,2,0,0,0,0|1,0,0]=3 7625 B14R1.18985 CCOC(=O)c1cc(cc(c1F)O)F 271570a_203496583355_100012920303 [0,2,0,0,0,0|1,0,0]=3 7626 B14R1.18985 CNNC(=O)c1cc(cc(c1O)Br)Br 22a_100016993582_100000212120 [0,2,0,0,0,0|2,0,0]=4 7627 B14R1.18985 CNNC(=O)c1cc(cc(c1O)Br)Cl 22a_100016993582_100000765379 [0,2,0,0,0,0|2,0,0]=4 7628 B14R1.18985 CNNC(=O)c1cc(cc(c1O)C)Br 22a_100016993582_100011825902 [0,2,0,0,0,0|2,0,0]=4 7629 B14R1.18985 CNNC(=O)c1cc(cc(c1O)C)Cl 22a_100016993582_100011255218 [0,2,0,0,0,0|2,0,0]=4 7630 B14R1.18985 CNNC(=O)c1cc(cc(c1O)Cl)Cl 22a_100016993582_100000215963 [0,2,0,0,0,0|2,0,0]=4 7631 B14R1.18985 CNNC(=O)c1cc(cc(c1O)F)Br 22a_100016993582_100011255233 [0,2,0,0,0,0|2,0,0]=4 7632 B14R1.18985 CNNC(=O)c1cc(cc(c1O)F)F 22a_100016993582_100011255242 [0,2,0,0,0,0|2,0,0]=4 7633 B14R1.18985 CNNC(=O)c1cc(cc(c1O)I)I 22a_100016993582_100000748652 [0,2,0,0,0,0|2,0,0]=4 7634 B14R1.18985 Cc1cc(cc(c1O)C(=O)CCF)Br 1458a_100011825902_100011217306 [0,2,0,0,0,0|2,0,0]=4 7635 B14R1.18985 Cc1cc(cc(c1O)C(=O)CCF)Cl 1458a_100011255218_100011217306 [0,2,0,0,0,0|2,0,0]=4 7636 B14R1.18985 Cc1cc(cc(c1O)C(=O)CCO)Br 1458a_100011825902_100000211926 [0,2,0,0,0,0|2,0,0]=4 7637 B14R1.18985 Cc1cc(cc(c1O)C(=O)CCO)Cl 1458a_100011255218_100000211926 [0,2,0,0,0,0|2,0,0]=4 7638 B14R1.18985 O=C(CCF)c1cc(cc(c1O)Br)Br 1458a_100000212120_100011217306 [0,2,0,0,0,0|2,0,0]=4 7639 B14R1.18985 O=C(CCF)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100011217306 [0,2,0,0,0,0|2,0,0]=4 7640 B14R1.18985 O=C(CCF)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100011217306 [0,2,0,0,0,0|2,0,0]=4 7641 B14R1.18985 O=C(CCF)c1cc(cc(c1O)F)Br 1458a_100011255233_100011217306 [0,2,0,0,0,0|2,0,0]=4 7642 B14R1.18985 O=C(CCF)c1cc(cc(c1O)F)F 1458a_100011255242_100011217306 [0,2,0,0,0,0|2,0,0]=4 7643 B14R1.18985 O=C(CCF)c1cc(cc(c1O)I)I 1458a_100000748652_100011217306 [0,2,0,0,0,0|2,0,0]=4 7644 B14R1.18985 O=C(CCF)c1cc(cc(c1O)O)Br 1458a_200010196872_100011217306 [0,2,0,0,0,0|2,0,0]=4 7645 B14R1.18985 O=C(CCO)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000211926 [0,2,0,0,0,0|2,0,0]=4 7646 B14R1.18985 O=C(CCO)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000211926 [0,2,0,0,0,0|2,0,0]=4 7647 B14R1.18985 O=C(CCO)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000211926 [0,2,0,0,0,0|2,0,0]=4 7648 B14R1.18985 O=C(CCO)c1cc(cc(c1O)F)Br 1458a_100011255233_100000211926 [0,2,0,0,0,0|2,0,0]=4 7649 B14R1.18985 O=C(CCO)c1cc(cc(c1O)F)F 1458a_100011255242_100000211926 [0,2,0,0,0,0|2,0,0]=4 7650 B14R1.18985 O=C(CCO)c1cc(cc(c1O)I)I 1458a_100000748652_100000211926 [0,2,0,0,0,0|2,0,0]=4 7651 B14R1.18985 O=C(CCO)c1cc(cc(c1O)O)Br 1458a_200010196872_100000211926 [0,2,0,0,0,0|2,0,0]=4 7652 B14R1.3111 CCNN=C(CC)c1ccccc1O 4a_100000756455_100000184720 [0,2,0,0,0,0|2,0,0]=4 7653 B14R1.3111 CCOCN(CC)c1ccccc1O 269982a_103624766699_100000739092 [0,2,0,0,0,0|2,0,0]=4 7654 B14R1.6855 CCOC(OCC)c1ccccc1O 271570a_203496583355_100009813689 [0,2,0,0,0,0|0,0,2]=4 7655 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1O 1458a_100015234032_100000179758 [0,2,0,0,0,0|1,0,1]=4 7656 B14R1.243 CC(C)N(C)C(=O)c1ccccc1Br 11a_200000211004_100000188424 [0,2,0,0,0,0|2,0,0]=4 7657 B14R1.243 CC(C)N(C)C(=O)c1ccccc1Br 1626a_200000211004_100000188424 [0,2,0,0,0,0|2,0,0]=4 7658 B14R1.243 CC(C)N(C)C(=O)c1ccccc1Br 240690a_200000211004_100000188424 [0,2,0,0,0,0|2,0,0]=4 7659 B14R1.243 CC(C)N(C)C(=O)c1ccccc1Br 527a_200000211004_100000188424 [0,2,0,0,0,0|2,0,0]=4 7660 B14R1.243 CC(C)N(C)C(=O)c1ccccc1Cl 11a_200000211004_100000185844 [0,2,0,0,0,0|2,0,0]=4 7661 B14R1.243 CC(C)N(C)C(=O)c1ccccc1Cl 1626a_200000211004_100000185844 [0,2,0,0,0,0|2,0,0]=4 7662 B14R1.243 CC(C)N(C)C(=O)c1ccccc1Cl 240690a_200000211004_100000185844 [0,2,0,0,0,0|2,0,0]=4 7663 B14R1.243 CC(C)N(C)C(=O)c1ccccc1Cl 527a_200000211004_100000185844 [0,2,0,0,0,0|2,0,0]=4 7664 B14R1.243 CC(C)N(C)C(=O)c1ccccc1F 11a_200000211004_100000188656 [0,2,0,0,0,0|2,0,0]=4 7665 B14R1.243 CC(C)N(C)C(=O)c1ccccc1F 1626a_200000211004_100000188656 [0,2,0,0,0,0|2,0,0]=4 7666 B14R1.243 CC(C)N(C)C(=O)c1ccccc1F 240690a_200000211004_100000188656 [0,2,0,0,0,0|2,0,0]=4 7667 B14R1.243 CC(C)N(C)C(=O)c1ccccc1F 527a_200000211004_100000188656 [0,2,0,0,0,0|2,0,0]=4 7668 B14R1.243 CC(C)N(C)C(=O)c1ccccc1I 11a_200000211004_100000187884 [0,2,0,0,0,0|2,0,0]=4 7669 B14R1.243 CC(C)N(C)C(=O)c1ccccc1I 1626a_200000211004_100000187884 [0,2,0,0,0,0|2,0,0]=4 7670 B14R1.243 CC(C)N(C)C(=O)c1ccccc1I 240690a_200000211004_100000187884 [0,2,0,0,0,0|2,0,0]=4 7671 B14R1.243 CC(C)N(C)C(=O)c1ccccc1I 527a_200000211004_100000187884 [0,2,0,0,0,0|2,0,0]=4 7672 B14R1.243 CC(C)N(C)C(=O)c1ccccc1O 240690a_200000211004_100015234032 [0,2,0,0,0,0|1,0,0]=3 7673 B14R1.243 CC(C)N(C)C(=O)c1ccccc1[O-] 1626a_200000211004_100009911694 [0,2,0,0,0,0|1,0,1]=4 7674 B14R1.243 CC(C)N(C)C(=O)c1ccccc1[O-] 240690a_200000211004_100009911694 [0,2,0,0,0,0|1,0,1]=4 7675 B14R1.243 CC(C)N(C)C(=O)c1ccccc1[O-] 527a_200000211004_100009911694 [0,2,0,0,0,0|1,0,1]=4 7676 B14R1.243 Cc1ccccc1C(=O)N(C)C(C)C 11a_200000211004_100000212026 [0,2,0,0,0,0|2,0,0]=4 7677 B14R1.243 Cc1ccccc1C(=O)N(C)C(C)C 1626a_200000211004_100000212026 [0,2,0,0,0,0|2,0,0]=4 7678 B14R1.243 Cc1ccccc1C(=O)N(C)C(C)C 240690a_200000211004_100000212026 [0,2,0,0,0,0|2,0,0]=4 7679 B14R1.243 Cc1ccccc1C(=O)N(C)C(C)C 527a_200000211004_100000212026 [0,2,0,0,0,0|2,0,0]=4 7680 B14R1.587 C#CC(C)NC(=O)c1ccccc1Br 11a_100000707721_100000188424 [0,2,0,0,0,0|2,0,0]=4 7681 B14R1.587 C#CC(C)NC(=O)c1ccccc1Br 1626a_100000707721_100000188424 [0,2,0,0,0,0|2,0,0]=4 7682 B14R1.587 C#CC(C)NC(=O)c1ccccc1Br 240690a_100000707721_100000188424 [0,2,0,0,0,0|2,0,0]=4 7683 B14R1.587 C#CC(C)NC(=O)c1ccccc1Br 527a_100000707721_100000188424 [0,2,0,0,0,0|2,0,0]=4 7684 B14R1.587 C#CC(C)NC(=O)c1ccccc1C 11a_100000707721_100000212026 [0,2,0,0,0,0|2,0,0]=4 7685 B14R1.587 C#CC(C)NC(=O)c1ccccc1C 1626a_100000707721_100000212026 [0,2,0,0,0,0|2,0,0]=4 7686 B14R1.587 C#CC(C)NC(=O)c1ccccc1C 240690a_100000707721_100000212026 [0,2,0,0,0,0|2,0,0]=4 7687 B14R1.587 C#CC(C)NC(=O)c1ccccc1C 527a_100000707721_100000212026 [0,2,0,0,0,0|2,0,0]=4 7688 B14R1.587 C#CC(C)NC(=O)c1ccccc1Cl 11a_100000707721_100000185844 [0,2,0,0,0,0|2,0,0]=4 7689 B14R1.587 C#CC(C)NC(=O)c1ccccc1Cl 1626a_100000707721_100000185844 [0,2,0,0,0,0|2,0,0]=4 7690 B14R1.587 C#CC(C)NC(=O)c1ccccc1Cl 240690a_100000707721_100000185844 [0,2,0,0,0,0|2,0,0]=4 7691 B14R1.587 C#CC(C)NC(=O)c1ccccc1Cl 527a_100000707721_100000185844 [0,2,0,0,0,0|2,0,0]=4 7692 B14R1.587 C#CC(C)NC(=O)c1ccccc1F 11a_100000707721_100000188656 [0,2,0,0,0,0|2,0,0]=4 7693 B14R1.587 C#CC(C)NC(=O)c1ccccc1F 1626a_100000707721_100000188656 [0,2,0,0,0,0|2,0,0]=4 7694 B14R1.587 C#CC(C)NC(=O)c1ccccc1F 240690a_100000707721_100000188656 [0,2,0,0,0,0|2,0,0]=4 7695 B14R1.587 C#CC(C)NC(=O)c1ccccc1F 527a_100000707721_100000188656 [0,2,0,0,0,0|2,0,0]=4 7696 B14R1.587 C#CC(C)NC(=O)c1ccccc1I 11a_100000707721_100000187884 [0,2,0,0,0,0|2,0,0]=4 7697 B14R1.587 C#CC(C)NC(=O)c1ccccc1I 1626a_100000707721_100000187884 [0,2,0,0,0,0|2,0,0]=4 7698 B14R1.587 C#CC(C)NC(=O)c1ccccc1I 240690a_100000707721_100000187884 [0,2,0,0,0,0|2,0,0]=4 7699 B14R1.587 C#CC(C)NC(=O)c1ccccc1I 527a_100000707721_100000187884 [0,2,0,0,0,0|2,0,0]=4 7700 B14R1.587 C#CC(C)NC(=O)c1ccccc1O 240690a_100000707721_100015234032 [0,2,0,0,0,0|1,0,0]=3 7701 B14R1.587 C#CC(C)NC(=O)c1ccccc1[O-] 1626a_100000707721_100009911694 [0,2,0,0,0,0|1,0,1]=4 7702 B14R1.587 C#CC(C)NC(=O)c1ccccc1[O-] 240690a_100000707721_100009911694 [0,2,0,0,0,0|1,0,1]=4 7703 B14R1.587 C#CC(C)NC(=O)c1ccccc1[O-] 527a_100000707721_100009911694 [0,2,0,0,0,0|1,0,1]=4 7704 B14R1.587 CC(C#N)NC(=O)c1ccccc1Br 11a_100000737613_100000188424 [0,2,0,0,0,0|2,0,0]=4 7705 B14R1.587 CC(C#N)NC(=O)c1ccccc1Br 1626a_100000737613_100000188424 [0,2,0,0,0,0|2,0,0]=4 7706 B14R1.587 CC(C#N)NC(=O)c1ccccc1Br 527a_100000737613_100000188424 [0,2,0,0,0,0|2,0,0]=4 7707 B14R1.587 CC(C#N)NC(=O)c1ccccc1Cl 11a_100000737613_100000185844 [0,2,0,0,0,0|2,0,0]=4 7708 B14R1.587 CC(C#N)NC(=O)c1ccccc1Cl 1626a_100000737613_100000185844 [0,2,0,0,0,0|2,0,0]=4 7709 B14R1.587 CC(C#N)NC(=O)c1ccccc1Cl 527a_100000737613_100000185844 [0,2,0,0,0,0|2,0,0]=4 7710 B14R1.587 CC(C#N)NC(=O)c1ccccc1F 11a_100000737613_100000188656 [0,2,0,0,0,0|2,0,0]=4 7711 B14R1.587 CC(C#N)NC(=O)c1ccccc1F 1626a_100000737613_100000188656 [0,2,0,0,0,0|2,0,0]=4 7712 B14R1.587 CC(C#N)NC(=O)c1ccccc1F 527a_100000737613_100000188656 [0,2,0,0,0,0|2,0,0]=4 7713 B14R1.587 CC(C#N)NC(=O)c1ccccc1I 11a_100000737613_100000187884 [0,2,0,0,0,0|2,0,0]=4 7714 B14R1.587 CC(C#N)NC(=O)c1ccccc1I 1626a_100000737613_100000187884 [0,2,0,0,0,0|2,0,0]=4 7715 B14R1.587 CC(C#N)NC(=O)c1ccccc1I 527a_100000737613_100000187884 [0,2,0,0,0,0|2,0,0]=4 7716 B14R1.587 CC(C#N)NC(=O)c1ccccc1[O-] 1626a_100000737613_100009911694 [0,2,0,0,0,0|1,0,1]=4 7717 B14R1.587 CC(C#N)NC(=O)c1ccccc1[O-] 527a_100000737613_100009911694 [0,2,0,0,0,0|1,0,1]=4 7718 B14R1.587 CCC(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100000747405 [0,2,0,0,0,0|2,0,0]=4 7719 B14R1.587 CCC(=O)CC(=O)c1ccccc1Br 1458a_100000210414_100000199116 [0,2,0,0,0,0|2,0,0]=4 7720 B14R1.587 CCC(=O)CC(=O)c1ccccc1C 1458a_100000210414_100000741374 [0,2,0,0,0,0|2,0,0]=4 7721 B14R1.587 CCC(=O)CC(=O)c1ccccc1C 1458a_100000212026_100000747405 [0,2,0,0,0,0|2,0,0]=4 7722 B14R1.587 CCC(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100000747405 [0,2,0,0,0,0|2,0,0]=4 7723 B14R1.587 CCC(=O)CC(=O)c1ccccc1Cl 1458a_100000210414_100000211432 [0,2,0,0,0,0|2,0,0]=4 7724 B14R1.587 CCC(=O)CC(=O)c1ccccc1F 1458a_100000188656_100000747405 [0,2,0,0,0,0|2,0,0]=4 7725 B14R1.587 CCC(=O)CC(=O)c1ccccc1F 1458a_100000210414_100000204681 [0,2,0,0,0,0|2,0,0]=4 7726 B14R1.587 CCC(=O)CC(=O)c1ccccc1I 1458a_100000187884_100000747405 [0,2,0,0,0,0|2,0,0]=4 7727 B14R1.587 CCC(=O)CC(=O)c1ccccc1O 1458a_100000210414_100000188908 [0,2,0,0,0,0|1,0,0]=3 7728 B14R1.587 CCC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000747405 [0,2,0,0,0,0|1,0,0]=3 7729 B14R1.587 CCC(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000747405 [0,2,0,0,0,0|1,0,1]=4 7730 B14R1.587 CCC(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000748023 [0,2,0,0,0,0|2,0,0]=4 7731 B14R1.587 CCC(C)CC(=O)c1ccccc1C 1458a_100000212026_100000748023 [0,2,0,0,0,0|2,0,0]=4 7732 B14R1.587 CCC(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000748023 [0,2,0,0,0,0|2,0,0]=4 7733 B14R1.587 CCC(C)CC(=O)c1ccccc1F 1458a_100000188656_100000748023 [0,2,0,0,0,0|2,0,0]=4 7734 B14R1.587 CCC(C)CC(=O)c1ccccc1I 1458a_100000187884_100000748023 [0,2,0,0,0,0|2,0,0]=4 7735 B14R1.587 CCC(C)CC(=O)c1ccccc1O 1458a_100015234032_100000748023 [0,2,0,0,0,0|1,0,0]=3 7736 B14R1.587 CCC(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000748023 [0,2,0,0,0,0|1,0,1]=4 7737 B14R1.587 CCC(C)NC(=O)c1ccccc1Br 11a_100000209981_100000188424 [0,2,0,0,0,0|2,0,0]=4 7738 B14R1.587 CCC(C)NC(=O)c1ccccc1Br 1626a_100000209981_100000188424 [0,2,0,0,0,0|2,0,0]=4 7739 B14R1.587 CCC(C)NC(=O)c1ccccc1Br 240690a_100000209981_100000188424 [0,2,0,0,0,0|2,0,0]=4 7740 B14R1.587 CCC(C)NC(=O)c1ccccc1Br 527a_100000209981_100000188424 [0,2,0,0,0,0|2,0,0]=4 7741 B14R1.587 CCC(C)NC(=O)c1ccccc1C 11a_100000209981_100000212026 [0,2,0,0,0,0|2,0,0]=4 7742 B14R1.587 CCC(C)NC(=O)c1ccccc1C 1626a_100000209981_100000212026 [0,2,0,0,0,0|2,0,0]=4 7743 B14R1.587 CCC(C)NC(=O)c1ccccc1C 240690a_100000209981_100000212026 [0,2,0,0,0,0|2,0,0]=4 7744 B14R1.587 CCC(C)NC(=O)c1ccccc1C 527a_100000209981_100000212026 [0,2,0,0,0,0|2,0,0]=4 7745 B14R1.587 CCC(C)NC(=O)c1ccccc1Cl 11a_100000209981_100000185844 [0,2,0,0,0,0|2,0,0]=4 7746 B14R1.587 CCC(C)NC(=O)c1ccccc1Cl 1626a_100000209981_100000185844 [0,2,0,0,0,0|2,0,0]=4 7747 B14R1.587 CCC(C)NC(=O)c1ccccc1Cl 240690a_100000209981_100000185844 [0,2,0,0,0,0|2,0,0]=4 7748 B14R1.587 CCC(C)NC(=O)c1ccccc1Cl 527a_100000209981_100000185844 [0,2,0,0,0,0|2,0,0]=4 7749 B14R1.587 CCC(C)NC(=O)c1ccccc1F 11a_100000209981_100000188656 [0,2,0,0,0,0|2,0,0]=4 7750 B14R1.587 CCC(C)NC(=O)c1ccccc1F 1626a_100000209981_100000188656 [0,2,0,0,0,0|2,0,0]=4 7751 B14R1.587 CCC(C)NC(=O)c1ccccc1F 240690a_100000209981_100000188656 [0,2,0,0,0,0|2,0,0]=4 7752 B14R1.587 CCC(C)NC(=O)c1ccccc1F 527a_100000209981_100000188656 [0,2,0,0,0,0|2,0,0]=4 7753 B14R1.587 CCC(C)NC(=O)c1ccccc1I 11a_100000209981_100000187884 [0,2,0,0,0,0|2,0,0]=4 7754 B14R1.587 CCC(C)NC(=O)c1ccccc1I 1626a_100000209981_100000187884 [0,2,0,0,0,0|2,0,0]=4 7755 B14R1.587 CCC(C)NC(=O)c1ccccc1I 240690a_100000209981_100000187884 [0,2,0,0,0,0|2,0,0]=4 7756 B14R1.587 CCC(C)NC(=O)c1ccccc1I 527a_100000209981_100000187884 [0,2,0,0,0,0|2,0,0]=4 7757 B14R1.587 CCC(C)NC(=O)c1ccccc1O 240690a_100000209981_100015234032 [0,2,0,0,0,0|1,0,0]=3 7758 B14R1.587 CCC(C)NC(=O)c1ccccc1O 271570a_203496583355_200000152809 [0,2,0,0,0,0|1,0,0]=3 7759 B14R1.587 CCC(C)NC(=O)c1ccccc1[O-] 1626a_100000209981_100009911694 [0,2,0,0,0,0|1,0,1]=4 7760 B14R1.587 CCC(C)NC(=O)c1ccccc1[O-] 240690a_100000209981_100009911694 [0,2,0,0,0,0|1,0,1]=4 7761 B14R1.587 CCC(C)NC(=O)c1ccccc1[O-] 527a_100000209981_100009911694 [0,2,0,0,0,0|1,0,1]=4 7762 B14R1.587 CCC(O)CC(=O)c1ccccc1Br 1458a_100000188424_100011218378 [0,2,0,0,0,0|2,0,0]=4 7763 B14R1.587 CCC(O)CC(=O)c1ccccc1C 1458a_100000212026_100011218378 [0,2,0,0,0,0|2,0,0]=4 7764 B14R1.587 CCC(O)CC(=O)c1ccccc1Cl 1458a_100000185844_100011218378 [0,2,0,0,0,0|2,0,0]=4 7765 B14R1.587 CCC(O)CC(=O)c1ccccc1F 1458a_100000188656_100011218378 [0,2,0,0,0,0|2,0,0]=4 7766 B14R1.587 CCC(O)CC(=O)c1ccccc1I 1458a_100000187884_100011218378 [0,2,0,0,0,0|2,0,0]=4 7767 B14R1.587 CCC(O)CC(=O)c1ccccc1O 1458a_100015234032_100011218378 [0,2,0,0,0,0|1,0,0]=3 7768 B14R1.587 CCC(O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100011218378 [0,2,0,0,0,0|1,0,1]=4 7769 B14R1.587 CCN(C)CC(=O)c1ccccc1Br 269982a_100000225621_100000199116 [0,2,0,0,0,0|2,0,0]=4 7770 B14R1.587 CCN(C)CC(=O)c1ccccc1C 2230a_100000225621_100000741374 [0,2,0,0,0,0|2,0,0]=4 7771 B14R1.587 CCN(C)CC(=O)c1ccccc1C 269982a_100000225621_100000741374 [0,2,0,0,0,0|2,0,0]=4 7772 B14R1.587 CCN(C)CC(=O)c1ccccc1Cl 269982a_100000225621_100000211432 [0,2,0,0,0,0|2,0,0]=4 7773 B14R1.587 CCN(C)CC(=O)c1ccccc1F 269982a_100000225621_100000204681 [0,2,0,0,0,0|2,0,0]=4 7774 B14R1.587 CCN(C)CC(=O)c1ccccc1O 269982a_100000225621_100000188908 [0,2,0,0,0,0|1,0,0]=3 7775 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1Br 1458a_100000188424_100009816398 [0,2,0,0,0,0|2,0,0]=4 7776 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1C 1458a_100000212026_100009816398 [0,2,0,0,0,0|2,0,0]=4 7777 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1Cl 1458a_100000185844_100009816398 [0,2,0,0,0,0|2,0,0]=4 7778 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1F 1458a_100000188656_100009816398 [0,2,0,0,0,0|2,0,0]=4 7779 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1I 1458a_100000187884_100009816398 [0,2,0,0,0,0|2,0,0]=4 7780 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1O 1458a_100015234032_100009816398 [0,2,0,0,0,0|1,0,0]=3 7781 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100009816398 [0,2,0,0,0,0|1,0,1]=4 7782 B14R1.587 CNC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000183359 [0,2,0,0,0,0|1,0,1]=4 7783 B14R1.587 COC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000747449 [0,2,0,0,0,0|1,0,1]=4 7784 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1Br 1458a_100000188424_100000059175 [0,2,0,0,0,0|2,0,0]=4 7785 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1Cl 1458a_100000185844_100000059175 [0,2,0,0,0,0|2,0,0]=4 7786 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1F 1458a_100000188656_100000059175 [0,2,0,0,0,0|2,0,0]=4 7787 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1I 1458a_100000187884_100000059175 [0,2,0,0,0,0|2,0,0]=4 7788 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1O 1458a_100015234032_100000059175 [0,2,0,0,0,0|1,0,0]=3 7789 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000059175 [0,2,0,0,0,0|1,0,1]=4 7790 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1Br 11a_100102880703_100000188424 [0,2,0,0,0,0|2,0,0]=4 7791 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1Br 1626a_100102880703_100000188424 [0,2,0,0,0,0|2,0,0]=4 7792 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1Br 240690a_100102880703_100000188424 [0,2,0,0,0,0|2,0,0]=4 7793 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1Br 527a_100102880703_100000188424 [0,2,0,0,0,0|2,0,0]=4 7794 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1Cl 11a_100102880703_100000185844 [0,2,0,0,0,0|2,0,0]=4 7795 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1Cl 1626a_100102880703_100000185844 [0,2,0,0,0,0|2,0,0]=4 7796 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1Cl 240690a_100102880703_100000185844 [0,2,0,0,0,0|2,0,0]=4 7797 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1Cl 527a_100102880703_100000185844 [0,2,0,0,0,0|2,0,0]=4 7798 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1F 11a_100102880703_100000188656 [0,2,0,0,0,0|2,0,0]=4 7799 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1F 1626a_100102880703_100000188656 [0,2,0,0,0,0|2,0,0]=4 7800 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1F 240690a_100102880703_100000188656 [0,2,0,0,0,0|2,0,0]=4 7801 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1F 527a_100102880703_100000188656 [0,2,0,0,0,0|2,0,0]=4 7802 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1I 11a_100102880703_100000187884 [0,2,0,0,0,0|2,0,0]=4 7803 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1I 1626a_100102880703_100000187884 [0,2,0,0,0,0|2,0,0]=4 7804 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1I 240690a_100102880703_100000187884 [0,2,0,0,0,0|2,0,0]=4 7805 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1I 527a_100102880703_100000187884 [0,2,0,0,0,0|2,0,0]=4 7806 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1O 240690a_100102880703_100015234032 [0,2,0,0,0,0|1,0,0]=3 7807 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1[O-] 1626a_100102880703_100009911694 [0,2,0,0,0,0|1,0,1]=4 7808 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1[O-] 240690a_100102880703_100009911694 [0,2,0,0,0,0|1,0,1]=4 7809 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1[O-] 527a_100102880703_100009911694 [0,2,0,0,0,0|1,0,1]=4 7810 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1Br 240690a_100000737577_100000188424 [0,2,0,0,0,0|2,0,0]=4 7811 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1Br 527a_100000737577_100000188424 [0,2,0,0,0,0|2,0,0]=4 7812 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1Cl 240690a_100000737577_100000185844 [0,2,0,0,0,0|2,0,0]=4 7813 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1Cl 527a_100000737577_100000185844 [0,2,0,0,0,0|2,0,0]=4 7814 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1F 240690a_100000737577_100000188656 [0,2,0,0,0,0|2,0,0]=4 7815 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1F 527a_100000737577_100000188656 [0,2,0,0,0,0|2,0,0]=4 7816 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1I 240690a_100000737577_100000187884 [0,2,0,0,0,0|2,0,0]=4 7817 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1I 527a_100000737577_100000187884 [0,2,0,0,0,0|2,0,0]=4 7818 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1O 240690a_100000737577_100015234032 [0,2,0,0,0,0|1,0,0]=3 7819 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1[O-] 240690a_100000737577_100009911694 [0,2,0,0,0,0|1,0,1]=4 7820 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1[O-] 527a_100000737577_100009911694 [0,2,0,0,0,0|1,0,1]=4 7821 B14R1.587 Cc1ccccc1C(=O)C[C@@H](C)CO 1458a_100000212026_100000059175 [0,2,0,0,0,0|2,0,0]=4 7822 B14R1.587 Cc1ccccc1C(=O)NC(C)C#N 11a_100000737613_100000212026 [0,2,0,0,0,0|2,0,0]=4 7823 B14R1.587 Cc1ccccc1C(=O)NC(C)C#N 1626a_100000737613_100000212026 [0,2,0,0,0,0|2,0,0]=4 7824 B14R1.587 Cc1ccccc1C(=O)NC(C)C#N 527a_100000737613_100000212026 [0,2,0,0,0,0|2,0,0]=4 7825 B14R1.587 Cc1ccccc1C(=O)N[C@H](C)CF 11a_100102880703_100000212026 [0,2,0,0,0,0|2,0,0]=4 7826 B14R1.587 Cc1ccccc1C(=O)N[C@H](C)CF 1626a_100102880703_100000212026 [0,2,0,0,0,0|2,0,0]=4 7827 B14R1.587 Cc1ccccc1C(=O)N[C@H](C)CF 240690a_100102880703_100000212026 [0,2,0,0,0,0|2,0,0]=4 7828 B14R1.587 Cc1ccccc1C(=O)N[C@H](C)CF 527a_100102880703_100000212026 [0,2,0,0,0,0|2,0,0]=4 7829 B14R1.587 Cc1ccccc1C(=O)N[C@H](C)CO 240690a_100000737577_100000212026 [0,2,0,0,0,0|2,0,0]=4 7830 B14R1.587 Cc1ccccc1C(=O)N[C@H](C)CO 527a_100000737577_100000212026 [0,2,0,0,0,0|2,0,0]=4 7831 B14R1.587 O=C(CO)CC(=O)c1ccccc1O 1458a_100000210174_100000188908 [0,2,0,0,0,0|1,0,1]=4 7832 B14R1.840 C#Cc1ccccc1C(=O)CC(C)C 1458a_100011243808_100000210624 [0,2,0,0,0,0|2,0,0]=4 7833 B14R1.840 C#Cc1ccccc1C(=O)CC(C)O 1458a_100011243808_100011218427 [0,2,0,0,0,0|2,0,0]=4 7834 B14R1.840 C#Cc1ccccc1C(=O)NC(C)C 527a_100138425928_100011243808 [0,2,0,0,0,0|2,0,0]=4 7835 B14R1.840 C=C(C)CC(=O)c1ccccc1CO 1458a_100011301526_100000748629 [0,2,0,0,0,0|1,0,1]=4 7836 B14R1.840 C=C(C)CC(=O)c1ccccc1OC 1458a_100000185835_100000748629 [0,2,0,0,0,0|1,0,1]=4 7837 B14R1.840 C=Cc1ccccc1C(=O)CC(C)C 1458a_100011830265_100000210624 [0,2,0,0,0,0|2,0,0]=4 7838 B14R1.840 C=Cc1ccccc1C(=O)CC(C)O 1458a_100011830265_100011218427 [0,2,0,0,0,0|2,0,0]=4 7839 B14R1.840 C=Cc1ccccc1C(=O)NC(C)C 1626a_100138425928_100011830265 [0,2,0,0,0,0|2,0,0]=4 7840 B14R1.840 C=Cc1ccccc1C(=O)NC(C)C 271570a_100011290941_200000152627 [0,2,0,0,0,0|2,0,0]=4 7841 B14R1.840 C=Cc1ccccc1C(=O)OC(C)C 271570a_100011290941_100000169877 [0,2,0,0,0,0|1,0,0]=3 7842 B14R1.840 CC(C)CC(=O)c1ccccc1C#N 1458a_100000742908_100000210624 [0,2,0,0,0,0|2,0,0]=4 7843 B14R1.840 CC(C)CC(=O)c1ccccc1CO 1458a_100011301526_100000210624 [0,2,0,0,0,0|1,0,0]=3 7844 B14R1.840 CC(C)CC(=O)c1ccccc1I=O 1458a_100000032414_100000210624 [0,2,0,0,0,0|1,0,1]=4 7845 B14R1.840 CC(C)NC(=O)c1ccccc1C#N 11a_100138425928_100000742908 [0,2,0,0,0,0|2,0,0]=4 7846 B14R1.840 CC(C)NC(=O)c1ccccc1C#N 1626a_100138425928_100000742908 [0,2,0,0,0,0|2,0,0]=4 7847 B14R1.840 CC(C)NC(=O)c1ccccc1C#N 527a_100138425928_100000742908 [0,2,0,0,0,0|2,0,0]=4 7848 B14R1.840 CC(C)NC(=O)c1ccccc1I=O 1626a_100138425928_100000032414 [0,2,0,0,0,0|1,0,1]=4 7849 B14R1.840 CC(C)NC(=O)c1ccccc1I=O 240690a_100138425928_100000032414 [0,2,0,0,0,0|1,0,1]=4 7850 B14R1.840 CC(C)NC(=O)c1ccccc1I=O 527a_100138425928_100000032414 [0,2,0,0,0,0|1,0,1]=4 7851 B14R1.840 CC(C)NC(=O)c1ccccc1S[13CH3] 62a_200000152627_200025704644 [0,2,0,0,0,0|1,1,0]=4 7852 B14R1.840 CC(C)NC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000152627 [0,2,0,0,0,0|1,1,0]=4 7853 B14R1.840 CC(C)OC(=O)c1ccccc1O[13CH3] 34a_100000169923_200025704644 [0,2,0,0,0,0|0,0,0]=2 7854 B14R1.840 CC(C)OC(=O)c1ccccc1O[13CH3] 7a_100000169923_200025704644 [0,2,0,0,0,0|0,0,0]=2 7855 B14R1.840 CC(C)OC(=O)c1ccccc1S[13CH3] 62a_100000169877_200025704644 [0,2,0,0,0,0|0,1,0]=3 7856 B14R1.840 CC(C)OC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000169877 [0,2,0,0,0,0|0,1,0]=3 7857 B14R1.840 CC(O)CC(=O)c1ccccc1C#N 1458a_100000742908_100011218427 [0,2,0,0,0,0|2,0,0]=4 7858 B14R1.840 CC(O)CC(=O)c1ccccc1CO 1458a_100011301526_100011218427 [0,2,0,0,0,0|1,0,0]=3 7859 B14R1.840 CC(O)CC(=O)c1ccccc1I=O 1458a_100000032414_100011218427 [0,2,0,0,0,0|1,0,1]=4 7860 B14R1.840 CCc1ccccc1C(=O)CC(C)C 1458a_100000689120_100000210624 [0,2,0,0,0,0|2,0,0]=4 7861 B14R1.840 CCc1ccccc1C(=O)CC(C)O 1458a_100000689120_100011218427 [0,2,0,0,0,0|2,0,0]=4 7862 B14R1.840 CCc1ccccc1C(=O)NC(C)C 11a_100138425928_100000689120 [0,2,0,0,0,0|2,0,0]=4 7863 B14R1.840 CCc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000689120 [0,2,0,0,0,0|2,0,0]=4 7864 B14R1.840 CCc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000689120 [0,2,0,0,0,0|2,0,0]=4 7865 B14R1.840 CCc1ccccc1C(=O)NC(C)C 527a_100138425928_100000689120 [0,2,0,0,0,0|2,0,0]=4 7866 B14R1.840 CNc1ccccc1C(=O)NC(C)C 27a_100102657272_200000152627 [0,2,0,0,0,0|2,0,0]=4 7867 B14R1.840 COc1ccccc1C(=O)CC(=O)C 1458a_100000070787_100000195505 [0,2,0,0,0,0|1,0,1]=4 7868 B14R1.840 COc1ccccc1C(=O)CC(C)C 1458a_100000185835_100000210624 [0,2,0,0,0,0|1,0,0]=3 7869 B14R1.840 COc1ccccc1C(=O)CC(C)O 1458a_100000185835_100011218427 [0,2,0,0,0,0|1,0,0]=3 7870 B14R1.840 COc1ccccc1C(=O)CC(F)F 1458a_100000185835_100011934356 [0,2,0,0,0,0|2,0,0]=4 7871 B14R1.840 COc1ccccc1C(=O)CN(C)C 269982a_100102631434_100000195505 [0,2,0,0,0,0|2,0,0]=4 7872 B14R1.840 COc1ccccc1C(=O)NC(C)C 11a_100138425928_100000185835 [0,2,0,0,0,0|1,0,0]=3 7873 B14R1.840 COc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000185835 [0,2,0,0,0,0|1,0,0]=3 7874 B14R1.840 COc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000185835 [0,2,0,0,0,0|1,0,0]=3 7875 B14R1.840 COc1ccccc1C(=O)NC(C)C 527a_100138425928_100000185835 [0,2,0,0,0,0|1,0,0]=3 7876 B14R1.840 COc1ccccc1C(=O)OC(C)C 34a_100000169923_200000210301 [0,2,0,0,0,0|0,0,0]=2 7877 B14R1.840 COc1ccccc1C(=O)OC(C)C 7a_100000169923_200000210301 [0,2,0,0,0,0|0,0,0]=2 7878 B14R1.840 COc1ccccc1C(C)OC(C)C 7a_100000742714_100000210206 [0,2,0,0,0,0|1,0,1]=4 7879 B14R1.840 CSc1ccccc1C(=O)CC(C)C 1458a_100000183967_100000210624 [0,2,0,0,0,0|1,1,0]=4 7880 B14R1.840 CSc1ccccc1C(=O)CC(C)O 1458a_100000183967_100011218427 [0,2,0,0,0,0|1,1,0]=4 7881 B14R1.840 CSc1ccccc1C(=O)NC(C)C 11a_100138425928_100000183967 [0,2,0,0,0,0|1,1,0]=4 7882 B14R1.840 CSc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000183967 [0,2,0,0,0,0|1,1,0]=4 7883 B14R1.840 CSc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000183967 [0,2,0,0,0,0|1,1,0]=4 7884 B14R1.840 CSc1ccccc1C(=O)NC(C)C 527a_100138425928_100000183967 [0,2,0,0,0,0|1,1,0]=4 7885 B14R1.840 CSc1ccccc1C(=O)NC(C)C 62a_200000152627_200000210301 [0,2,0,0,0,0|1,1,0]=4 7886 B14R1.840 CSc1ccccc1C(=O)NC(C)C 62a_200000210301_200000152627 [0,2,0,0,0,0|1,1,0]=4 7887 B14R1.840 CSc1ccccc1C(=O)OC(C)C 62a_100000169877_200000210301 [0,2,0,0,0,0|0,1,0]=3 7888 B14R1.840 CSc1ccccc1C(=O)OC(C)C 62a_200000210301_100000169877 [0,2,0,0,0,0|0,1,0]=3 7889 B14R1.840 O=C(CC(F)F)c1ccccc1CO 1458a_100011301526_100011934356 [0,2,0,0,0,0|2,0,0]=4 7890 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1Br 11a_100000715429_100000188424 [0,2,0,0,0,0|2,0,0]=4 7891 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1Br 1626a_100000715429_100000188424 [0,2,0,0,0,0|2,0,0]=4 7892 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1Br 240690a_100000715429_100000188424 [0,2,0,0,0,0|2,0,0]=4 7893 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1Br 527a_100000715429_100000188424 [0,2,0,0,0,0|2,0,0]=4 7894 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1Cl 11a_100000715429_100000185844 [0,2,0,0,0,0|2,0,0]=4 7895 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1Cl 1626a_100000715429_100000185844 [0,2,0,0,0,0|2,0,0]=4 7896 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1Cl 240690a_100000715429_100000185844 [0,2,0,0,0,0|2,0,0]=4 7897 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1Cl 527a_100000715429_100000185844 [0,2,0,0,0,0|2,0,0]=4 7898 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1F 11a_100000715429_100000188656 [0,2,0,0,0,0|2,0,0]=4 7899 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1F 1626a_100000715429_100000188656 [0,2,0,0,0,0|2,0,0]=4 7900 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1F 240690a_100000715429_100000188656 [0,2,0,0,0,0|2,0,0]=4 7901 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1F 527a_100000715429_100000188656 [0,2,0,0,0,0|2,0,0]=4 7902 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1I 11a_100000715429_100000187884 [0,2,0,0,0,0|2,0,0]=4 7903 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1I 1626a_100000715429_100000187884 [0,2,0,0,0,0|2,0,0]=4 7904 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1I 240690a_100000715429_100000187884 [0,2,0,0,0,0|2,0,0]=4 7905 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1I 527a_100000715429_100000187884 [0,2,0,0,0,0|2,0,0]=4 7906 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1O 240690a_100000715429_100015234032 [0,2,0,0,0,0|1,0,0]=3 7907 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1O 271570a_203496583355_200000154197 [0,2,0,0,0,0|1,0,0]=3 7908 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1[O-] 1626a_100000715429_100009911694 [0,2,0,0,0,0|1,0,1]=4 7909 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1[O-] 240690a_100000715429_100009911694 [0,2,0,0,0,0|1,0,1]=4 7910 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1[O-] 527a_100000715429_100009911694 [0,2,0,0,0,0|1,0,1]=4 7911 B14R1.4451 CC(C)(C)OC(=O)c1ccccc1O 271570a_203496583355_100011942462 [0,2,0,0,0,0|0,0,0]=2 7912 B14R1.4451 CC(C)(C)OC(=O)c1cccnc1O 271570a_203496583355_100011933524 [0,2,0,0,0,0|1,0,0]=3 7913 B14R1.4451 CC(C)(C)OC(=O)c1ccncc1O 271570a_203496583355_100012344410 [0,2,0,0,0,0|1,0,0]=3 7914 B14R1.4451 CC(C)(C)OC(=O)c1ncccc1O 271570a_203496583355_100012355708 [0,2,0,0,0,0|1,0,0]=3 7915 B14R1.4451 CS(=O)(=O)NC(=O)c1ccccc1O 2740a_100000171171_100015234032 [0,2,0,0,0,0|2,0,0]=4 7916 B14R1.4451 C[Si](C)(C)CC(=O)c1ccccc1O 1458a_100015234032_100000233785 [0,2,0,0,0,0|1,1,0]=4 7917 B14R1.4451 Cc1ccccc1C(=O)NC(C)(C)C 11a_100000715429_100000212026 [0,2,0,0,0,0|2,0,0]=4 7918 B14R1.4451 Cc1ccccc1C(=O)NC(C)(C)C 1626a_100000715429_100000212026 [0,2,0,0,0,0|2,0,0]=4 7919 B14R1.4451 Cc1ccccc1C(=O)NC(C)(C)C 240690a_100000715429_100000212026 [0,2,0,0,0,0|2,0,0]=4 7920 B14R1.4451 Cc1ccccc1C(=O)NC(C)(C)C 527a_100000715429_100000212026 [0,2,0,0,0,0|2,0,0]=4 7921 B14R1.5805 CC(C)NS(=O)(=O)c1ccccc1O 271570a_203496583355_200000164685 [0,2,0,0,0,0|2,0,0]=4 7922 B14R1.5805 CC(C)OS(=O)(=O)c1ccccc1O 271570a_203496583355_100010876974 [0,2,0,0,0,0|1,0,0]=3 7923 B14R1.5958 C=C(C)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100000748629 [0,2,0,0,0,0|1,0,1]=4 7924 B14R1.5958 C=C(C)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000748629 [0,2,0,0,0,0|1,0,1]=4 7925 B14R1.5958 C=C(C)CC(=O)c1c(cccc1F)O 1458a_100000763259_100000748629 [0,2,0,0,0,0|1,0,1]=4 7926 B14R1.5958 C=C(C)CC(=O)c1c(cccc1O)C 1458a_100011934116_100000748629 [0,2,0,0,0,0|1,0,1]=4 7927 B14R1.5958 C=C(C)CC(=O)c1c(cccc1O)O 1458a_100000755285_100000748629 [0,2,0,0,0,0|1,0,1]=4 7928 B14R1.5958 CC(C)CC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210624 [0,2,0,0,0,0|2,0,0]=4 7929 B14R1.5958 CC(C)CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210624 [0,2,0,0,0,0|2,0,0]=4 7930 B14R1.5958 CC(C)CC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210624 [0,2,0,0,0,0|2,0,0]=4 7931 B14R1.5958 CC(C)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210624 [0,2,0,0,0,0|1,0,0]=3 7932 B14R1.5958 CC(C)CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210624 [0,2,0,0,0,0|2,0,0]=4 7933 B14R1.5958 CC(C)CC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210624 [0,2,0,0,0,0|2,0,0]=4 7934 B14R1.5958 CC(C)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210624 [0,2,0,0,0,0|1,0,0]=3 7935 B14R1.5958 CC(C)CC(=O)c1c(cccc1F)F 1458a_100000210804_100000210624 [0,2,0,0,0,0|2,0,0]=4 7936 B14R1.5958 CC(C)CC(=O)c1c(cccc1F)O 1458a_100000763259_100000210624 [0,2,0,0,0,0|1,0,0]=3 7937 B14R1.5958 CC(C)CC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210624 [0,2,0,0,0,0|2,0,0]=4 7938 B14R1.5958 CC(C)CC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210624 [0,2,0,0,0,0|2,0,0]=4 7939 B14R1.5958 CC(C)CC(=O)c1c(cccc1I)F 1458a_100000023732_100000210624 [0,2,0,0,0,0|2,0,0]=4 7940 B14R1.5958 CC(C)CC(=O)c1c(cccc1O)O 1458a_100000755285_100000210624 [0,2,0,0,0,0|1,0,0]=3 7941 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)Br 11a_100138425928_100000690891 [0,2,0,0,0,0|2,0,0]=4 7942 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)Br 1626a_100138425928_100000690891 [0,2,0,0,0,0|2,0,0]=4 7943 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)Br 240690a_100138425928_100000690891 [0,2,0,0,0,0|2,0,0]=4 7944 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)Br 527a_100138425928_100000690891 [0,2,0,0,0,0|2,0,0]=4 7945 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)Cl 11a_100138425928_100011253703 [0,2,0,0,0,0|2,0,0]=4 7946 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)Cl 1626a_100138425928_100011253703 [0,2,0,0,0,0|2,0,0]=4 7947 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)Cl 240690a_100138425928_100011253703 [0,2,0,0,0,0|2,0,0]=4 7948 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)Cl 527a_100138425928_100011253703 [0,2,0,0,0,0|2,0,0]=4 7949 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)F 11a_100138425928_100000752694 [0,2,0,0,0,0|2,0,0]=4 7950 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)F 1626a_100138425928_100000752694 [0,2,0,0,0,0|2,0,0]=4 7951 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)F 240690a_100138425928_100000752694 [0,2,0,0,0,0|2,0,0]=4 7952 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)F 527a_100138425928_100000752694 [0,2,0,0,0,0|2,0,0]=4 7953 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)O 240690a_100138425928_100011935254 [0,2,0,0,0,0|1,0,0]=3 7954 B14R1.5958 CC(C)NC(=O)c1c(cccc1Br)O 527a_100138425928_100011935254 [0,2,0,0,0,0|1,0,0]=3 7955 B14R1.5958 CC(C)NC(=O)c1c(cccc1Cl)Cl 11a_100138425928_100000210656 [0,2,0,0,0,0|2,0,0]=4 7956 B14R1.5958 CC(C)NC(=O)c1c(cccc1Cl)Cl 1626a_100138425928_100000210656 [0,2,0,0,0,0|2,0,0]=4 7957 B14R1.5958 CC(C)NC(=O)c1c(cccc1Cl)Cl 240690a_100138425928_100000210656 [0,2,0,0,0,0|2,0,0]=4 7958 B14R1.5958 CC(C)NC(=O)c1c(cccc1Cl)F 11a_100138425928_100000210369 [0,2,0,0,0,0|2,0,0]=4 7959 B14R1.5958 CC(C)NC(=O)c1c(cccc1Cl)F 1626a_100138425928_100000210369 [0,2,0,0,0,0|2,0,0]=4 7960 B14R1.5958 CC(C)NC(=O)c1c(cccc1Cl)F 240690a_100138425928_100000210369 [0,2,0,0,0,0|2,0,0]=4 7961 B14R1.5958 CC(C)NC(=O)c1c(cccc1Cl)F 527a_100138425928_100000210369 [0,2,0,0,0,0|2,0,0]=4 7962 B14R1.5958 CC(C)NC(=O)c1c(cccc1Cl)O 240690a_100138425928_100000745519 [0,2,0,0,0,0|1,0,0]=3 7963 B14R1.5958 CC(C)NC(=O)c1c(cccc1Cl)O 527a_100138425928_100000745519 [0,2,0,0,0,0|1,0,0]=3 7964 B14R1.5958 CC(C)NC(=O)c1c(cccc1F)F 11a_100138425928_100000210804 [0,2,0,0,0,0|2,0,0]=4 7965 B14R1.5958 CC(C)NC(=O)c1c(cccc1F)F 1626a_100138425928_100000210804 [0,2,0,0,0,0|2,0,0]=4 7966 B14R1.5958 CC(C)NC(=O)c1c(cccc1F)F 240690a_100138425928_100000210804 [0,2,0,0,0,0|2,0,0]=4 7967 B14R1.5958 CC(C)NC(=O)c1c(cccc1F)F 527a_100138425928_100000210804 [0,2,0,0,0,0|2,0,0]=4 7968 B14R1.5958 CC(C)NC(=O)c1c(cccc1F)O 527a_100138425928_100000763259 [0,2,0,0,0,0|1,0,0]=3 7969 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)Br 11a_100138425928_100010232521 [0,2,0,0,0,0|2,0,0]=4 7970 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)Br 1626a_100138425928_100010232521 [0,2,0,0,0,0|2,0,0]=4 7971 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)Br 240690a_100138425928_100010232521 [0,2,0,0,0,0|2,0,0]=4 7972 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)Br 527a_100138425928_100010232521 [0,2,0,0,0,0|2,0,0]=4 7973 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)Cl 11a_100138425928_100000702859 [0,2,0,0,0,0|2,0,0]=4 7974 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)Cl 1626a_100138425928_100000702859 [0,2,0,0,0,0|2,0,0]=4 7975 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)Cl 240690a_100138425928_100000702859 [0,2,0,0,0,0|2,0,0]=4 7976 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)Cl 527a_100138425928_100000702859 [0,2,0,0,0,0|2,0,0]=4 7977 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)F 11a_100138425928_100000023732 [0,2,0,0,0,0|2,0,0]=4 7978 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)F 1626a_100138425928_100000023732 [0,2,0,0,0,0|2,0,0]=4 7979 B14R1.5958 CC(C)NC(=O)c1c(cccc1I)F 240690a_100138425928_100000023732 [0,2,0,0,0,0|2,0,0]=4 7980 B14R1.5958 CC(C)NC(=O)c1c(cccc1O)O 527a_100138425928_100000755285 [0,2,0,0,0,0|1,0,0]=3 7981 B14R1.5958 CC(O)CC(=O)c1c(cccc1Br)Br 1458a_100000690891_100011218427 [0,2,0,0,0,0|2,0,0]=4 7982 B14R1.5958 CC(O)CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100011218427 [0,2,0,0,0,0|2,0,0]=4 7983 B14R1.5958 CC(O)CC(=O)c1c(cccc1Br)F 1458a_100000752694_100011218427 [0,2,0,0,0,0|2,0,0]=4 7984 B14R1.5958 CC(O)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100011218427 [0,2,0,0,0,0|1,0,0]=3 7985 B14R1.5958 CC(O)CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100011218427 [0,2,0,0,0,0|2,0,0]=4 7986 B14R1.5958 CC(O)CC(=O)c1c(cccc1Cl)F 1458a_100000210369_100011218427 [0,2,0,0,0,0|2,0,0]=4 7987 B14R1.5958 CC(O)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011218427 [0,2,0,0,0,0|1,0,0]=3 7988 B14R1.5958 CC(O)CC(=O)c1c(cccc1F)F 1458a_100000210804_100011218427 [0,2,0,0,0,0|2,0,0]=4 7989 B14R1.5958 CC(O)CC(=O)c1c(cccc1F)O 1458a_100000763259_100011218427 [0,2,0,0,0,0|1,0,0]=3 7990 B14R1.5958 CC(O)CC(=O)c1c(cccc1I)Br 1458a_100010232521_100011218427 [0,2,0,0,0,0|2,0,0]=4 7991 B14R1.5958 CC(O)CC(=O)c1c(cccc1I)Cl 1458a_100000702859_100011218427 [0,2,0,0,0,0|2,0,0]=4 7992 B14R1.5958 CC(O)CC(=O)c1c(cccc1I)F 1458a_100000023732_100011218427 [0,2,0,0,0,0|2,0,0]=4 7993 B14R1.5958 CC(O)CC(=O)c1c(cccc1O)O 1458a_100000755285_100011218427 [0,2,0,0,0,0|1,0,0]=3 7994 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)Br 1458a_100000701904_100000210624 [0,2,0,0,0,0|2,0,0]=4 7995 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)C 1458a_100000758298_100000210624 [0,2,0,0,0,0|2,0,0]=4 7996 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)Cl 1458a_100000692601_100000210624 [0,2,0,0,0,0|2,0,0]=4 7997 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)F 1458a_100000762013_100000210624 [0,2,0,0,0,0|2,0,0]=4 7998 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)I 1458a_100000688020_100000210624 [0,2,0,0,0,0|2,0,0]=4 7999 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)O 1458a_100011934116_100000210624 [0,2,0,0,0,0|1,0,0]=3 8000 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)Br 1458a_100000701904_100011218427 [0,2,0,0,0,0|2,0,0]=4 8001 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)C 1458a_100000758298_100011218427 [0,2,0,0,0,0|2,0,0]=4 8002 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)Cl 1458a_100000692601_100011218427 [0,2,0,0,0,0|2,0,0]=4 8003 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)F 1458a_100000762013_100011218427 [0,2,0,0,0,0|2,0,0]=4 8004 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)I 1458a_100000688020_100011218427 [0,2,0,0,0,0|2,0,0]=4 8005 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)O 1458a_100011934116_100011218427 [0,2,0,0,0,0|1,0,0]=3 8006 B14R1.5958 Cc1cccc(c1C(=O)CC(F)F)O 1458a_100011934116_100011934356 [0,2,0,0,0,0|2,0,0]=4 8007 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)Br 11a_100138425928_100000701904 [0,2,0,0,0,0|2,0,0]=4 8008 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)Br 1626a_100138425928_100000701904 [0,2,0,0,0,0|2,0,0]=4 8009 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)Br 240690a_100138425928_100000701904 [0,2,0,0,0,0|2,0,0]=4 8010 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)Br 527a_100138425928_100000701904 [0,2,0,0,0,0|2,0,0]=4 8011 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)C 11a_100138425928_100000758298 [0,2,0,0,0,0|2,0,0]=4 8012 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)C 1626a_100138425928_100000758298 [0,2,0,0,0,0|2,0,0]=4 8013 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)C 240690a_100138425928_100000758298 [0,2,0,0,0,0|2,0,0]=4 8014 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)Cl 11a_100138425928_100000692601 [0,2,0,0,0,0|2,0,0]=4 8015 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)Cl 1626a_100138425928_100000692601 [0,2,0,0,0,0|2,0,0]=4 8016 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)Cl 240690a_100138425928_100000692601 [0,2,0,0,0,0|2,0,0]=4 8017 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)F 11a_100138425928_100000762013 [0,2,0,0,0,0|2,0,0]=4 8018 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)F 1626a_100138425928_100000762013 [0,2,0,0,0,0|2,0,0]=4 8019 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)F 240690a_100138425928_100000762013 [0,2,0,0,0,0|2,0,0]=4 8020 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)F 527a_100138425928_100000762013 [0,2,0,0,0,0|2,0,0]=4 8021 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)I 11a_100138425928_100000688020 [0,2,0,0,0,0|2,0,0]=4 8022 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)I 1626a_100138425928_100000688020 [0,2,0,0,0,0|2,0,0]=4 8023 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)I 240690a_100138425928_100000688020 [0,2,0,0,0,0|2,0,0]=4 8024 B14R1.5958 O=C(CC(F)F)c1c(cccc1Br)O 1458a_100011935254_100011934356 [0,2,0,0,0,0|2,0,0]=4 8025 B14R1.5958 O=C(CC(F)F)c1c(cccc1Cl)O 1458a_100000745519_100011934356 [0,2,0,0,0,0|2,0,0]=4 8026 B14R1.5958 O=C(CC(F)F)c1c(cccc1F)O 1458a_100000763259_100011934356 [0,2,0,0,0,0|2,0,0]=4 8027 B14R1.5958 O=C(CC(F)F)c1c(cccc1O)O 1458a_100000755285_100011934356 [0,2,0,0,0,0|2,0,0]=4 8028 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000748629 [0,2,0,0,0,0|1,0,1]=4 8029 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)C 1458a_100000212137_100000748629 [0,2,0,0,0,0|1,0,1]=4 8030 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000748629 [0,2,0,0,0,0|1,0,1]=4 8031 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100000748629 [0,2,0,0,0,0|1,0,1]=4 8032 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100000748629 [0,2,0,0,0,0|1,0,1]=4 8033 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100000748629 [0,2,0,0,0,0|1,0,1]=4 8034 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1O)F 1458a_100000070787_100009817053 [0,2,0,0,0,0|1,0,1]=4 8035 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1O)O 1458a_100000070787_100009814262 [0,2,0,0,0,0|1,0,1]=4 8036 B14R1.6048 CC(C)CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210624 [0,2,0,0,0,0|2,0,0]=4 8037 B14R1.6048 CC(C)CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210624 [0,2,0,0,0,0|2,0,0]=4 8038 B14R1.6048 CC(C)CC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210624 [0,2,0,0,0,0|2,0,0]=4 8039 B14R1.6048 CC(C)CC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210624 [0,2,0,0,0,0|2,0,0]=4 8040 B14R1.6048 CC(C)CC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210624 [0,2,0,0,0,0|2,0,0]=4 8041 B14R1.6048 CC(C)CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210624 [0,2,0,0,0,0|2,0,0]=4 8042 B14R1.6048 CC(C)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210624 [0,2,0,0,0,0|2,0,0]=4 8043 B14R1.6048 CC(C)CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210624 [0,2,0,0,0,0|2,0,0]=4 8044 B14R1.6048 CC(C)CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210624 [0,2,0,0,0,0|2,0,0]=4 8045 B14R1.6048 CC(C)CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210624 [0,2,0,0,0,0|2,0,0]=4 8046 B14R1.6048 CC(C)CC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210624 [0,2,0,0,0,0|2,0,0]=4 8047 B14R1.6048 CC(C)CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210624 [0,2,0,0,0,0|2,0,0]=4 8048 B14R1.6048 CC(C)CC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210624 [0,2,0,0,0,0|2,0,0]=4 8049 B14R1.6048 CC(C)CC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210624 [0,2,0,0,0,0|2,0,0]=4 8050 B14R1.6048 CC(C)CC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210624 [0,2,0,0,0,0|2,0,0]=4 8051 B14R1.6048 CC(C)CC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210624 [0,2,0,0,0,0|2,0,0]=4 8052 B14R1.6048 CC(C)CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210624 [0,2,0,0,0,0|2,0,0]=4 8053 B14R1.6048 CC(C)CC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210624 [0,2,0,0,0,0|2,0,0]=4 8054 B14R1.6048 CC(C)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210624 [0,2,0,0,0,0|1,0,0]=3 8055 B14R1.6048 CC(C)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210624 [0,2,0,0,0,0|1,0,0]=3 8056 B14R1.6048 CC(C)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210624 [0,2,0,0,0,0|1,0,0]=3 8057 B14R1.6048 CC(C)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210624 [0,2,0,0,0,0|1,0,0]=3 8058 B14R1.6048 CC(C)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210624 [0,2,0,0,0,0|1,0,0]=3 8059 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)Br 11a_100138425928_100000762965 [0,2,0,0,0,0|2,0,0]=4 8060 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)Br 1626a_100138425928_100000762965 [0,2,0,0,0,0|2,0,0]=4 8061 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)Br 240690a_100138425928_100000762965 [0,2,0,0,0,0|2,0,0]=4 8062 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)Br 527a_100138425928_100000762965 [0,2,0,0,0,0|2,0,0]=4 8063 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)Cl 11a_100138425928_100000766353 [0,2,0,0,0,0|2,0,0]=4 8064 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)Cl 1626a_100138425928_100000766353 [0,2,0,0,0,0|2,0,0]=4 8065 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)Cl 240690a_100138425928_100000766353 [0,2,0,0,0,0|2,0,0]=4 8066 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)Cl 527a_100138425928_100000766353 [0,2,0,0,0,0|2,0,0]=4 8067 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)F 11a_100138425928_100000212304 [0,2,0,0,0,0|2,0,0]=4 8068 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)F 1626a_100138425928_100000212304 [0,2,0,0,0,0|2,0,0]=4 8069 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)F 240690a_100138425928_100000212304 [0,2,0,0,0,0|2,0,0]=4 8070 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)F 527a_100138425928_100000212304 [0,2,0,0,0,0|2,0,0]=4 8071 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)I 11a_100138425928_100012360512 [0,2,0,0,0,0|2,0,0]=4 8072 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)I 1626a_100138425928_100012360512 [0,2,0,0,0,0|2,0,0]=4 8073 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)I 240690a_100138425928_100012360512 [0,2,0,0,0,0|2,0,0]=4 8074 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)I 527a_100138425928_100012360512 [0,2,0,0,0,0|2,0,0]=4 8075 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)O 240690a_100138425928_100012344906 [0,2,0,0,0,0|2,0,0]=4 8076 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Br)O 527a_100138425928_100012344906 [0,2,0,0,0,0|2,0,0]=4 8077 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)Br 11a_100138425928_100000741628 [0,2,0,0,0,0|2,0,0]=4 8078 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)Br 1626a_100138425928_100000741628 [0,2,0,0,0,0|2,0,0]=4 8079 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)Br 240690a_100138425928_100000741628 [0,2,0,0,0,0|2,0,0]=4 8080 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)Br 527a_100138425928_100000741628 [0,2,0,0,0,0|2,0,0]=4 8081 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)Cl 11a_100138425928_100000185840 [0,2,0,0,0,0|2,0,0]=4 8082 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)Cl 1626a_100138425928_100000185840 [0,2,0,0,0,0|2,0,0]=4 8083 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)Cl 240690a_100138425928_100000185840 [0,2,0,0,0,0|2,0,0]=4 8084 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)Cl 527a_100138425928_100000185840 [0,2,0,0,0,0|2,0,0]=4 8085 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)F 11a_100138425928_100000211397 [0,2,0,0,0,0|2,0,0]=4 8086 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)F 1626a_100138425928_100000211397 [0,2,0,0,0,0|2,0,0]=4 8087 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)F 240690a_100138425928_100000211397 [0,2,0,0,0,0|2,0,0]=4 8088 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)F 527a_100138425928_100000211397 [0,2,0,0,0,0|2,0,0]=4 8089 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)I 11a_100138425928_100000751301 [0,2,0,0,0,0|2,0,0]=4 8090 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)I 1626a_100138425928_100000751301 [0,2,0,0,0,0|2,0,0]=4 8091 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)I 240690a_100138425928_100000751301 [0,2,0,0,0,0|2,0,0]=4 8092 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)I 527a_100138425928_100000751301 [0,2,0,0,0,0|2,0,0]=4 8093 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)O 240690a_100138425928_100000702456 [0,2,0,0,0,0|2,0,0]=4 8094 B14R1.6048 CC(C)NC(=O)c1ccc(cc1Cl)O 527a_100138425928_100000702456 [0,2,0,0,0,0|2,0,0]=4 8095 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)Br 11a_100138425928_100000214689 [0,2,0,0,0,0|2,0,0]=4 8096 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)Br 1626a_100138425928_100000214689 [0,2,0,0,0,0|2,0,0]=4 8097 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)Br 240690a_100138425928_100000214689 [0,2,0,0,0,0|2,0,0]=4 8098 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)Br 527a_100138425928_100000214689 [0,2,0,0,0,0|2,0,0]=4 8099 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)Cl 11a_100138425928_100000212326 [0,2,0,0,0,0|2,0,0]=4 8100 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)Cl 1626a_100138425928_100000212326 [0,2,0,0,0,0|2,0,0]=4 8101 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)Cl 240690a_100138425928_100000212326 [0,2,0,0,0,0|2,0,0]=4 8102 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)Cl 527a_100138425928_100000212326 [0,2,0,0,0,0|2,0,0]=4 8103 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)F 11a_100138425928_100000211022 [0,2,0,0,0,0|2,0,0]=4 8104 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)F 1626a_100138425928_100000211022 [0,2,0,0,0,0|2,0,0]=4 8105 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)F 240690a_100138425928_100000211022 [0,2,0,0,0,0|2,0,0]=4 8106 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)F 527a_100138425928_100000211022 [0,2,0,0,0,0|2,0,0]=4 8107 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)I 11a_100138425928_100000037189 [0,2,0,0,0,0|2,0,0]=4 8108 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)I 1626a_100138425928_100000037189 [0,2,0,0,0,0|2,0,0]=4 8109 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)I 240690a_100138425928_100000037189 [0,2,0,0,0,0|2,0,0]=4 8110 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)I 527a_100138425928_100000037189 [0,2,0,0,0,0|2,0,0]=4 8111 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)O 240690a_100138425928_100000689029 [0,2,0,0,0,0|2,0,0]=4 8112 B14R1.6048 CC(C)NC(=O)c1ccc(cc1F)O 527a_100138425928_100000689029 [0,2,0,0,0,0|2,0,0]=4 8113 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)Br 11a_100138425928_100000751167 [0,2,0,0,0,0|2,0,0]=4 8114 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)Br 1626a_100138425928_100000751167 [0,2,0,0,0,0|2,0,0]=4 8115 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)Br 240690a_100138425928_100000751167 [0,2,0,0,0,0|2,0,0]=4 8116 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)Br 527a_100138425928_100000751167 [0,2,0,0,0,0|2,0,0]=4 8117 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)Cl 11a_100138425928_100000739380 [0,2,0,0,0,0|2,0,0]=4 8118 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)Cl 1626a_100138425928_100000739380 [0,2,0,0,0,0|2,0,0]=4 8119 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)Cl 240690a_100138425928_100000739380 [0,2,0,0,0,0|2,0,0]=4 8120 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)Cl 527a_100138425928_100000739380 [0,2,0,0,0,0|2,0,0]=4 8121 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)F 11a_100138425928_100000739341 [0,2,0,0,0,0|2,0,0]=4 8122 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)F 1626a_100138425928_100000739341 [0,2,0,0,0,0|2,0,0]=4 8123 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)F 240690a_100138425928_100000739341 [0,2,0,0,0,0|2,0,0]=4 8124 B14R1.6048 CC(C)NC(=O)c1ccc(cc1I)F 527a_100138425928_100000739341 [0,2,0,0,0,0|2,0,0]=4 8125 B14R1.6048 CC(C)NC(=O)c1ccc(cc1O)Br 240690a_100138425928_100000744433 [0,2,0,0,0,0|1,0,0]=3 8126 B14R1.6048 CC(C)NC(=O)c1ccc(cc1O)Br 527a_100138425928_100000744433 [0,2,0,0,0,0|1,0,0]=3 8127 B14R1.6048 CC(C)NC(=O)c1ccc(cc1O)Cl 11a_100138425928_100000188622 [0,2,0,0,0,0|1,0,0]=3 8128 B14R1.6048 CC(C)NC(=O)c1ccc(cc1O)Cl 240690a_100138425928_100000188622 [0,2,0,0,0,0|1,0,0]=3 8129 B14R1.6048 CC(C)NC(=O)c1ccc(cc1O)Cl 527a_100138425928_100000188622 [0,2,0,0,0,0|1,0,0]=3 8130 B14R1.6048 CC(C)NC(=O)c1ccc(cc1O)F 240690a_100138425928_100000746061 [0,2,0,0,0,0|1,0,0]=3 8131 B14R1.6048 CC(C)NC(=O)c1ccc(cc1O)F 527a_100138425928_100000746061 [0,2,0,0,0,0|1,0,0]=3 8132 B14R1.6048 CC(C)NC(=O)c1ccc(cc1O)I 240690a_100138425928_100000091984 [0,2,0,0,0,0|1,0,0]=3 8133 B14R1.6048 CC(C)NC(=O)c1ccc(cc1O)I 527a_100138425928_100000091984 [0,2,0,0,0,0|1,0,0]=3 8134 B14R1.6048 CC(C)OC(=O)c1ccc(cc1F)O 271570a_203496583355_200000240902 [0,2,0,0,0,0|1,0,0]=3 8135 B14R1.6048 CC(O)CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100011218427 [0,2,0,0,0,0|2,0,0]=4 8136 B14R1.6048 CC(O)CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011218427 [0,2,0,0,0,0|2,0,0]=4 8137 B14R1.6048 CC(O)CC(=O)c1ccc(cc1Br)F 1458a_100000212304_100011218427 [0,2,0,0,0,0|2,0,0]=4 8138 B14R1.6048 CC(O)CC(=O)c1ccc(cc1Br)I 1458a_100012360512_100011218427 [0,2,0,0,0,0|2,0,0]=4 8139 B14R1.6048 CC(O)CC(=O)c1ccc(cc1Br)O 1458a_100012344906_100011218427 [0,2,0,0,0,0|2,0,0]=4 8140 B14R1.6048 CC(O)CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100011218427 [0,2,0,0,0,0|2,0,0]=4 8141 B14R1.6048 CC(O)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011218427 [0,2,0,0,0,0|2,0,0]=4 8142 B14R1.6048 CC(O)CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100011218427 [0,2,0,0,0,0|2,0,0]=4 8143 B14R1.6048 CC(O)CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100011218427 [0,2,0,0,0,0|2,0,0]=4 8144 B14R1.6048 CC(O)CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100011218427 [0,2,0,0,0,0|2,0,0]=4 8145 B14R1.6048 CC(O)CC(=O)c1ccc(cc1F)Br 1458a_100000214689_100011218427 [0,2,0,0,0,0|2,0,0]=4 8146 B14R1.6048 CC(O)CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011218427 [0,2,0,0,0,0|2,0,0]=4 8147 B14R1.6048 CC(O)CC(=O)c1ccc(cc1F)F 1458a_100000211022_100011218427 [0,2,0,0,0,0|2,0,0]=4 8148 B14R1.6048 CC(O)CC(=O)c1ccc(cc1F)I 1458a_100000037189_100011218427 [0,2,0,0,0,0|2,0,0]=4 8149 B14R1.6048 CC(O)CC(=O)c1ccc(cc1F)O 1458a_100000689029_100011218427 [0,2,0,0,0,0|2,0,0]=4 8150 B14R1.6048 CC(O)CC(=O)c1ccc(cc1I)Br 1458a_100000751167_100011218427 [0,2,0,0,0,0|2,0,0]=4 8151 B14R1.6048 CC(O)CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011218427 [0,2,0,0,0,0|2,0,0]=4 8152 B14R1.6048 CC(O)CC(=O)c1ccc(cc1I)F 1458a_100000739341_100011218427 [0,2,0,0,0,0|2,0,0]=4 8153 B14R1.6048 CC(O)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011218427 [0,2,0,0,0,0|1,0,0]=3 8154 B14R1.6048 CC(O)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011218427 [0,2,0,0,0,0|1,0,0]=3 8155 B14R1.6048 CC(O)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100011218427 [0,2,0,0,0,0|1,0,0]=3 8156 B14R1.6048 CC(O)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100011218427 [0,2,0,0,0,0|1,0,0]=3 8157 B14R1.6048 CC(O)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100011218427 [0,2,0,0,0,0|1,0,0]=3 8158 B14R1.6048 CN(C)CC(=O)c1ccc(cc1O)F 269982a_100102631434_100009817053 [0,2,0,0,0,0|2,0,0]=4 8159 B14R1.6048 CN(C)CC(=O)c1ccc(cc1O)O 269982a_100102631434_100009814262 [0,2,0,0,0,0|2,0,0]=4 8160 B14R1.6048 Cc1cc(ccc1C(=O)CC(C)C)Br 1458a_100000741311_100000210624 [0,2,0,0,0,0|2,0,0]=4 8161 B14R1.6048 Cc1cc(ccc1C(=O)CC(C)C)Cl 1458a_100000688705_100000210624 [0,2,0,0,0,0|2,0,0]=4 8162 B14R1.6048 Cc1cc(ccc1C(=O)CC(C)C)F 1458a_100000686989_100000210624 [0,2,0,0,0,0|2,0,0]=4 8163 B14R1.6048 Cc1cc(ccc1C(=O)CC(C)C)I 1458a_100010189873_100000210624 [0,2,0,0,0,0|2,0,0]=4 8164 B14R1.6048 Cc1cc(ccc1C(=O)CC(C)C)O 1458a_100000692822_100000210624 [0,2,0,0,0,0|2,0,0]=4 8165 B14R1.6048 Cc1cc(ccc1C(=O)CC(C)O)Br 1458a_100000741311_100011218427 [0,2,0,0,0,0|2,0,0]=4 8166 B14R1.6048 Cc1cc(ccc1C(=O)CC(C)O)Cl 1458a_100000688705_100011218427 [0,2,0,0,0,0|2,0,0]=4 8167 B14R1.6048 Cc1cc(ccc1C(=O)CC(C)O)F 1458a_100000686989_100011218427 [0,2,0,0,0,0|2,0,0]=4 8168 B14R1.6048 Cc1cc(ccc1C(=O)CC(C)O)I 1458a_100010189873_100011218427 [0,2,0,0,0,0|2,0,0]=4 8169 B14R1.6048 Cc1cc(ccc1C(=O)CC(C)O)O 1458a_100000692822_100011218427 [0,2,0,0,0,0|2,0,0]=4 8170 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)Br 11a_100138425928_100000741311 [0,2,0,0,0,0|2,0,0]=4 8171 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)Br 1626a_100138425928_100000741311 [0,2,0,0,0,0|2,0,0]=4 8172 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)Br 240690a_100138425928_100000741311 [0,2,0,0,0,0|2,0,0]=4 8173 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)Br 527a_100138425928_100000741311 [0,2,0,0,0,0|2,0,0]=4 8174 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)Cl 11a_100138425928_100000688705 [0,2,0,0,0,0|2,0,0]=4 8175 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)Cl 1626a_100138425928_100000688705 [0,2,0,0,0,0|2,0,0]=4 8176 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)Cl 240690a_100138425928_100000688705 [0,2,0,0,0,0|2,0,0]=4 8177 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)Cl 527a_100138425928_100000688705 [0,2,0,0,0,0|2,0,0]=4 8178 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)F 11a_100138425928_100000686989 [0,2,0,0,0,0|2,0,0]=4 8179 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)F 1626a_100138425928_100000686989 [0,2,0,0,0,0|2,0,0]=4 8180 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)F 240690a_100138425928_100000686989 [0,2,0,0,0,0|2,0,0]=4 8181 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)F 527a_100138425928_100000686989 [0,2,0,0,0,0|2,0,0]=4 8182 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)I 11a_100138425928_100010189873 [0,2,0,0,0,0|2,0,0]=4 8183 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)I 1626a_100138425928_100010189873 [0,2,0,0,0,0|2,0,0]=4 8184 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)I 240690a_100138425928_100010189873 [0,2,0,0,0,0|2,0,0]=4 8185 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)I 527a_100138425928_100010189873 [0,2,0,0,0,0|2,0,0]=4 8186 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)O 240690a_100138425928_100000692822 [0,2,0,0,0,0|2,0,0]=4 8187 B14R1.6048 Cc1cc(ccc1C(=O)NC(C)C)O 527a_100138425928_100000692822 [0,2,0,0,0,0|2,0,0]=4 8188 B14R1.6048 Cc1ccc(c(c1)Br)C(=O)CC(C)C 1458a_100000685072_100000210624 [0,2,0,0,0,0|2,0,0]=4 8189 B14R1.6048 Cc1ccc(c(c1)Br)C(=O)CC(C)O 1458a_100000685072_100011218427 [0,2,0,0,0,0|2,0,0]=4 8190 B14R1.6048 Cc1ccc(c(c1)Br)C(=O)NC(C)C 11a_100138425928_100000685072 [0,2,0,0,0,0|2,0,0]=4 8191 B14R1.6048 Cc1ccc(c(c1)Br)C(=O)NC(C)C 1626a_100138425928_100000685072 [0,2,0,0,0,0|2,0,0]=4 8192 B14R1.6048 Cc1ccc(c(c1)Br)C(=O)NC(C)C 240690a_100138425928_100000685072 [0,2,0,0,0,0|2,0,0]=4 8193 B14R1.6048 Cc1ccc(c(c1)Br)C(=O)NC(C)C 527a_100138425928_100000685072 [0,2,0,0,0,0|2,0,0]=4 8194 B14R1.6048 Cc1ccc(c(c1)C)C(=O)CC(C)C 1458a_100000211164_100000210624 [0,2,0,0,0,0|2,0,0]=4 8195 B14R1.6048 Cc1ccc(c(c1)C)C(=O)CC(C)O 1458a_100000211164_100011218427 [0,2,0,0,0,0|2,0,0]=4 8196 B14R1.6048 Cc1ccc(c(c1)C)C(=O)NC(C)C 11a_100138425928_100000211164 [0,2,0,0,0,0|2,0,0]=4 8197 B14R1.6048 Cc1ccc(c(c1)C)C(=O)NC(C)C 1626a_100138425928_100000211164 [0,2,0,0,0,0|2,0,0]=4 8198 B14R1.6048 Cc1ccc(c(c1)C)C(=O)NC(C)C 240690a_100138425928_100000211164 [0,2,0,0,0,0|2,0,0]=4 8199 B14R1.6048 Cc1ccc(c(c1)C)C(=O)NC(C)C 527a_100138425928_100000211164 [0,2,0,0,0,0|2,0,0]=4 8200 B14R1.6048 Cc1ccc(c(c1)Cl)C(=O)CC(C)C 1458a_100000766932_100000210624 [0,2,0,0,0,0|2,0,0]=4 8201 B14R1.6048 Cc1ccc(c(c1)Cl)C(=O)CC(C)O 1458a_100000766932_100011218427 [0,2,0,0,0,0|2,0,0]=4 8202 B14R1.6048 Cc1ccc(c(c1)Cl)C(=O)NC(C)C 11a_100138425928_100000766932 [0,2,0,0,0,0|2,0,0]=4 8203 B14R1.6048 Cc1ccc(c(c1)Cl)C(=O)NC(C)C 1626a_100138425928_100000766932 [0,2,0,0,0,0|2,0,0]=4 8204 B14R1.6048 Cc1ccc(c(c1)Cl)C(=O)NC(C)C 240690a_100138425928_100000766932 [0,2,0,0,0,0|2,0,0]=4 8205 B14R1.6048 Cc1ccc(c(c1)Cl)C(=O)NC(C)C 527a_100138425928_100000766932 [0,2,0,0,0,0|2,0,0]=4 8206 B14R1.6048 Cc1ccc(c(c1)F)C(=O)CC(C)C 1458a_100000766033_100000210624 [0,2,0,0,0,0|2,0,0]=4 8207 B14R1.6048 Cc1ccc(c(c1)F)C(=O)CC(C)O 1458a_100000766033_100011218427 [0,2,0,0,0,0|2,0,0]=4 8208 B14R1.6048 Cc1ccc(c(c1)F)C(=O)NC(C)C 11a_100138425928_100000766033 [0,2,0,0,0,0|2,0,0]=4 8209 B14R1.6048 Cc1ccc(c(c1)F)C(=O)NC(C)C 1626a_100138425928_100000766033 [0,2,0,0,0,0|2,0,0]=4 8210 B14R1.6048 Cc1ccc(c(c1)F)C(=O)NC(C)C 240690a_100138425928_100000766033 [0,2,0,0,0,0|2,0,0]=4 8211 B14R1.6048 Cc1ccc(c(c1)F)C(=O)NC(C)C 527a_100138425928_100000766033 [0,2,0,0,0,0|2,0,0]=4 8212 B14R1.6048 Cc1ccc(c(c1)I)C(=O)CC(C)C 1458a_100009999607_100000210624 [0,2,0,0,0,0|2,0,0]=4 8213 B14R1.6048 Cc1ccc(c(c1)I)C(=O)CC(C)O 1458a_100009999607_100011218427 [0,2,0,0,0,0|2,0,0]=4 8214 B14R1.6048 Cc1ccc(c(c1)I)C(=O)NC(C)C 11a_100138425928_100009999607 [0,2,0,0,0,0|2,0,0]=4 8215 B14R1.6048 Cc1ccc(c(c1)I)C(=O)NC(C)C 1626a_100138425928_100009999607 [0,2,0,0,0,0|2,0,0]=4 8216 B14R1.6048 Cc1ccc(c(c1)I)C(=O)NC(C)C 240690a_100138425928_100009999607 [0,2,0,0,0,0|2,0,0]=4 8217 B14R1.6048 Cc1ccc(c(c1)I)C(=O)NC(C)C 527a_100138425928_100009999607 [0,2,0,0,0,0|2,0,0]=4 8218 B14R1.6048 Cc1ccc(c(c1)O)C(=O)CC(C)C 1458a_100000212137_100000210624 [0,2,0,0,0,0|1,0,0]=3 8219 B14R1.6048 Cc1ccc(c(c1)O)C(=O)CC(C)O 1458a_100000212137_100011218427 [0,2,0,0,0,0|1,0,0]=3 8220 B14R1.6048 Cc1ccc(c(c1)O)C(=O)CC(F)F 1458a_100000212137_100011934356 [0,2,0,0,0,0|2,0,0]=4 8221 B14R1.6048 Cc1ccc(c(c1)O)C(=O)NC(C)C 1626a_100138425928_100000212137 [0,2,0,0,0,0|1,0,0]=3 8222 B14R1.6048 Cc1ccc(c(c1)O)C(=O)NC(C)C 240690a_100138425928_100000212137 [0,2,0,0,0,0|1,0,0]=3 8223 B14R1.6048 Cc1ccc(c(c1)O)C(=O)NC(C)C 527a_100138425928_100000212137 [0,2,0,0,0,0|1,0,0]=3 8224 B14R1.6048 O=C(CC(F)F)c1ccc(cc1O)Br 1458a_100000744433_100011934356 [0,2,0,0,0,0|2,0,0]=4 8225 B14R1.6048 O=C(CC(F)F)c1ccc(cc1O)Cl 1458a_100000188622_100011934356 [0,2,0,0,0,0|2,0,0]=4 8226 B14R1.6048 O=C(CC(F)F)c1ccc(cc1O)F 1458a_100000746061_100011934356 [0,2,0,0,0,0|2,0,0]=4 8227 B14R1.6048 O=C(CC(F)F)c1ccc(cc1O)I 1458a_100000091984_100011934356 [0,2,0,0,0,0|2,0,0]=4 8228 B14R1.6048 O=C(CC(F)F)c1ccc(cc1O)O 1458a_100000212172_100011934356 [0,2,0,0,0,0|2,0,0]=4 8229 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000748629 [0,2,0,0,0,0|1,0,1]=4 8230 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)C 1458a_100000229998_100000748629 [0,2,0,0,0,0|1,0,1]=4 8231 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000748629 [0,2,0,0,0,0|1,0,1]=4 8232 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100000748629 [0,2,0,0,0,0|1,0,1]=4 8233 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100000748629 [0,2,0,0,0,0|1,0,1]=4 8234 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100000748629 [0,2,0,0,0,0|1,0,1]=4 8235 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1O)Br 1458a_100000070787_200009828000 [0,2,0,0,0,0|1,0,1]=4 8236 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1O)Cl 1458a_100000070787_200009816716 [0,2,0,0,0,0|1,0,1]=4 8237 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1O)F 1458a_100000070787_100000047744 [0,2,0,0,0,0|1,0,1]=4 8238 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1O)O 1458a_100000070787_100009814097 [0,2,0,0,0,0|1,0,1]=4 8239 B14R1.6052 CC(C)CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210624 [0,2,0,0,0,0|2,0,0]=4 8240 B14R1.6052 CC(C)CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210624 [0,2,0,0,0,0|2,0,0]=4 8241 B14R1.6052 CC(C)CC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210624 [0,2,0,0,0,0|2,0,0]=4 8242 B14R1.6052 CC(C)CC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210624 [0,2,0,0,0,0|2,0,0]=4 8243 B14R1.6052 CC(C)CC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210624 [0,2,0,0,0,0|2,0,0]=4 8244 B14R1.6052 CC(C)CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210624 [0,2,0,0,0,0|2,0,0]=4 8245 B14R1.6052 CC(C)CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210624 [0,2,0,0,0,0|2,0,0]=4 8246 B14R1.6052 CC(C)CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210624 [0,2,0,0,0,0|2,0,0]=4 8247 B14R1.6052 CC(C)CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210624 [0,2,0,0,0,0|2,0,0]=4 8248 B14R1.6052 CC(C)CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210624 [0,2,0,0,0,0|2,0,0]=4 8249 B14R1.6052 CC(C)CC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210624 [0,2,0,0,0,0|2,0,0]=4 8250 B14R1.6052 CC(C)CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210624 [0,2,0,0,0,0|2,0,0]=4 8251 B14R1.6052 CC(C)CC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210624 [0,2,0,0,0,0|2,0,0]=4 8252 B14R1.6052 CC(C)CC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210624 [0,2,0,0,0,0|2,0,0]=4 8253 B14R1.6052 CC(C)CC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210624 [0,2,0,0,0,0|2,0,0]=4 8254 B14R1.6052 CC(C)CC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210624 [0,2,0,0,0,0|2,0,0]=4 8255 B14R1.6052 CC(C)CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210624 [0,2,0,0,0,0|2,0,0]=4 8256 B14R1.6052 CC(C)CC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210624 [0,2,0,0,0,0|2,0,0]=4 8257 B14R1.6052 CC(C)CC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210624 [0,2,0,0,0,0|2,0,0]=4 8258 B14R1.6052 CC(C)CC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210624 [0,2,0,0,0,0|2,0,0]=4 8259 B14R1.6052 CC(C)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210624 [0,2,0,0,0,0|1,0,0]=3 8260 B14R1.6052 CC(C)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210624 [0,2,0,0,0,0|1,0,0]=3 8261 B14R1.6052 CC(C)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210624 [0,2,0,0,0,0|1,0,0]=3 8262 B14R1.6052 CC(C)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210624 [0,2,0,0,0,0|1,0,0]=3 8263 B14R1.6052 CC(C)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210624 [0,2,0,0,0,0|1,0,0]=3 8264 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)Br 11a_100138425928_100000690610 [0,2,0,0,0,0|2,0,0]=4 8265 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)Br 1626a_100138425928_100000690610 [0,2,0,0,0,0|2,0,0]=4 8266 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)Br 240690a_100138425928_100000690610 [0,2,0,0,0,0|2,0,0]=4 8267 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)Br 527a_100138425928_100000690610 [0,2,0,0,0,0|2,0,0]=4 8268 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)Cl 11a_100138425928_100000736951 [0,2,0,0,0,0|2,0,0]=4 8269 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)Cl 1626a_100138425928_100000736951 [0,2,0,0,0,0|2,0,0]=4 8270 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)Cl 240690a_100138425928_100000736951 [0,2,0,0,0,0|2,0,0]=4 8271 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)Cl 527a_100138425928_100000736951 [0,2,0,0,0,0|2,0,0]=4 8272 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)F 11a_100138425928_100000212315 [0,2,0,0,0,0|2,0,0]=4 8273 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)F 1626a_100138425928_100000212315 [0,2,0,0,0,0|2,0,0]=4 8274 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)F 240690a_100138425928_100000212315 [0,2,0,0,0,0|2,0,0]=4 8275 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)F 527a_100138425928_100000212315 [0,2,0,0,0,0|2,0,0]=4 8276 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)I 11a_100138425928_100000698340 [0,2,0,0,0,0|2,0,0]=4 8277 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)I 1626a_100138425928_100000698340 [0,2,0,0,0,0|2,0,0]=4 8278 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)I 240690a_100138425928_100000698340 [0,2,0,0,0,0|2,0,0]=4 8279 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)I 527a_100138425928_100000698340 [0,2,0,0,0,0|2,0,0]=4 8280 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)O 240690a_100138425928_100012352043 [0,2,0,0,0,0|2,0,0]=4 8281 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)O 527a_100138425928_100012352043 [0,2,0,0,0,0|2,0,0]=4 8282 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)Br 11a_100138425928_100000211212 [0,2,0,0,0,0|2,0,0]=4 8283 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)Br 1626a_100138425928_100000211212 [0,2,0,0,0,0|2,0,0]=4 8284 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)Br 240690a_100138425928_100000211212 [0,2,0,0,0,0|2,0,0]=4 8285 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)Br 527a_100138425928_100000211212 [0,2,0,0,0,0|2,0,0]=4 8286 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)Cl 11a_100138425928_100000210642 [0,2,0,0,0,0|2,0,0]=4 8287 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)Cl 1626a_100138425928_100000210642 [0,2,0,0,0,0|2,0,0]=4 8288 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)Cl 240690a_100138425928_100000210642 [0,2,0,0,0,0|2,0,0]=4 8289 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)Cl 527a_100138425928_100000210642 [0,2,0,0,0,0|2,0,0]=4 8290 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)F 11a_100138425928_100011219680 [0,2,0,0,0,0|2,0,0]=4 8291 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)F 1626a_100138425928_100011219680 [0,2,0,0,0,0|2,0,0]=4 8292 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)F 240690a_100138425928_100011219680 [0,2,0,0,0,0|2,0,0]=4 8293 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)F 527a_100138425928_100011219680 [0,2,0,0,0,0|2,0,0]=4 8294 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)I 11a_100138425928_100000688013 [0,2,0,0,0,0|2,0,0]=4 8295 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)I 1626a_100138425928_100000688013 [0,2,0,0,0,0|2,0,0]=4 8296 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)I 240690a_100138425928_100000688013 [0,2,0,0,0,0|2,0,0]=4 8297 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)I 527a_100138425928_100000688013 [0,2,0,0,0,0|2,0,0]=4 8298 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)O 240690a_100138425928_100000719527 [0,2,0,0,0,0|2,0,0]=4 8299 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)O 527a_100138425928_100000719527 [0,2,0,0,0,0|2,0,0]=4 8300 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)Br 11a_100138425928_100000212322 [0,2,0,0,0,0|2,0,0]=4 8301 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)Br 1626a_100138425928_100000212322 [0,2,0,0,0,0|2,0,0]=4 8302 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)Br 240690a_100138425928_100000212322 [0,2,0,0,0,0|2,0,0]=4 8303 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)Br 527a_100138425928_100000212322 [0,2,0,0,0,0|2,0,0]=4 8304 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)Cl 11a_100138425928_100000214954 [0,2,0,0,0,0|2,0,0]=4 8305 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)Cl 1626a_100138425928_100000214954 [0,2,0,0,0,0|2,0,0]=4 8306 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)Cl 240690a_100138425928_100000214954 [0,2,0,0,0,0|2,0,0]=4 8307 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)Cl 527a_100138425928_100000214954 [0,2,0,0,0,0|2,0,0]=4 8308 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)F 11a_100138425928_100000198512 [0,2,0,0,0,0|2,0,0]=4 8309 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)F 1626a_100138425928_100000198512 [0,2,0,0,0,0|2,0,0]=4 8310 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)F 240690a_100138425928_100000198512 [0,2,0,0,0,0|2,0,0]=4 8311 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)F 527a_100138425928_100000198512 [0,2,0,0,0,0|2,0,0]=4 8312 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)I 11a_100138425928_100000688014 [0,2,0,0,0,0|2,0,0]=4 8313 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)I 1626a_100138425928_100000688014 [0,2,0,0,0,0|2,0,0]=4 8314 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)I 240690a_100138425928_100000688014 [0,2,0,0,0,0|2,0,0]=4 8315 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)I 527a_100138425928_100000688014 [0,2,0,0,0,0|2,0,0]=4 8316 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)O 240690a_100138425928_100000037260 [0,2,0,0,0,0|2,0,0]=4 8317 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)O 527a_100138425928_100000037260 [0,2,0,0,0,0|2,0,0]=4 8318 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)Br 11a_100138425928_100000183945 [0,2,0,0,0,0|2,0,0]=4 8319 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)Br 1626a_100138425928_100000183945 [0,2,0,0,0,0|2,0,0]=4 8320 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)Br 240690a_100138425928_100000183945 [0,2,0,0,0,0|2,0,0]=4 8321 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)Cl 11a_100138425928_100000739379 [0,2,0,0,0,0|2,0,0]=4 8322 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)Cl 1626a_100138425928_100000739379 [0,2,0,0,0,0|2,0,0]=4 8323 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)Cl 240690a_100138425928_100000739379 [0,2,0,0,0,0|2,0,0]=4 8324 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)Cl 527a_100138425928_100000739379 [0,2,0,0,0,0|2,0,0]=4 8325 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)F 11a_100138425928_100000748905 [0,2,0,0,0,0|2,0,0]=4 8326 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)F 1626a_100138425928_100000748905 [0,2,0,0,0,0|2,0,0]=4 8327 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)F 240690a_100138425928_100000748905 [0,2,0,0,0,0|2,0,0]=4 8328 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)F 527a_100138425928_100000748905 [0,2,0,0,0,0|2,0,0]=4 8329 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)I 11a_100138425928_100000750460 [0,2,0,0,0,0|2,0,0]=4 8330 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)I 1626a_100138425928_100000750460 [0,2,0,0,0,0|2,0,0]=4 8331 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)I 240690a_100138425928_100000750460 [0,2,0,0,0,0|2,0,0]=4 8332 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)I 527a_100138425928_100000750460 [0,2,0,0,0,0|2,0,0]=4 8333 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)O 1626a_100138425928_200009995701 [0,2,0,0,0,0|2,0,0]=4 8334 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)O 240690a_100138425928_200009995701 [0,2,0,0,0,0|2,0,0]=4 8335 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)O 527a_100138425928_200009995701 [0,2,0,0,0,0|2,0,0]=4 8336 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)Br 1626a_100138425928_100000212140 [0,2,0,0,0,0|1,0,0]=3 8337 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)Br 240690a_100138425928_100000212140 [0,2,0,0,0,0|1,0,0]=3 8338 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)Br 527a_100138425928_100000212140 [0,2,0,0,0,0|1,0,0]=3 8339 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)Cl 11a_100138425928_100000212143 [0,2,0,0,0,0|1,0,0]=3 8340 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)Cl 1626a_100138425928_100000212143 [0,2,0,0,0,0|1,0,0]=3 8341 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)Cl 240690a_100138425928_100000212143 [0,2,0,0,0,0|1,0,0]=3 8342 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)Cl 527a_100138425928_100000212143 [0,2,0,0,0,0|1,0,0]=3 8343 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)F 240690a_100138425928_100000742286 [0,2,0,0,0,0|1,0,0]=3 8344 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)F 271570a_203496583355_200000205832 [0,2,0,0,0,0|1,0,0]=3 8345 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)F 527a_100138425928_100000742286 [0,2,0,0,0,0|1,0,0]=3 8346 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)I 240690a_100138425928_100000212111 [0,2,0,0,0,0|1,0,0]=3 8347 B14R1.6052 CC(C)NC(=O)c1cc(ccc1O)I 527a_100138425928_100000212111 [0,2,0,0,0,0|1,0,0]=3 8348 B14R1.6052 CC(O)CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100011218427 [0,2,0,0,0,0|2,0,0]=4 8349 B14R1.6052 CC(O)CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100011218427 [0,2,0,0,0,0|2,0,0]=4 8350 B14R1.6052 CC(O)CC(=O)c1cc(ccc1Br)F 1458a_100000212315_100011218427 [0,2,0,0,0,0|2,0,0]=4 8351 B14R1.6052 CC(O)CC(=O)c1cc(ccc1Br)I 1458a_100000698340_100011218427 [0,2,0,0,0,0|2,0,0]=4 8352 B14R1.6052 CC(O)CC(=O)c1cc(ccc1Br)O 1458a_100012352043_100011218427 [0,2,0,0,0,0|2,0,0]=4 8353 B14R1.6052 CC(O)CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100011218427 [0,2,0,0,0,0|2,0,0]=4 8354 B14R1.6052 CC(O)CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100011218427 [0,2,0,0,0,0|2,0,0]=4 8355 B14R1.6052 CC(O)CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100011218427 [0,2,0,0,0,0|2,0,0]=4 8356 B14R1.6052 CC(O)CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100011218427 [0,2,0,0,0,0|2,0,0]=4 8357 B14R1.6052 CC(O)CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100011218427 [0,2,0,0,0,0|2,0,0]=4 8358 B14R1.6052 CC(O)CC(=O)c1cc(ccc1F)Br 1458a_100000212322_100011218427 [0,2,0,0,0,0|2,0,0]=4 8359 B14R1.6052 CC(O)CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100011218427 [0,2,0,0,0,0|2,0,0]=4 8360 B14R1.6052 CC(O)CC(=O)c1cc(ccc1F)F 1458a_100000198512_100011218427 [0,2,0,0,0,0|2,0,0]=4 8361 B14R1.6052 CC(O)CC(=O)c1cc(ccc1F)I 1458a_100000688014_100011218427 [0,2,0,0,0,0|2,0,0]=4 8362 B14R1.6052 CC(O)CC(=O)c1cc(ccc1F)O 1458a_100000037260_100011218427 [0,2,0,0,0,0|2,0,0]=4 8363 B14R1.6052 CC(O)CC(=O)c1cc(ccc1I)Br 1458a_100000183945_100011218427 [0,2,0,0,0,0|2,0,0]=4 8364 B14R1.6052 CC(O)CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100011218427 [0,2,0,0,0,0|2,0,0]=4 8365 B14R1.6052 CC(O)CC(=O)c1cc(ccc1I)F 1458a_100000748905_100011218427 [0,2,0,0,0,0|2,0,0]=4 8366 B14R1.6052 CC(O)CC(=O)c1cc(ccc1I)I 1458a_100000750460_100011218427 [0,2,0,0,0,0|2,0,0]=4 8367 B14R1.6052 CC(O)CC(=O)c1cc(ccc1I)O 1458a_200009995701_100011218427 [0,2,0,0,0,0|2,0,0]=4 8368 B14R1.6052 CC(O)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011218427 [0,2,0,0,0,0|1,0,0]=3 8369 B14R1.6052 CC(O)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011218427 [0,2,0,0,0,0|1,0,0]=3 8370 B14R1.6052 CC(O)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100011218427 [0,2,0,0,0,0|1,0,0]=3 8371 B14R1.6052 CC(O)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100011218427 [0,2,0,0,0,0|1,0,0]=3 8372 B14R1.6052 CC(O)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100011218427 [0,2,0,0,0,0|1,0,0]=3 8373 B14R1.6052 CN(C)CC(=O)c1cc(ccc1O)Br 269982a_100102631434_200009828000 [0,2,0,0,0,0|2,0,0]=4 8374 B14R1.6052 CN(C)CC(=O)c1cc(ccc1O)Cl 269982a_100102631434_200009816716 [0,2,0,0,0,0|2,0,0]=4 8375 B14R1.6052 CN(C)CC(=O)c1cc(ccc1O)F 269982a_100102631434_100009814381 [0,2,0,0,0,0|2,0,0]=4 8376 B14R1.6052 CN(C)CC(=O)c1cc(ccc1O)O 269982a_100102631434_100009814097 [0,2,0,0,0,0|2,0,0]=4 8377 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)C)Br 1458a_100000689033_100000210624 [0,2,0,0,0,0|2,0,0]=4 8378 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)C)C 1458a_100000195421_100000210624 [0,2,0,0,0,0|2,0,0]=4 8379 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)C)Cl 1458a_100011290873_100000210624 [0,2,0,0,0,0|2,0,0]=4 8380 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)C)F 1458a_100000749327_100000210624 [0,2,0,0,0,0|2,0,0]=4 8381 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)C)I 1458a_100000057929_100000210624 [0,2,0,0,0,0|2,0,0]=4 8382 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)C)O 1458a_100000229998_100000210624 [0,2,0,0,0,0|1,0,0]=3 8383 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)O)Br 1458a_100000689033_100011218427 [0,2,0,0,0,0|2,0,0]=4 8384 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)O)C 1458a_100000195421_100011218427 [0,2,0,0,0,0|2,0,0]=4 8385 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)O)Cl 1458a_100011290873_100011218427 [0,2,0,0,0,0|2,0,0]=4 8386 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)O)F 1458a_100000749327_100011218427 [0,2,0,0,0,0|2,0,0]=4 8387 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)O)I 1458a_100000057929_100011218427 [0,2,0,0,0,0|2,0,0]=4 8388 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)O)O 1458a_100000229998_100011218427 [0,2,0,0,0,0|1,0,0]=3 8389 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(F)F)O 1458a_100000229998_100011934356 [0,2,0,0,0,0|2,0,0]=4 8390 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)Br 11a_100138425928_100000689033 [0,2,0,0,0,0|2,0,0]=4 8391 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)Br 1626a_100138425928_100000689033 [0,2,0,0,0,0|2,0,0]=4 8392 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)Br 240690a_100138425928_100000689033 [0,2,0,0,0,0|2,0,0]=4 8393 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)Br 527a_100138425928_100000689033 [0,2,0,0,0,0|2,0,0]=4 8394 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)C 11a_100138425928_100000195421 [0,2,0,0,0,0|2,0,0]=4 8395 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)C 1626a_100138425928_100000195421 [0,2,0,0,0,0|2,0,0]=4 8396 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)C 240690a_100138425928_100000195421 [0,2,0,0,0,0|2,0,0]=4 8397 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)C 527a_100138425928_100000195421 [0,2,0,0,0,0|2,0,0]=4 8398 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)Cl 11a_100138425928_100011290873 [0,2,0,0,0,0|2,0,0]=4 8399 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)Cl 1626a_100138425928_100011290873 [0,2,0,0,0,0|2,0,0]=4 8400 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)Cl 240690a_100138425928_100011290873 [0,2,0,0,0,0|2,0,0]=4 8401 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)Cl 527a_100138425928_100011290873 [0,2,0,0,0,0|2,0,0]=4 8402 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)F 11a_100138425928_100000749327 [0,2,0,0,0,0|2,0,0]=4 8403 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)F 1626a_100138425928_100000749327 [0,2,0,0,0,0|2,0,0]=4 8404 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)F 240690a_100138425928_100000749327 [0,2,0,0,0,0|2,0,0]=4 8405 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)F 527a_100138425928_100000749327 [0,2,0,0,0,0|2,0,0]=4 8406 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)I 11a_100138425928_100000057929 [0,2,0,0,0,0|2,0,0]=4 8407 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)I 1626a_100138425928_100000057929 [0,2,0,0,0,0|2,0,0]=4 8408 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)I 240690a_100138425928_100000057929 [0,2,0,0,0,0|2,0,0]=4 8409 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)I 527a_100138425928_100000057929 [0,2,0,0,0,0|2,0,0]=4 8410 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)O 240690a_100138425928_100000229998 [0,2,0,0,0,0|1,0,0]=3 8411 B14R1.6052 Cc1ccc(c(c1)C(=O)NC(C)C)O 527a_100138425928_100000229998 [0,2,0,0,0,0|1,0,0]=3 8412 B14R1.6052 Cc1ccc(cc1C(=O)CC(C)C)Br 1458a_100000759961_100000210624 [0,2,0,0,0,0|2,0,0]=4 8413 B14R1.6052 Cc1ccc(cc1C(=O)CC(C)C)Cl 1458a_100000692595_100000210624 [0,2,0,0,0,0|2,0,0]=4 8414 B14R1.6052 Cc1ccc(cc1C(=O)CC(C)C)F 1458a_100000240043_100000210624 [0,2,0,0,0,0|2,0,0]=4 8415 B14R1.6052 Cc1ccc(cc1C(=O)CC(C)C)I 1458a_100000688012_100000210624 [0,2,0,0,0,0|2,0,0]=4 8416 B14R1.6052 Cc1ccc(cc1C(=O)CC(C)C)O 1458a_100000687834_100000210624 [0,2,0,0,0,0|2,0,0]=4 8417 B14R1.6052 Cc1ccc(cc1C(=O)CC(C)O)Br 1458a_100000759961_100011218427 [0,2,0,0,0,0|2,0,0]=4 8418 B14R1.6052 Cc1ccc(cc1C(=O)CC(C)O)Cl 1458a_100000692595_100011218427 [0,2,0,0,0,0|2,0,0]=4 8419 B14R1.6052 Cc1ccc(cc1C(=O)CC(C)O)F 1458a_100000240043_100011218427 [0,2,0,0,0,0|2,0,0]=4 8420 B14R1.6052 Cc1ccc(cc1C(=O)CC(C)O)I 1458a_100000688012_100011218427 [0,2,0,0,0,0|2,0,0]=4 8421 B14R1.6052 Cc1ccc(cc1C(=O)CC(C)O)O 1458a_100000687834_100011218427 [0,2,0,0,0,0|2,0,0]=4 8422 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)Br 11a_100138425928_100000759961 [0,2,0,0,0,0|2,0,0]=4 8423 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)Br 1626a_100138425928_100000759961 [0,2,0,0,0,0|2,0,0]=4 8424 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)Br 240690a_100138425928_100000759961 [0,2,0,0,0,0|2,0,0]=4 8425 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)Br 527a_100138425928_100000759961 [0,2,0,0,0,0|2,0,0]=4 8426 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)Cl 11a_100138425928_100000692595 [0,2,0,0,0,0|2,0,0]=4 8427 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)Cl 1626a_100138425928_100000692595 [0,2,0,0,0,0|2,0,0]=4 8428 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)Cl 240690a_100138425928_100000692595 [0,2,0,0,0,0|2,0,0]=4 8429 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)Cl 527a_100138425928_100000692595 [0,2,0,0,0,0|2,0,0]=4 8430 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)F 11a_100138425928_100000240043 [0,2,0,0,0,0|2,0,0]=4 8431 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)F 1626a_100138425928_100000240043 [0,2,0,0,0,0|2,0,0]=4 8432 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)F 240690a_100138425928_100000240043 [0,2,0,0,0,0|2,0,0]=4 8433 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)F 527a_100138425928_100000240043 [0,2,0,0,0,0|2,0,0]=4 8434 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)I 11a_100138425928_100000688012 [0,2,0,0,0,0|2,0,0]=4 8435 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)I 1626a_100138425928_100000688012 [0,2,0,0,0,0|2,0,0]=4 8436 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)I 240690a_100138425928_100000688012 [0,2,0,0,0,0|2,0,0]=4 8437 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)I 527a_100138425928_100000688012 [0,2,0,0,0,0|2,0,0]=4 8438 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)O 240690a_100138425928_100000687834 [0,2,0,0,0,0|2,0,0]=4 8439 B14R1.6052 O=C(CC(F)F)c1cc(ccc1O)Br 1458a_100000212140_100011934356 [0,2,0,0,0,0|2,0,0]=4 8440 B14R1.6052 O=C(CC(F)F)c1cc(ccc1O)Cl 1458a_100000212143_100011934356 [0,2,0,0,0,0|2,0,0]=4 8441 B14R1.6052 O=C(CC(F)F)c1cc(ccc1O)F 1458a_100000742286_100011934356 [0,2,0,0,0,0|2,0,0]=4 8442 B14R1.6052 O=C(CC(F)F)c1cc(ccc1O)I 1458a_100000212111_100011934356 [0,2,0,0,0,0|2,0,0]=4 8443 B14R1.6052 O=C(CC(F)F)c1cc(ccc1O)O 1458a_100000758025_100011934356 [0,2,0,0,0,0|2,0,0]=4 8444 B14R1.599 C=Cc1ccc(cc1C(=O)OCC)Br 271570a_100011290941_100000171027 [0,2,0,0,0,0|1,0,0]=3 8445 B14R1.599 C=Cc1ccc(cc1C(=O)OCC)C 271570a_100011290941_200012353901 [0,2,0,0,0,0|1,0,0]=3 8446 B14R1.599 C=Cc1ccc(cc1C(=O)OCC)Cl 271570a_100011290941_100011294803 [0,2,0,0,0,0|1,0,0]=3 8447 B14R1.599 C=Cc1ccc(cc1C(=O)OCC)F 271570a_100011290941_100011206316 [0,2,0,0,0,0|1,0,0]=3 8448 B14R1.599 C=Cc1ccc(nc1C(=O)OCC)N 271570a_100011290941_100010172133 [0,2,0,0,0,0|2,0,0]=4 8449 B14R1.599 C=Cc1ccc(nc1C(=O)OCC)O 271570a_100011290941_200010189762 [0,2,0,0,0,0|2,0,0]=4 8450 B14R1.599 C=Cc1ncc(cc1C(=O)OCC)C 271570a_100011290941_100009868943 [0,2,0,0,0,0|2,0,0]=4 8451 B14R1.599 C=Cc1ncc(cc1C(=O)OCC)F 271570a_100011290941_100012350521 [0,2,0,0,0,0|2,0,0]=4 8452 B14R1.599 C=Cc1ncc(cc1C(=O)OCC)N 271570a_100011290941_200012352213 [0,2,0,0,0,0|2,0,0]=4 8453 B14R1.599 CCCC(=O)c1cc(ccc1C#N)F 1458a_100011217471_100000210303 [0,2,0,0,0,0|2,0,0]=4 8454 B14R1.599 CCCC(=O)c1cc(ccc1CC)Br 1458a_100012343961_100000210303 [0,2,0,0,0,0|2,0,0]=4 8455 B14R1.599 CCCC(=O)c1cc(ccc1OC)Br 1458a_100000188853_100000210303 [0,2,0,0,0,0|1,0,0]=3 8456 B14R1.599 CCCC(=O)c1cc(ccc1OC)C 1458a_100000204667_100000210303 [0,2,0,0,0,0|1,0,0]=3 8457 B14R1.599 CCCC(=O)c1cc(ccc1OC)Cl 1458a_100000211409_100000210303 [0,2,0,0,0,0|1,0,0]=3 8458 B14R1.599 CCCC(=O)c1cc(ccc1OC)F 1458a_100000735445_100000210303 [0,2,0,0,0,0|1,0,0]=3 8459 B14R1.599 CCCC(=O)c1cc(ccc1OC)I 1458a_100000230898_100000210303 [0,2,0,0,0,0|1,0,0]=3 8460 B14R1.599 CCCC(=O)c1cc(ccc1OC)O 1458a_200000100057_100000210303 [0,2,0,0,0,0|1,0,0]=3 8461 B14R1.599 CCNC(=O)c1cc(ccc1C#N)F 11a_100015525214_100011217471 [0,2,0,0,0,0|2,0,0]=4 8462 B14R1.599 CCNC(=O)c1cc(ccc1CC)Br 11a_100015525214_100012343961 [0,2,0,0,0,0|2,0,0]=4 8463 B14R1.599 CCNC(=O)c1cc(ccc1CC)Br 240690a_100015525214_100012343961 [0,2,0,0,0,0|2,0,0]=4 8464 B14R1.599 CCNC(=O)c1cc(ccc1CC)Br 527a_100015525214_100012343961 [0,2,0,0,0,0|2,0,0]=4 8465 B14R1.599 CCNC(=O)c1cc(ccc1OC)Br 11a_100015525214_100000188853 [0,2,0,0,0,0|1,0,0]=3 8466 B14R1.599 CCNC(=O)c1cc(ccc1OC)Br 240690a_100015525214_100000188853 [0,2,0,0,0,0|1,0,0]=3 8467 B14R1.599 CCNC(=O)c1cc(ccc1OC)Br 527a_100015525214_100000188853 [0,2,0,0,0,0|1,0,0]=3 8468 B14R1.599 CCNC(=O)c1cc(ccc1OC)C 11a_100015525214_100000204667 [0,2,0,0,0,0|1,0,0]=3 8469 B14R1.599 CCNC(=O)c1cc(ccc1OC)C 240690a_100015525214_100000204667 [0,2,0,0,0,0|1,0,0]=3 8470 B14R1.599 CCNC(=O)c1cc(ccc1OC)C 527a_100015525214_100000204667 [0,2,0,0,0,0|1,0,0]=3 8471 B14R1.599 CCNC(=O)c1cc(ccc1OC)Cl 11a_100015525214_100000211409 [0,2,0,0,0,0|1,0,0]=3 8472 B14R1.599 CCNC(=O)c1cc(ccc1OC)Cl 240690a_100015525214_100000211409 [0,2,0,0,0,0|1,0,0]=3 8473 B14R1.599 CCNC(=O)c1cc(ccc1OC)Cl 527a_100015525214_100000211409 [0,2,0,0,0,0|1,0,0]=3 8474 B14R1.599 CCNC(=O)c1cc(ccc1OC)F 11a_100015525214_100000735445 [0,2,0,0,0,0|1,0,0]=3 8475 B14R1.599 CCNC(=O)c1cc(ccc1OC)F 240690a_100015525214_100000735445 [0,2,0,0,0,0|1,0,0]=3 8476 B14R1.599 CCNC(=O)c1cc(ccc1OC)F 527a_100015525214_100000735445 [0,2,0,0,0,0|1,0,0]=3 8477 B14R1.599 CCNC(=O)c1cc(ccc1OC)I 11a_100015525214_100000230898 [0,2,0,0,0,0|1,0,0]=3 8478 B14R1.599 CCNC(=O)c1cc(ccc1OC)I 240690a_100015525214_100000230898 [0,2,0,0,0,0|1,0,0]=3 8479 B14R1.599 CCNC(=O)c1cc(ccc1OC)I 527a_100015525214_100000230898 [0,2,0,0,0,0|1,0,0]=3 8480 B14R1.599 CCNC(=O)c1cc(ccc1OC)O 240690a_100015525214_200000100057 [0,2,0,0,0,0|1,0,0]=3 8481 B14R1.599 CCNC(=O)c1cc(ccc1OC)O 527a_100015525214_200000100057 [0,2,0,0,0,0|1,0,0]=3 8482 B14R1.599 CCOC(=O)c1cc(ccc1OC)Br 7a_200000174078_200000210301 [0,2,0,0,0,0|0,0,0]=2 8483 B14R1.599 CCOC(=O)c1cc(ccc1OC)C 7a_200011212139_200000210301 [0,2,0,0,0,0|0,0,0]=2 8484 B14R1.599 CCOC(=O)c1cc(ccc1OC)I 7a_200000173011_200000210301 [0,2,0,0,0,0|0,0,0]=2 8485 B14R1.599 CCOC(=O)c1cc(ccc1O[13CH3])Br 7a_200000174078_200025704644 [0,2,0,0,0,0|0,0,0]=2 8486 B14R1.599 CCOC(=O)c1cc(ccc1O[13CH3])C 7a_200011212139_200025704644 [0,2,0,0,0,0|0,0,0]=2 8487 B14R1.599 CCOC(=O)c1cc(ccc1O[13CH3])I 7a_200000173011_200025704644 [0,2,0,0,0,0|0,0,0]=2 8488 B14R1.599 CCOC(=O)c1cc(ccc1SC)Br 62a_100000171027_200000210301 [0,2,0,0,0,0|0,1,0]=3 8489 B14R1.599 CCOC(=O)c1cc(ccc1SC)C 62a_200000210301_200012353901 [0,2,0,0,0,0|0,1,0]=3 8490 B14R1.599 CCOC(=O)c1cc(ccc1SC)C 62a_200012353901_200000210301 [0,2,0,0,0,0|0,1,0]=3 8491 B14R1.599 CCOC(=O)c1cc(ccc1SC)Cl 62a_100011294803_200000210301 [0,2,0,0,0,0|0,1,0]=3 8492 B14R1.599 CCOC(=O)c1cc(ccc1SC)Cl 62a_200000210301_100011294803 [0,2,0,0,0,0|0,1,0]=3 8493 B14R1.599 CCOC(=O)c1cc(ccc1SC)F 62a_100011206316_200000210301 [0,2,0,0,0,0|0,1,0]=3 8494 B14R1.599 CCOC(=O)c1cc(ccc1SC)F 62a_200000210301_100011206316 [0,2,0,0,0,0|0,1,0]=3 8495 B14R1.599 CCOC(=O)c1cc(ccc1S[13CH3])Br 62a_100000171027_200025704644 [0,2,0,0,0,0|0,1,0]=3 8496 B14R1.599 CCOC(=O)c1cc(ccc1S[13CH3])C 62a_200012353901_200025704644 [0,2,0,0,0,0|0,1,0]=3 8497 B14R1.599 CCOC(=O)c1cc(ccc1S[13CH3])C 62a_200025704644_200012353901 [0,2,0,0,0,0|0,1,0]=3 8498 B14R1.599 CCOC(=O)c1cc(ccc1S[13CH3])Cl 62a_100011294803_200025704644 [0,2,0,0,0,0|0,1,0]=3 8499 B14R1.599 CCOC(=O)c1cc(ccc1S[13CH3])Cl 62a_200025704644_100011294803 [0,2,0,0,0,0|0,1,0]=3 8500 B14R1.599 CCOC(=O)c1cc(ccc1S[13CH3])F 62a_100011206316_200025704644 [0,2,0,0,0,0|0,1,0]=3 8501 B14R1.599 CCOC(=O)c1cc(ccc1S[13CH3])F 62a_200025704644_100011206316 [0,2,0,0,0,0|0,1,0]=3 8502 B14R1.599 CCOC(=O)c1cc(cnc1NC)C 27a_100102657272_100009868943 [0,2,0,0,0,0|2,0,0]=4 8503 B14R1.599 CCOC(=O)c1cc(cnc1OC)O 271570a_203496583355_200010189771 [0,2,0,0,0,0|1,0,0]=3 8504 B14R1.599 CCOC(=O)c1cc(cnc1SC)C 62a_200000210301_100009868943 [0,2,0,0,0,0|1,1,0]=4 8505 B14R1.599 CCOC(=O)c1cc(cnc1SC)F 62a_200000210301_100012350521 [0,2,0,0,0,0|1,1,0]=4 8506 B14R1.599 CCOC(=O)c1cc(cnc1SC)N 62a_200000210301_200012352213 [0,2,0,0,0,0|1,1,0]=4 8507 B14R1.599 CCOC(=O)c1cc(cnc1S[13CH3])C 62a_200025704644_100009868943 [0,2,0,0,0,0|1,1,0]=4 8508 B14R1.599 CCOC(=O)c1cc(cnc1S[13CH3])F 62a_200025704644_100012350521 [0,2,0,0,0,0|1,1,0]=4 8509 B14R1.599 CCOC(=O)c1cc(cnc1S[13CH3])N 62a_200025704644_200012352213 [0,2,0,0,0,0|1,1,0]=4 8510 B14R1.599 CCOC(=O)c1nc(ccc1SC)N 62a_100010172133_200000210301 [0,2,0,0,0,0|1,1,0]=4 8511 B14R1.599 CCOC(=O)c1nc(ccc1S[13CH3])N 62a_100010172133_200025704644 [0,2,0,0,0,0|1,1,0]=4 8512 B14R1.599 CCOC(C)c1cc(ccc1OC)Cl 34a_100011598618_100000210202 [0,2,0,0,0,0|1,0,1]=4 8513 B14R1.599 CCOC(C)c1cc(ccc1OC)Cl 7a_100011598618_100000210202 [0,2,0,0,0,0|1,0,1]=4 8514 B14R1.599 CCOC(C)c1cc(ccc1OC)F 34a_100011305292_100000210202 [0,2,0,0,0,0|1,0,1]=4 8515 B14R1.599 CCOC(C)c1cc(ccc1OC)F 7a_100011305292_100000210202 [0,2,0,0,0,0|1,0,1]=4 8516 B14R1.599 CNCC(=O)c1cc(ccc1OC)Br 34a_100102657272_200000749383 [0,2,0,0,0,0|2,0,0]=4 8517 B14R1.599 CNCC(=O)c1cc(ccc1OC)Br 7a_106832991635_200000749383 [0,2,0,0,0,0|2,0,0]=4 8518 B14R1.599 CNCC(=O)c1cc(ccc1OC)Cl 7a_106832991635_100012340060 [0,2,0,0,0,0|2,0,0]=4 8519 B14R1.599 CNCC(=O)c1cc(ccc1OC)F 34a_100102657272_100000737820 [0,2,0,0,0,0|2,0,0]=4 8520 B14R1.599 CNCC(=O)c1cc(ccc1OC)F 7a_106832991635_100000737820 [0,2,0,0,0,0|2,0,0]=4 8521 B14R1.599 CNNC(=O)c1cc(ccc1OC)Br 22a_100016993582_100000188853 [0,2,0,0,0,0|2,0,0]=4 8522 B14R1.599 CNNC(=O)c1cc(ccc1OC)C 22a_100016993582_100000204667 [0,2,0,0,0,0|2,0,0]=4 8523 B14R1.599 CNNC(=O)c1cc(ccc1OC)Cl 22a_100016993582_100000211409 [0,2,0,0,0,0|2,0,0]=4 8524 B14R1.599 CNNC(=O)c1cc(ccc1OC)F 22a_100016993582_100000735445 [0,2,0,0,0,0|2,0,0]=4 8525 B14R1.599 CNNC(=O)c1cc(ccc1OC)I 22a_100016993582_100000230898 [0,2,0,0,0,0|2,0,0]=4 8526 B14R1.599 CNNC(=O)c1cc(ccc1OC)O 22a_100016993582_200000100057 [0,2,0,0,0,0|2,0,0]=4 8527 B14R1.599 COCC(=O)c1cc(ccc1OC)Br 34a_100138415774_200000749383 [0,2,0,0,0,0|2,0,0]=4 8528 B14R1.599 COCC(=O)c1cc(ccc1OC)F 34a_100138415774_100000737820 [0,2,0,0,0,0|2,0,0]=4 8529 B14R1.599 COc1ccc(cc1C(=O)CCF)Br 1458a_100000188853_100011217306 [0,2,0,0,0,0|2,0,0]=4 8530 B14R1.599 COc1ccc(cc1C(=O)CCF)C 1458a_100000204667_100011217306 [0,2,0,0,0,0|2,0,0]=4 8531 B14R1.599 COc1ccc(cc1C(=O)CCF)Cl 1458a_100000211409_100011217306 [0,2,0,0,0,0|2,0,0]=4 8532 B14R1.599 COc1ccc(cc1C(=O)CCF)F 1458a_100000735445_100011217306 [0,2,0,0,0,0|2,0,0]=4 8533 B14R1.599 COc1ccc(cc1C(=O)CCF)I 1458a_100000230898_100011217306 [0,2,0,0,0,0|2,0,0]=4 8534 B14R1.599 COc1ccc(cc1C(=O)CCF)O 1458a_200000100057_100011217306 [0,2,0,0,0,0|2,0,0]=4 8535 B14R1.599 COc1ccc(cc1C(=O)CCO)Br 1458a_100000188853_100000211926 [0,2,0,0,0,0|2,0,0]=4 8536 B14R1.599 COc1ccc(cc1C(=O)CCO)C 1458a_100000204667_100000211926 [0,2,0,0,0,0|2,0,0]=4 8537 B14R1.599 COc1ccc(cc1C(=O)CCO)Cl 1458a_100000211409_100000211926 [0,2,0,0,0,0|2,0,0]=4 8538 B14R1.599 COc1ccc(cc1C(=O)CCO)F 1458a_100000735445_100000211926 [0,2,0,0,0,0|2,0,0]=4 8539 B14R1.599 COc1ccc(cc1C(=O)CCO)I 1458a_100000230898_100000211926 [0,2,0,0,0,0|2,0,0]=4 8540 B14R1.599 COc1ccc(cc1C(=O)CCO)O 1458a_200000100057_100000211926 [0,2,0,0,0,0|2,0,0]=4 8541 B14R1.599 COc1ccc(cc1C(=O)CSC)Br 62a_200000749383_200000210301 [0,2,0,0,0,0|2,0,0]=4 8542 B14R1.599 COc1ccc(cc1C(=O)CSC)Cl 62a_100012340060_200000210301 [0,2,0,0,0,0|2,0,0]=4 8543 B14R1.599 COc1ccc(cc1C(=O)CSC)F 62a_100000737820_200000210301 [0,2,0,0,0,0|2,0,0]=4 8544 B14R1.599 COc1ccc(cc1C(=O)CS[13CH3])Br 62a_200000749383_200025704644 [0,2,0,0,0,0|2,0,0]=4 8545 B14R1.599 COc1ccc(cc1C(=O)CS[13CH3])Cl 62a_100012340060_200025704644 [0,2,0,0,0,0|2,0,0]=4 8546 B14R1.599 COc1ccc(cc1C(=O)CS[13CH3])F 62a_100000737820_200025704644 [0,2,0,0,0,0|2,0,0]=4 8547 B14R1.601 C=Cc1cc(c(cn1)C)C(=O)OCC 271570a_100011290941_100000083727 [0,2,0,0,0,0|2,0,0]=4 8548 B14R1.601 C=Cc1cc(c(cn1)F)C(=O)OCC 271570a_100011290941_100010189748 [0,2,0,0,0,0|2,0,0]=4 8549 B14R1.601 C=Cc1cc(c(cn1)N)C(=O)OCC 271570a_100011290941_100010759034 [0,2,0,0,0,0|2,0,0]=4 8550 B14R1.601 C=Cc1ccc(c(c1)C(=O)NCC)F 271570a_100011290941_100000155167 [0,2,0,0,0,0|2,0,0]=4 8551 B14R1.601 C=Cc1ccc(c(c1)C(=O)OCC)Br 271570a_100011290941_200012360513 [0,2,0,0,0,0|1,0,0]=3 8552 B14R1.601 C=Cc1ccc(c(c1)C(=O)OCC)C 271570a_100011290941_100012360117 [0,2,0,0,0,0|1,0,0]=3 8553 B14R1.601 C=Cc1ccc(c(c1)C(=O)OCC)Cl 271570a_100011290941_200012339456 [0,2,0,0,0,0|1,0,0]=3 8554 B14R1.601 C=Cc1ccc(c(c1)C(=O)OCC)F 271570a_100011290941_100000716760 [0,2,0,0,0,0|1,0,0]=3 8555 B14R1.601 C=Cc1ccc(c(c1)C(=O)OCC)N 271570a_100011290941_100000747833 [0,2,0,0,0,0|1,0,0]=3 8556 B14R1.601 C=Cc1ccc(c(c1)C(=O)OCC)O 271570a_100011290941_200000174078 [0,2,0,0,0,0|0,0,0]=2 8557 B14R1.601 C=Cc1ccc(c(n1)C(=O)OCC)C 271570a_100011290941_100009888570 [0,2,0,0,0,0|2,0,0]=4 8558 B14R1.601 C=Cc1ccc(c(n1)C(=O)OCC)F 271570a_100011290941_100010189790 [0,2,0,0,0,0|2,0,0]=4 8559 B14R1.601 C=Cc1ccc(c(n1)C(=O)OCC)N 271570a_100011290941_100010243813 [0,2,0,0,0,0|2,0,0]=4 8560 B14R1.601 C=Cc1cnc(c(c1)C(=O)OCC)C 271570a_100011290941_100012232392 [0,2,0,0,0,0|2,0,0]=4 8561 B14R1.601 C=Cc1cnc(c(c1)C(=O)OCC)F 271570a_100011290941_200010189675 [0,2,0,0,0,0|2,0,0]=4 8562 B14R1.601 C=Cc1cnc(c(c1)C(=O)OCC)N 271570a_100011290941_100009816981 [0,2,0,0,0,0|2,0,0]=4 8563 B14R1.601 C=Cc1cnc(c(c1)C(=O)OCC)O 271570a_100011290941_100010189763 [0,2,0,0,0,0|1,0,0]=3 8564 B14R1.601 CCCC(=O)c1cc(ccc1Br)C#N 1458a_100012361338_100000210303 [0,2,0,0,0,0|2,0,0]=4 8565 B14R1.601 CCCC(=O)c1cc(ccc1Br)CO 1458a_100010259715_100000210303 [0,2,0,0,0,0|2,0,0]=4 8566 B14R1.601 CCCC(=O)c1cc(ccc1Br)OC 1458a_100000211723_100000210303 [0,2,0,0,0,0|2,0,0]=4 8567 B14R1.601 CCCC(=O)c1cc(ccc1C)C#N 1458a_200012187059_100000210303 [0,2,0,0,0,0|2,0,0]=4 8568 B14R1.601 CCCC(=O)c1cc(ccc1C)OC 1458a_100011399813_100000210303 [0,2,0,0,0,0|2,0,0]=4 8569 B14R1.601 CCCC(=O)c1cc(ccc1Cl)C#N 1458a_100000729836_100000210303 [0,2,0,0,0,0|2,0,0]=4 8570 B14R1.601 CCCC(=O)c1cc(ccc1Cl)OC 1458a_100000763818_100000210303 [0,2,0,0,0,0|2,0,0]=4 8571 B14R1.601 CCCC(=O)c1cc(ccc1Cl)SC 1458a_100000212015_100000210303 [0,2,0,0,0,0|2,0,0]=4 8572 B14R1.601 CCCC(=O)c1cc(ccc1F)C#N 1458a_100011218479_100000210303 [0,2,0,0,0,0|2,0,0]=4 8573 B14R1.601 CCCC(=O)c1cc(ccc1F)OC 1458a_100011217016_100000210303 [0,2,0,0,0,0|2,0,0]=4 8574 B14R1.601 CCCC(=O)c1cc(ccc1F)SC 1458a_200012183283_100000210303 [0,2,0,0,0,0|2,0,0]=4 8575 B14R1.601 CCCC(=O)c1cc(ccc1I)C#N 1458a_200010191847_100000210303 [0,2,0,0,0,0|2,0,0]=4 8576 B14R1.601 CCCC(=O)c1cc(ccc1I)OC 1458a_100012339533_100000210303 [0,2,0,0,0,0|2,0,0]=4 8577 B14R1.601 CCCC(=O)c1cc(ccc1O)C#N 1458a_100000719980_100000210303 [0,2,0,0,0,0|1,0,0]=3 8578 B14R1.601 CCCC(=O)c1cc(ccc1O)CC 1458a_200000748397_100000210303 [0,2,0,0,0,0|1,0,0]=3 8579 B14R1.601 CCCC(=O)c1cc(ccc1O)CO 1458a_200000045694_100000210303 [0,2,0,0,0,0|1,0,0]=3 8580 B14R1.601 CCCC(=O)c1cc(ccc1O)OC 1458a_100000211986_100000210303 [0,2,0,0,0,0|1,0,0]=3 8581 B14R1.601 CCNC(=O)c1cc(ccc1Br)C#N 11a_100015525214_100012361338 [0,2,0,0,0,0|2,0,0]=4 8582 B14R1.601 CCNC(=O)c1cc(ccc1Br)C#N 240690a_100015525214_100012361338 [0,2,0,0,0,0|2,0,0]=4 8583 B14R1.601 CCNC(=O)c1cc(ccc1Br)C#N 527a_100015525214_100012361338 [0,2,0,0,0,0|2,0,0]=4 8584 B14R1.601 CCNC(=O)c1cc(ccc1Br)CO 240690a_100015525214_100010259715 [0,2,0,0,0,0|2,0,0]=4 8585 B14R1.601 CCNC(=O)c1cc(ccc1Br)OC 11a_100015525214_100000211723 [0,2,0,0,0,0|2,0,0]=4 8586 B14R1.601 CCNC(=O)c1cc(ccc1Br)OC 240690a_100015525214_100000211723 [0,2,0,0,0,0|2,0,0]=4 8587 B14R1.601 CCNC(=O)c1cc(ccc1Br)OC 527a_100015525214_100000211723 [0,2,0,0,0,0|2,0,0]=4 8588 B14R1.601 CCNC(=O)c1cc(ccc1C)C#N 11a_100015525214_200012187059 [0,2,0,0,0,0|2,0,0]=4 8589 B14R1.601 CCNC(=O)c1cc(ccc1C)C#N 240690a_100015525214_200012187059 [0,2,0,0,0,0|2,0,0]=4 8590 B14R1.601 CCNC(=O)c1cc(ccc1C)C#N 527a_100015525214_200012187059 [0,2,0,0,0,0|2,0,0]=4 8591 B14R1.601 CCNC(=O)c1cc(ccc1C)OC 11a_100015525214_100011399813 [0,2,0,0,0,0|2,0,0]=4 8592 B14R1.601 CCNC(=O)c1cc(ccc1C)OC 240690a_100015525214_100011399813 [0,2,0,0,0,0|2,0,0]=4 8593 B14R1.601 CCNC(=O)c1cc(ccc1C)OC 527a_100015525214_100011399813 [0,2,0,0,0,0|2,0,0]=4 8594 B14R1.601 CCNC(=O)c1cc(ccc1Cl)C#N 11a_100015525214_100000729836 [0,2,0,0,0,0|2,0,0]=4 8595 B14R1.601 CCNC(=O)c1cc(ccc1Cl)C#N 240690a_100015525214_100000729836 [0,2,0,0,0,0|2,0,0]=4 8596 B14R1.601 CCNC(=O)c1cc(ccc1Cl)C#N 527a_100015525214_100000729836 [0,2,0,0,0,0|2,0,0]=4 8597 B14R1.601 CCNC(=O)c1cc(ccc1Cl)NC 2230a_200015187120_200000210301 [0,2,0,0,0,0|2,0,0]=4 8598 B14R1.601 CCNC(=O)c1cc(ccc1Cl)NC 34a_200015187120_200000210301 [0,2,0,0,0,0|2,0,0]=4 8599 B14R1.601 CCNC(=O)c1cc(ccc1Cl)NC 7a_200015187120_200000210301 [0,2,0,0,0,0|2,0,0]=4 8600 B14R1.601 CCNC(=O)c1cc(ccc1Cl)N[13CH3] 2230a_200015187120_200025704644 [0,2,0,0,0,0|2,0,0]=4 8601 B14R1.601 CCNC(=O)c1cc(ccc1Cl)N[13CH3] 34a_200015187120_200025704644 [0,2,0,0,0,0|2,0,0]=4 8602 B14R1.601 CCNC(=O)c1cc(ccc1Cl)N[13CH3] 7a_200015187120_200025704644 [0,2,0,0,0,0|2,0,0]=4 8603 B14R1.601 CCNC(=O)c1cc(ccc1Cl)OC 11a_100015525214_100000763818 [0,2,0,0,0,0|2,0,0]=4 8604 B14R1.601 CCNC(=O)c1cc(ccc1Cl)OC 240690a_100015525214_100000763818 [0,2,0,0,0,0|2,0,0]=4 8605 B14R1.601 CCNC(=O)c1cc(ccc1Cl)OC 527a_100015525214_100000763818 [0,2,0,0,0,0|2,0,0]=4 8606 B14R1.601 CCNC(=O)c1cc(ccc1Cl)SC 11a_100015525214_100000212015 [0,2,0,0,0,0|2,0,0]=4 8607 B14R1.601 CCNC(=O)c1cc(ccc1Cl)SC 240690a_100015525214_100000212015 [0,2,0,0,0,0|2,0,0]=4 8608 B14R1.601 CCNC(=O)c1cc(ccc1Cl)SC 527a_100015525214_100000212015 [0,2,0,0,0,0|2,0,0]=4 8609 B14R1.601 CCNC(=O)c1cc(ccc1F)C#N 11a_100015525214_100011218479 [0,2,0,0,0,0|2,0,0]=4 8610 B14R1.601 CCNC(=O)c1cc(ccc1F)C#N 240690a_100015525214_100011218479 [0,2,0,0,0,0|2,0,0]=4 8611 B14R1.601 CCNC(=O)c1cc(ccc1F)NC 27a_100102657272_100000155167 [0,2,0,0,0,0|2,0,0]=4 8612 B14R1.601 CCNC(=O)c1cc(ccc1F)OC 11a_100015525214_100011217016 [0,2,0,0,0,0|2,0,0]=4 8613 B14R1.601 CCNC(=O)c1cc(ccc1F)OC 240690a_100015525214_100011217016 [0,2,0,0,0,0|2,0,0]=4 8614 B14R1.601 CCNC(=O)c1cc(ccc1F)OC 527a_100015525214_100011217016 [0,2,0,0,0,0|2,0,0]=4 8615 B14R1.601 CCNC(=O)c1cc(ccc1F)SC 11a_100015525214_200012183283 [0,2,0,0,0,0|2,0,0]=4 8616 B14R1.601 CCNC(=O)c1cc(ccc1F)SC 240690a_100015525214_200012183283 [0,2,0,0,0,0|2,0,0]=4 8617 B14R1.601 CCNC(=O)c1cc(ccc1F)SC 527a_100015525214_200012183283 [0,2,0,0,0,0|2,0,0]=4 8618 B14R1.601 CCNC(=O)c1cc(ccc1F)SC 62a_100000155167_200000210301 [0,2,0,0,0,0|2,0,0]=4 8619 B14R1.601 CCNC(=O)c1cc(ccc1F)SC 62a_200000210301_100000155167 [0,2,0,0,0,0|2,0,0]=4 8620 B14R1.601 CCNC(=O)c1cc(ccc1F)S[13CH3] 62a_100000155167_200025704644 [0,2,0,0,0,0|2,0,0]=4 8621 B14R1.601 CCNC(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100000155167 [0,2,0,0,0,0|2,0,0]=4 8622 B14R1.601 CCNC(=O)c1cc(ccc1I)C#N 11a_100015525214_200010191847 [0,2,0,0,0,0|2,0,0]=4 8623 B14R1.601 CCNC(=O)c1cc(ccc1I)C#N 240690a_100015525214_200010191847 [0,2,0,0,0,0|2,0,0]=4 8624 B14R1.601 CCNC(=O)c1cc(ccc1I)OC 11a_100015525214_100012339533 [0,2,0,0,0,0|2,0,0]=4 8625 B14R1.601 CCNC(=O)c1cc(ccc1I)OC 240690a_100015525214_100012339533 [0,2,0,0,0,0|2,0,0]=4 8626 B14R1.601 CCNC(=O)c1cc(ccc1I)OC 527a_100015525214_100012339533 [0,2,0,0,0,0|2,0,0]=4 8627 B14R1.601 CCNC(=O)c1cc(ccc1O)C#N 240690a_100015525214_100000719980 [0,2,0,0,0,0|1,0,0]=3 8628 B14R1.601 CCNC(=O)c1cc(ccc1O)CC 240690a_100015525214_200000748397 [0,2,0,0,0,0|1,0,0]=3 8629 B14R1.601 CCNC(=O)c1cc(ccc1O)CC 527a_100015525214_200000748397 [0,2,0,0,0,0|1,0,0]=3 8630 B14R1.601 CCNC(=O)c1cc(ccc1O)CO 240690a_100015525214_200000045694 [0,2,0,0,0,0|1,0,0]=3 8631 B14R1.601 CCNC(=O)c1cc(ccc1O)OC 240690a_100015525214_100000211986 [0,2,0,0,0,0|1,0,0]=3 8632 B14R1.601 CCNC(=O)c1cc(ccc1O)OC 527a_100015525214_100000211986 [0,2,0,0,0,0|1,0,0]=3 8633 B14R1.601 CCOC(=O)c1cc(ccc1Br)SC 62a_200000210301_200012360513 [0,2,0,0,0,0|1,0,0]=3 8634 B14R1.601 CCOC(=O)c1cc(ccc1Br)SC 62a_200012360513_200000210301 [0,2,0,0,0,0|1,0,0]=3 8635 B14R1.601 CCOC(=O)c1cc(ccc1Br)S[13CH3] 62a_200012360513_200025704644 [0,2,0,0,0,0|1,0,0]=3 8636 B14R1.601 CCOC(=O)c1cc(ccc1Br)S[13CH3] 62a_200025704644_200012360513 [0,2,0,0,0,0|1,0,0]=3 8637 B14R1.601 CCOC(=O)c1cc(ccc1C)SC 62a_100012360117_200000210301 [0,2,0,0,0,0|1,0,0]=3 8638 B14R1.601 CCOC(=O)c1cc(ccc1C)SC 62a_200000210301_100012360117 [0,2,0,0,0,0|1,0,0]=3 8639 B14R1.601 CCOC(=O)c1cc(ccc1C)S[13CH3] 62a_100012360117_200025704644 [0,2,0,0,0,0|1,0,0]=3 8640 B14R1.601 CCOC(=O)c1cc(ccc1C)S[13CH3] 62a_200025704644_100012360117 [0,2,0,0,0,0|1,0,0]=3 8641 B14R1.601 CCOC(=O)c1cc(ccc1Cl)SC 62a_200000210301_200012339456 [0,2,0,0,0,0|1,0,0]=3 8642 B14R1.601 CCOC(=O)c1cc(ccc1Cl)SC 62a_200012339456_200000210301 [0,2,0,0,0,0|1,0,0]=3 8643 B14R1.601 CCOC(=O)c1cc(ccc1Cl)S[13CH3] 62a_200012339456_200025704644 [0,2,0,0,0,0|1,0,0]=3 8644 B14R1.601 CCOC(=O)c1cc(ccc1Cl)S[13CH3] 62a_200025704644_200012339456 [0,2,0,0,0,0|1,0,0]=3 8645 B14R1.601 CCOC(=O)c1cc(ccc1F)OC 34a_200009857887_200000210301 [0,2,0,0,0,0|1,0,0]=3 8646 B14R1.601 CCOC(=O)c1cc(ccc1F)OC 7a_200009857887_200000210301 [0,2,0,0,0,0|1,0,0]=3 8647 B14R1.601 CCOC(=O)c1cc(ccc1F)O[13CH3] 34a_200009857887_200025704644 [0,2,0,0,0,0|1,0,0]=3 8648 B14R1.601 CCOC(=O)c1cc(ccc1F)O[13CH3] 7a_200009857887_200025704644 [0,2,0,0,0,0|1,0,0]=3 8649 B14R1.601 CCOC(=O)c1cc(ccc1F)SC 62a_100000716760_200000210301 [0,2,0,0,0,0|1,0,0]=3 8650 B14R1.601 CCOC(=O)c1cc(ccc1F)SC 62a_200000210301_100011206329 [0,2,0,0,0,0|1,0,0]=3 8651 B14R1.601 CCOC(=O)c1cc(ccc1F)S[13CH3] 62a_100000716760_200025704644 [0,2,0,0,0,0|1,0,0]=3 8652 B14R1.601 CCOC(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100011206329 [0,2,0,0,0,0|1,0,0]=3 8653 B14R1.601 CCOC(=O)c1cc(ccc1N)SC 62a_100000747833_200000210301 [0,2,0,0,0,0|1,0,0]=3 8654 B14R1.601 CCOC(=O)c1cc(ccc1N)S[13CH3] 62a_100000747833_200025704644 [0,2,0,0,0,0|1,0,0]=3 8655 B14R1.601 CCOC(=O)c1cc(ccc1O)OC 271570a_203496583355_200000171771 [0,2,0,0,0,0|0,0,0]=2 8656 B14R1.601 CCOC(=O)c1cc(ccc1O)SC 62a_200000210301_200000173011 [0,2,0,0,0,0|0,0,0]=2 8657 B14R1.601 CCOC(=O)c1cc(ccc1O)S[13CH3] 62a_200025704644_200000173011 [0,2,0,0,0,0|0,0,0]=2 8658 B14R1.601 CCOC(=O)c1cc(cnc1C)SC 62a_100012232392_200000210301 [0,2,0,0,0,0|2,0,0]=4 8659 B14R1.601 CCOC(=O)c1cc(cnc1C)SC 62a_200000210301_100012232392 [0,2,0,0,0,0|2,0,0]=4 8660 B14R1.601 CCOC(=O)c1cc(cnc1C)S[13CH3] 62a_100012232392_200025704644 [0,2,0,0,0,0|2,0,0]=4 8661 B14R1.601 CCOC(=O)c1cc(cnc1C)S[13CH3] 62a_200025704644_100012232392 [0,2,0,0,0,0|2,0,0]=4 8662 B14R1.601 CCOC(=O)c1cc(cnc1F)SC 62a_200000210301_200010189675 [0,2,0,0,0,0|2,0,0]=4 8663 B14R1.601 CCOC(=O)c1cc(cnc1F)S[13CH3] 62a_200025704644_200010189675 [0,2,0,0,0,0|2,0,0]=4 8664 B14R1.601 CCOC(=O)c1cc(cnc1N)SC 62a_100009816981_200000210301 [0,2,0,0,0,0|2,0,0]=4 8665 B14R1.601 CCOC(=O)c1cc(cnc1N)SC 62a_200000210301_100009816981 [0,2,0,0,0,0|2,0,0]=4 8666 B14R1.601 CCOC(=O)c1cc(cnc1N)S[13CH3] 62a_100009816981_200025704644 [0,2,0,0,0,0|2,0,0]=4 8667 B14R1.601 CCOC(=O)c1cc(cnc1N)S[13CH3] 62a_200025704644_100009816981 [0,2,0,0,0,0|2,0,0]=4 8668 B14R1.601 CCOC(=O)c1cc(cnc1O)CC 271570a_203496583355_200010006761 [0,2,0,0,0,0|1,0,0]=3 8669 B14R1.601 CCOC(=O)c1cc(cnc1O)SC 62a_200000210301_100010189763 [0,2,0,0,0,0|1,0,0]=3 8670 B14R1.601 CCOC(=O)c1cc(cnc1O)S[13CH3] 62a_200025704644_100010189763 [0,2,0,0,0,0|1,0,0]=3 8671 B14R1.601 CCOC(=O)c1cc(ncc1C)SC 62a_200000210301_100000083727 [0,2,0,0,0,0|2,0,0]=4 8672 B14R1.601 CCOC(=O)c1cc(ncc1C)S[13CH3] 62a_200025704644_100000083727 [0,2,0,0,0,0|2,0,0]=4 8673 B14R1.601 CCOC(=O)c1cc(ncc1F)SC 62a_100010189748_200000210301 [0,2,0,0,0,0|2,0,0]=4 8674 B14R1.601 CCOC(=O)c1cc(ncc1F)SC 62a_200000210301_100010189748 [0,2,0,0,0,0|2,0,0]=4 8675 B14R1.601 CCOC(=O)c1cc(ncc1F)S[13CH3] 62a_100010189748_200025704644 [0,2,0,0,0,0|2,0,0]=4 8676 B14R1.601 CCOC(=O)c1cc(ncc1F)S[13CH3] 62a_200025704644_100010189748 [0,2,0,0,0,0|2,0,0]=4 8677 B14R1.601 CCOC(=O)c1cc(ncc1N)SC 62a_100010759034_200000210301 [0,2,0,0,0,0|2,0,0]=4 8678 B14R1.601 CCOC(=O)c1cc(ncc1N)SC 62a_200000210301_100010759034 [0,2,0,0,0,0|2,0,0]=4 8679 B14R1.601 CCOC(=O)c1cc(ncc1N)S[13CH3] 62a_100010759034_200025704644 [0,2,0,0,0,0|2,0,0]=4 8680 B14R1.601 CCOC(=O)c1cc(ncc1N)S[13CH3] 62a_200025704644_100010759034 [0,2,0,0,0,0|2,0,0]=4 8681 B14R1.601 CCOC(=O)c1nc(ccc1C)SC 62a_200000210301_100009888570 [0,2,0,0,0,0|2,0,0]=4 8682 B14R1.601 CCOC(=O)c1nc(ccc1C)S[13CH3] 62a_200025704644_100009888570 [0,2,0,0,0,0|2,0,0]=4 8683 B14R1.601 CCOC(=O)c1nc(ccc1F)NC 27a_100102657272_100010189790 [0,2,0,0,0,0|2,0,0]=4 8684 B14R1.601 CCOC(=O)c1nc(ccc1F)SC 62a_100010189790_200000210301 [0,2,0,0,0,0|2,0,0]=4 8685 B14R1.601 CCOC(=O)c1nc(ccc1F)SC 62a_200000210301_100010189790 [0,2,0,0,0,0|2,0,0]=4 8686 B14R1.601 CCOC(=O)c1nc(ccc1F)S[13CH3] 62a_100010189790_200025704644 [0,2,0,0,0,0|2,0,0]=4 8687 B14R1.601 CCOC(=O)c1nc(ccc1F)S[13CH3] 62a_200025704644_100010189790 [0,2,0,0,0,0|2,0,0]=4 8688 B14R1.601 CCOC(=O)c1nc(ccc1N)SC 62a_100010243813_200000210301 [0,2,0,0,0,0|2,0,0]=4 8689 B14R1.601 CCOC(=O)c1nc(ccc1N)S[13CH3] 62a_100010243813_200025704644 [0,2,0,0,0,0|2,0,0]=4 8690 B14R1.601 CCOC(=O)c1nc(ccc1O)C#N 271570a_203496583355_100015929475 [0,2,0,0,0,0|1,0,0]=3 8691 B14R1.601 CCOC(=O)c1nc(ccc1O)OC 271570a_203496583355_100010189770 [0,2,0,0,0,0|1,0,0]=3 8692 B14R1.601 CCOC(=O)c1nc(ncc1O)SC 271570a_203496583355_100000735467 [0,2,0,0,0,0|2,0,0]=4 8693 B14R1.601 CCc1ccc(c(c1)C(=O)CCF)O 1458a_200000748397_100011217306 [0,2,0,0,0,0|2,0,0]=4 8694 B14R1.601 CCc1ccc(c(c1)C(=O)CCO)O 1458a_200000748397_100000211926 [0,2,0,0,0,0|2,0,0]=4 8695 B14R1.601 CCc1ccc(c(c1)C(=O)NNC)O 22a_100016993582_200000748397 [0,2,0,0,0,0|2,0,0]=4 8696 B14R1.601 CNCC(=O)c1cc(ccc1O)OC 7a_106832991635_100010402061 [0,2,0,0,0,0|2,0,0]=4 8697 B14R1.601 CNNC(=O)c1cc(ccc1O)OC 22a_100016993582_100000211986 [0,2,0,0,0,0|2,0,0]=4 8698 B14R1.601 COc1ccc(c(c1)C(=O)CCF)O 1458a_100000211986_100011217306 [0,2,0,0,0,0|2,0,0]=4 8699 B14R1.601 COc1ccc(c(c1)C(=O)CCO)O 1458a_100000211986_100000211926 [0,2,0,0,0,0|2,0,0]=4 8700 B14R1.601 N#Cc1ccc(c(c1)C(=O)CCF)O 1458a_100000719980_100011217306 [0,2,0,0,0,0|2,0,0]=4 8701 B14R1.601 N#Cc1ccc(c(c1)C(=O)CCO)O 1458a_100000719980_100000211926 [0,2,0,0,0,0|2,0,0]=4 8702 B14R1.601 O=C(CCF)c1cc(ccc1O)CO 1458a_200000045694_100011217306 [0,2,0,0,0,0|2,0,0]=4 8703 B14R1.601 O=C(CCO)c1cc(ccc1O)CO 1458a_200000045694_100000211926 [0,2,0,0,0,0|2,0,0]=4 8704 B14R1.918 C#CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000753159 [0,2,0,0,0,0|1,0,1]=4 8705 B14R1.918 C#CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000753159 [0,2,0,0,0,0|1,0,1]=4 8706 B14R1.918 C#CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000753159 [0,2,0,0,0,0|1,0,1]=4 8707 B14R1.918 C#CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000753159 [0,2,0,0,0,0|1,0,1]=4 8708 B14R1.918 C#CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000753159 [0,2,0,0,0,0|1,0,1]=4 8709 B14R1.918 C#CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000753159 [0,2,0,0,0,0|1,0,1]=4 8710 B14R1.918 C#CCNC(=O)c1cc(ccc1O)Br 1626a_100000212058_100000212140 [0,2,0,0,0,0|1,0,1]=4 8711 B14R1.918 C#CCNC(=O)c1cc(ccc1O)Br 240690a_100000212058_100000212140 [0,2,0,0,0,0|1,0,1]=4 8712 B14R1.918 C#CCNC(=O)c1cc(ccc1O)Br 527a_100000212058_100000212140 [0,2,0,0,0,0|1,0,1]=4 8713 B14R1.918 C#CCNC(=O)c1cc(ccc1O)C 240690a_100000212058_100000229998 [0,2,0,0,0,0|1,0,1]=4 8714 B14R1.918 C#CCNC(=O)c1cc(ccc1O)C 527a_100000212058_100000229998 [0,2,0,0,0,0|1,0,1]=4 8715 B14R1.918 C#CCNC(=O)c1cc(ccc1O)Cl 11a_100000212058_100000212143 [0,2,0,0,0,0|1,0,1]=4 8716 B14R1.918 C#CCNC(=O)c1cc(ccc1O)Cl 1626a_100000212058_100000212143 [0,2,0,0,0,0|1,0,1]=4 8717 B14R1.918 C#CCNC(=O)c1cc(ccc1O)Cl 240690a_100000212058_100000212143 [0,2,0,0,0,0|1,0,1]=4 8718 B14R1.918 C#CCNC(=O)c1cc(ccc1O)Cl 527a_100000212058_100000212143 [0,2,0,0,0,0|1,0,1]=4 8719 B14R1.918 C#CCNC(=O)c1cc(ccc1O)F 240690a_100000212058_100000742286 [0,2,0,0,0,0|1,0,1]=4 8720 B14R1.918 C#CCNC(=O)c1cc(ccc1O)F 527a_100000212058_100000742286 [0,2,0,0,0,0|1,0,1]=4 8721 B14R1.918 C#CCNC(=O)c1cc(ccc1O)I 240690a_100000212058_100000212111 [0,2,0,0,0,0|1,0,1]=4 8722 B14R1.918 C#CCNC(=O)c1cc(ccc1O)I 527a_100000212058_100000212111 [0,2,0,0,0,0|1,0,1]=4 8723 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100102629194 [0,2,0,0,0,0|1,0,1]=4 8724 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)C 1458a_100000229998_100102629194 [0,2,0,0,0,0|1,0,1]=4 8725 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100102629194 [0,2,0,0,0,0|1,0,1]=4 8726 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)F 1458a_100000742286_100102629194 [0,2,0,0,0,0|1,0,1]=4 8727 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)I 1458a_100000212111_100102629194 [0,2,0,0,0,0|1,0,1]=4 8728 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)O 1458a_100000758025_100102629194 [0,2,0,0,0,0|1,0,1]=4 8729 B14R1.918 C=CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000754431 [0,2,0,0,0,0|1,0,1]=4 8730 B14R1.918 C=CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000754431 [0,2,0,0,0,0|1,0,1]=4 8731 B14R1.918 C=CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000754431 [0,2,0,0,0,0|1,0,1]=4 8732 B14R1.918 C=CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000754431 [0,2,0,0,0,0|1,0,1]=4 8733 B14R1.918 C=CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000754431 [0,2,0,0,0,0|1,0,1]=4 8734 B14R1.918 C=CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000754431 [0,2,0,0,0,0|1,0,1]=4 8735 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Br 1626a_100020586998_100000212140 [0,2,0,0,0,0|1,0,1]=4 8736 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Br 240690a_100020586998_100000212140 [0,2,0,0,0,0|1,0,1]=4 8737 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Br 527a_100020586998_100000212140 [0,2,0,0,0,0|1,0,1]=4 8738 B14R1.918 C=CCNC(=O)c1cc(ccc1O)C 240690a_100020586998_100000229998 [0,2,0,0,0,0|1,0,1]=4 8739 B14R1.918 C=CCNC(=O)c1cc(ccc1O)C 527a_100020586998_100000229998 [0,2,0,0,0,0|1,0,1]=4 8740 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Cl 1626a_100020586998_100000212143 [0,2,0,0,0,0|1,0,1]=4 8741 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Cl 240690a_100020586998_100000212143 [0,2,0,0,0,0|1,0,1]=4 8742 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Cl 527a_100020586998_100000212143 [0,2,0,0,0,0|1,0,1]=4 8743 B14R1.918 C=CCNC(=O)c1cc(ccc1O)F 240690a_100020586998_100000742286 [0,2,0,0,0,0|1,0,1]=4 8744 B14R1.918 C=CCNC(=O)c1cc(ccc1O)F 527a_100020586998_100000742286 [0,2,0,0,0,0|1,0,1]=4 8745 B14R1.918 C=CCNC(=O)c1cc(ccc1O)I 240690a_100020586998_100000212111 [0,2,0,0,0,0|1,0,1]=4 8746 B14R1.918 C=CCNC(=O)c1cc(ccc1O)I 527a_100020586998_100000212111 [0,2,0,0,0,0|1,0,1]=4 8747 B14R1.918 CC#CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000748600 [0,2,0,0,0,0|1,0,1]=4 8748 B14R1.918 CC#CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000748600 [0,2,0,0,0,0|1,0,1]=4 8749 B14R1.918 CC#CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000748600 [0,2,0,0,0,0|1,0,1]=4 8750 B14R1.918 CC#CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000748600 [0,2,0,0,0,0|1,0,1]=4 8751 B14R1.918 CC#CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000748600 [0,2,0,0,0,0|1,0,1]=4 8752 B14R1.918 CC#CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000748600 [0,2,0,0,0,0|1,0,1]=4 8753 B14R1.918 CC=CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000070051 [0,2,0,0,0,0|1,0,1]=4 8754 B14R1.918 CC=CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000070051 [0,2,0,0,0,0|1,0,1]=4 8755 B14R1.918 CC=CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000070051 [0,2,0,0,0,0|1,0,1]=4 8756 B14R1.918 CC=CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000070051 [0,2,0,0,0,0|1,0,1]=4 8757 B14R1.918 CC=CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000070051 [0,2,0,0,0,0|1,0,1]=4 8758 B14R1.918 CC=CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000070051 [0,2,0,0,0,0|1,0,1]=4 8759 B14R1.918 CCCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210211 [0,2,0,0,0,0|2,0,0]=4 8760 B14R1.918 CCCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210211 [0,2,0,0,0,0|2,0,0]=4 8761 B14R1.918 CCCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210211 [0,2,0,0,0,0|2,0,0]=4 8762 B14R1.918 CCCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210211 [0,2,0,0,0,0|2,0,0]=4 8763 B14R1.918 CCCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210211 [0,2,0,0,0,0|2,0,0]=4 8764 B14R1.918 CCCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210211 [0,2,0,0,0,0|2,0,0]=4 8765 B14R1.918 CCCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210211 [0,2,0,0,0,0|2,0,0]=4 8766 B14R1.918 CCCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210211 [0,2,0,0,0,0|2,0,0]=4 8767 B14R1.918 CCCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210211 [0,2,0,0,0,0|2,0,0]=4 8768 B14R1.918 CCCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210211 [0,2,0,0,0,0|2,0,0]=4 8769 B14R1.918 CCCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210211 [0,2,0,0,0,0|2,0,0]=4 8770 B14R1.918 CCCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210211 [0,2,0,0,0,0|2,0,0]=4 8771 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210211 [0,2,0,0,0,0|2,0,0]=4 8772 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210211 [0,2,0,0,0,0|2,0,0]=4 8773 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210211 [0,2,0,0,0,0|2,0,0]=4 8774 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210211 [0,2,0,0,0,0|2,0,0]=4 8775 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210211 [0,2,0,0,0,0|2,0,0]=4 8776 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210211 [0,2,0,0,0,0|2,0,0]=4 8777 B14R1.918 CCCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210211 [0,2,0,0,0,0|2,0,0]=4 8778 B14R1.918 CCCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210211 [0,2,0,0,0,0|2,0,0]=4 8779 B14R1.918 CCCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210211 [0,2,0,0,0,0|2,0,0]=4 8780 B14R1.918 CCCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210211 [0,2,0,0,0,0|2,0,0]=4 8781 B14R1.918 CCCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210211 [0,2,0,0,0,0|2,0,0]=4 8782 B14R1.918 CCCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210211 [0,2,0,0,0,0|2,0,0]=4 8783 B14R1.918 CCCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210211 [0,2,0,0,0,0|2,0,0]=4 8784 B14R1.918 CCCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210211 [0,2,0,0,0,0|2,0,0]=4 8785 B14R1.918 CCCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210211 [0,2,0,0,0,0|2,0,0]=4 8786 B14R1.918 CCCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210211 [0,2,0,0,0,0|2,0,0]=4 8787 B14R1.918 CCCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210211 [0,2,0,0,0,0|2,0,0]=4 8788 B14R1.918 CCCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210211 [0,2,0,0,0,0|2,0,0]=4 8789 B14R1.918 CCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210211 [0,2,0,0,0,0|1,0,0]=3 8790 B14R1.918 CCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210211 [0,2,0,0,0,0|1,0,0]=3 8791 B14R1.918 CCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210211 [0,2,0,0,0,0|1,0,0]=3 8792 B14R1.918 CCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210211 [0,2,0,0,0,0|1,0,0]=3 8793 B14R1.918 CCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210211 [0,2,0,0,0,0|1,0,0]=3 8794 B14R1.918 CCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210211 [0,2,0,0,0,0|1,0,0]=3 8795 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Br 11a_100020643023_100000690610 [0,2,0,0,0,0|2,0,0]=4 8796 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Br 1626a_100020643023_100000690610 [0,2,0,0,0,0|2,0,0]=4 8797 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Br 240690a_100020643023_100000690610 [0,2,0,0,0,0|2,0,0]=4 8798 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Br 527a_100020643023_100000690610 [0,2,0,0,0,0|2,0,0]=4 8799 B14R1.918 CCCNC(=O)c1cc(ccc1Br)C 11a_100020643023_100000689033 [0,2,0,0,0,0|2,0,0]=4 8800 B14R1.918 CCCNC(=O)c1cc(ccc1Br)C 1626a_100020643023_100000689033 [0,2,0,0,0,0|2,0,0]=4 8801 B14R1.918 CCCNC(=O)c1cc(ccc1Br)C 240690a_100020643023_100000689033 [0,2,0,0,0,0|2,0,0]=4 8802 B14R1.918 CCCNC(=O)c1cc(ccc1Br)C 527a_100020643023_100000689033 [0,2,0,0,0,0|2,0,0]=4 8803 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Cl 11a_100020643023_100000736951 [0,2,0,0,0,0|2,0,0]=4 8804 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Cl 1626a_100020643023_100000736951 [0,2,0,0,0,0|2,0,0]=4 8805 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Cl 240690a_100020643023_100000736951 [0,2,0,0,0,0|2,0,0]=4 8806 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Cl 527a_100020643023_100000736951 [0,2,0,0,0,0|2,0,0]=4 8807 B14R1.918 CCCNC(=O)c1cc(ccc1Br)F 11a_100020643023_100000212315 [0,2,0,0,0,0|2,0,0]=4 8808 B14R1.918 CCCNC(=O)c1cc(ccc1Br)F 1626a_100020643023_100000212315 [0,2,0,0,0,0|2,0,0]=4 8809 B14R1.918 CCCNC(=O)c1cc(ccc1Br)F 240690a_100020643023_100000212315 [0,2,0,0,0,0|2,0,0]=4 8810 B14R1.918 CCCNC(=O)c1cc(ccc1Br)F 527a_100020643023_100000212315 [0,2,0,0,0,0|2,0,0]=4 8811 B14R1.918 CCCNC(=O)c1cc(ccc1Br)I 11a_100020643023_100000698340 [0,2,0,0,0,0|2,0,0]=4 8812 B14R1.918 CCCNC(=O)c1cc(ccc1Br)I 1626a_100020643023_100000698340 [0,2,0,0,0,0|2,0,0]=4 8813 B14R1.918 CCCNC(=O)c1cc(ccc1Br)I 240690a_100020643023_100000698340 [0,2,0,0,0,0|2,0,0]=4 8814 B14R1.918 CCCNC(=O)c1cc(ccc1Br)I 527a_100020643023_100000698340 [0,2,0,0,0,0|2,0,0]=4 8815 B14R1.918 CCCNC(=O)c1cc(ccc1Br)O 240690a_100020643023_100012352043 [0,2,0,0,0,0|2,0,0]=4 8816 B14R1.918 CCCNC(=O)c1cc(ccc1Br)O 527a_100020643023_100012352043 [0,2,0,0,0,0|2,0,0]=4 8817 B14R1.918 CCCNC(=O)c1cc(ccc1C)Br 11a_100020643023_100000759961 [0,2,0,0,0,0|2,0,0]=4 8818 B14R1.918 CCCNC(=O)c1cc(ccc1C)Br 1626a_100020643023_100000759961 [0,2,0,0,0,0|2,0,0]=4 8819 B14R1.918 CCCNC(=O)c1cc(ccc1C)Br 240690a_100020643023_100000759961 [0,2,0,0,0,0|2,0,0]=4 8820 B14R1.918 CCCNC(=O)c1cc(ccc1C)Br 527a_100020643023_100000759961 [0,2,0,0,0,0|2,0,0]=4 8821 B14R1.918 CCCNC(=O)c1cc(ccc1C)C 11a_100020643023_100000195421 [0,2,0,0,0,0|2,0,0]=4 8822 B14R1.918 CCCNC(=O)c1cc(ccc1C)C 1626a_100020643023_100000195421 [0,2,0,0,0,0|2,0,0]=4 8823 B14R1.918 CCCNC(=O)c1cc(ccc1C)C 240690a_100020643023_100000195421 [0,2,0,0,0,0|2,0,0]=4 8824 B14R1.918 CCCNC(=O)c1cc(ccc1C)C 527a_100020643023_100000195421 [0,2,0,0,0,0|2,0,0]=4 8825 B14R1.918 CCCNC(=O)c1cc(ccc1C)Cl 11a_100020643023_100000692595 [0,2,0,0,0,0|2,0,0]=4 8826 B14R1.918 CCCNC(=O)c1cc(ccc1C)Cl 1626a_100020643023_100000692595 [0,2,0,0,0,0|2,0,0]=4 8827 B14R1.918 CCCNC(=O)c1cc(ccc1C)Cl 240690a_100020643023_100000692595 [0,2,0,0,0,0|2,0,0]=4 8828 B14R1.918 CCCNC(=O)c1cc(ccc1C)Cl 527a_100020643023_100000692595 [0,2,0,0,0,0|2,0,0]=4 8829 B14R1.918 CCCNC(=O)c1cc(ccc1C)F 11a_100020643023_100000240043 [0,2,0,0,0,0|2,0,0]=4 8830 B14R1.918 CCCNC(=O)c1cc(ccc1C)F 1626a_100020643023_100000240043 [0,2,0,0,0,0|2,0,0]=4 8831 B14R1.918 CCCNC(=O)c1cc(ccc1C)F 240690a_100020643023_100000240043 [0,2,0,0,0,0|2,0,0]=4 8832 B14R1.918 CCCNC(=O)c1cc(ccc1C)F 527a_100020643023_100000240043 [0,2,0,0,0,0|2,0,0]=4 8833 B14R1.918 CCCNC(=O)c1cc(ccc1C)I 11a_100020643023_100000688012 [0,2,0,0,0,0|2,0,0]=4 8834 B14R1.918 CCCNC(=O)c1cc(ccc1C)I 1626a_100020643023_100000688012 [0,2,0,0,0,0|2,0,0]=4 8835 B14R1.918 CCCNC(=O)c1cc(ccc1C)I 240690a_100020643023_100000688012 [0,2,0,0,0,0|2,0,0]=4 8836 B14R1.918 CCCNC(=O)c1cc(ccc1C)I 527a_100020643023_100000688012 [0,2,0,0,0,0|2,0,0]=4 8837 B14R1.918 CCCNC(=O)c1cc(ccc1C)O 240690a_100020643023_100000687834 [0,2,0,0,0,0|2,0,0]=4 8838 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Br 11a_100020643023_100000211212 [0,2,0,0,0,0|2,0,0]=4 8839 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Br 1626a_100020643023_100000211212 [0,2,0,0,0,0|2,0,0]=4 8840 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Br 240690a_100020643023_100000211212 [0,2,0,0,0,0|2,0,0]=4 8841 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Br 527a_100020643023_100000211212 [0,2,0,0,0,0|2,0,0]=4 8842 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)C 11a_100020643023_100011290873 [0,2,0,0,0,0|2,0,0]=4 8843 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)C 1626a_100020643023_100011290873 [0,2,0,0,0,0|2,0,0]=4 8844 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)C 240690a_100020643023_100011290873 [0,2,0,0,0,0|2,0,0]=4 8845 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)C 527a_100020643023_100011290873 [0,2,0,0,0,0|2,0,0]=4 8846 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Cl 11a_100020643023_100000210642 [0,2,0,0,0,0|2,0,0]=4 8847 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Cl 1626a_100020643023_100000210642 [0,2,0,0,0,0|2,0,0]=4 8848 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Cl 240690a_100020643023_100000210642 [0,2,0,0,0,0|2,0,0]=4 8849 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Cl 527a_100020643023_100000210642 [0,2,0,0,0,0|2,0,0]=4 8850 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)F 11a_100020643023_100011219680 [0,2,0,0,0,0|2,0,0]=4 8851 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)F 1626a_100020643023_100011219680 [0,2,0,0,0,0|2,0,0]=4 8852 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)F 240690a_100020643023_100011219680 [0,2,0,0,0,0|2,0,0]=4 8853 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)F 527a_100020643023_100011219680 [0,2,0,0,0,0|2,0,0]=4 8854 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)I 11a_100020643023_100000688013 [0,2,0,0,0,0|2,0,0]=4 8855 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)I 1626a_100020643023_100000688013 [0,2,0,0,0,0|2,0,0]=4 8856 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)I 240690a_100020643023_100000688013 [0,2,0,0,0,0|2,0,0]=4 8857 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)I 527a_100020643023_100000688013 [0,2,0,0,0,0|2,0,0]=4 8858 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)O 240690a_100020643023_100000719527 [0,2,0,0,0,0|2,0,0]=4 8859 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)O 527a_100020643023_100000719527 [0,2,0,0,0,0|2,0,0]=4 8860 B14R1.918 CCCNC(=O)c1cc(ccc1F)Br 11a_100020643023_100000212322 [0,2,0,0,0,0|2,0,0]=4 8861 B14R1.918 CCCNC(=O)c1cc(ccc1F)Br 1626a_100020643023_100000212322 [0,2,0,0,0,0|2,0,0]=4 8862 B14R1.918 CCCNC(=O)c1cc(ccc1F)Br 240690a_100020643023_100000212322 [0,2,0,0,0,0|2,0,0]=4 8863 B14R1.918 CCCNC(=O)c1cc(ccc1F)Br 527a_100020643023_100000212322 [0,2,0,0,0,0|2,0,0]=4 8864 B14R1.918 CCCNC(=O)c1cc(ccc1F)C 11a_100020643023_100000749327 [0,2,0,0,0,0|2,0,0]=4 8865 B14R1.918 CCCNC(=O)c1cc(ccc1F)C 1626a_100020643023_100000749327 [0,2,0,0,0,0|2,0,0]=4 8866 B14R1.918 CCCNC(=O)c1cc(ccc1F)C 240690a_100020643023_100000749327 [0,2,0,0,0,0|2,0,0]=4 8867 B14R1.918 CCCNC(=O)c1cc(ccc1F)C 527a_100020643023_100000749327 [0,2,0,0,0,0|2,0,0]=4 8868 B14R1.918 CCCNC(=O)c1cc(ccc1F)Cl 11a_100020643023_100000214954 [0,2,0,0,0,0|2,0,0]=4 8869 B14R1.918 CCCNC(=O)c1cc(ccc1F)Cl 1626a_100020643023_100000214954 [0,2,0,0,0,0|2,0,0]=4 8870 B14R1.918 CCCNC(=O)c1cc(ccc1F)Cl 240690a_100020643023_100000214954 [0,2,0,0,0,0|2,0,0]=4 8871 B14R1.918 CCCNC(=O)c1cc(ccc1F)Cl 527a_100020643023_100000214954 [0,2,0,0,0,0|2,0,0]=4 8872 B14R1.918 CCCNC(=O)c1cc(ccc1F)F 11a_100020643023_100000198512 [0,2,0,0,0,0|2,0,0]=4 8873 B14R1.918 CCCNC(=O)c1cc(ccc1F)F 1626a_100020643023_100000198512 [0,2,0,0,0,0|2,0,0]=4 8874 B14R1.918 CCCNC(=O)c1cc(ccc1F)F 240690a_100020643023_100000198512 [0,2,0,0,0,0|2,0,0]=4 8875 B14R1.918 CCCNC(=O)c1cc(ccc1F)F 527a_100020643023_100000198512 [0,2,0,0,0,0|2,0,0]=4 8876 B14R1.918 CCCNC(=O)c1cc(ccc1F)I 11a_100020643023_100000688014 [0,2,0,0,0,0|2,0,0]=4 8877 B14R1.918 CCCNC(=O)c1cc(ccc1F)I 1626a_100020643023_100000688014 [0,2,0,0,0,0|2,0,0]=4 8878 B14R1.918 CCCNC(=O)c1cc(ccc1F)I 240690a_100020643023_100000688014 [0,2,0,0,0,0|2,0,0]=4 8879 B14R1.918 CCCNC(=O)c1cc(ccc1F)I 527a_100020643023_100000688014 [0,2,0,0,0,0|2,0,0]=4 8880 B14R1.918 CCCNC(=O)c1cc(ccc1F)O 240690a_100020643023_100000037260 [0,2,0,0,0,0|2,0,0]=4 8881 B14R1.918 CCCNC(=O)c1cc(ccc1F)O 527a_100020643023_100000037260 [0,2,0,0,0,0|2,0,0]=4 8882 B14R1.918 CCCNC(=O)c1cc(ccc1I)Br 11a_100020643023_100000183945 [0,2,0,0,0,0|2,0,0]=4 8883 B14R1.918 CCCNC(=O)c1cc(ccc1I)Br 1626a_100020643023_100000183945 [0,2,0,0,0,0|2,0,0]=4 8884 B14R1.918 CCCNC(=O)c1cc(ccc1I)Br 240690a_100020643023_100000183945 [0,2,0,0,0,0|2,0,0]=4 8885 B14R1.918 CCCNC(=O)c1cc(ccc1I)C 11a_100020643023_100000057929 [0,2,0,0,0,0|2,0,0]=4 8886 B14R1.918 CCCNC(=O)c1cc(ccc1I)C 1626a_100020643023_100000057929 [0,2,0,0,0,0|2,0,0]=4 8887 B14R1.918 CCCNC(=O)c1cc(ccc1I)C 240690a_100020643023_100000057929 [0,2,0,0,0,0|2,0,0]=4 8888 B14R1.918 CCCNC(=O)c1cc(ccc1I)C 527a_100020643023_100000057929 [0,2,0,0,0,0|2,0,0]=4 8889 B14R1.918 CCCNC(=O)c1cc(ccc1I)Cl 11a_100020643023_100000739379 [0,2,0,0,0,0|2,0,0]=4 8890 B14R1.918 CCCNC(=O)c1cc(ccc1I)Cl 1626a_100020643023_100000739379 [0,2,0,0,0,0|2,0,0]=4 8891 B14R1.918 CCCNC(=O)c1cc(ccc1I)Cl 240690a_100020643023_100000739379 [0,2,0,0,0,0|2,0,0]=4 8892 B14R1.918 CCCNC(=O)c1cc(ccc1I)Cl 527a_100020643023_100000739379 [0,2,0,0,0,0|2,0,0]=4 8893 B14R1.918 CCCNC(=O)c1cc(ccc1I)F 11a_100020643023_100000748905 [0,2,0,0,0,0|2,0,0]=4 8894 B14R1.918 CCCNC(=O)c1cc(ccc1I)F 1626a_100020643023_100000748905 [0,2,0,0,0,0|2,0,0]=4 8895 B14R1.918 CCCNC(=O)c1cc(ccc1I)F 240690a_100020643023_100000748905 [0,2,0,0,0,0|2,0,0]=4 8896 B14R1.918 CCCNC(=O)c1cc(ccc1I)F 527a_100020643023_100000748905 [0,2,0,0,0,0|2,0,0]=4 8897 B14R1.918 CCCNC(=O)c1cc(ccc1I)I 11a_100020643023_100000750460 [0,2,0,0,0,0|2,0,0]=4 8898 B14R1.918 CCCNC(=O)c1cc(ccc1I)I 1626a_100020643023_100000750460 [0,2,0,0,0,0|2,0,0]=4 8899 B14R1.918 CCCNC(=O)c1cc(ccc1I)I 240690a_100020643023_100000750460 [0,2,0,0,0,0|2,0,0]=4 8900 B14R1.918 CCCNC(=O)c1cc(ccc1I)I 527a_100020643023_100000750460 [0,2,0,0,0,0|2,0,0]=4 8901 B14R1.918 CCCNC(=O)c1cc(ccc1I)O 1626a_100020643023_200009995701 [0,2,0,0,0,0|2,0,0]=4 8902 B14R1.918 CCCNC(=O)c1cc(ccc1I)O 240690a_100020643023_200009995701 [0,2,0,0,0,0|2,0,0]=4 8903 B14R1.918 CCCNC(=O)c1cc(ccc1I)O 527a_100020643023_200009995701 [0,2,0,0,0,0|2,0,0]=4 8904 B14R1.918 CCCNC(=O)c1cc(ccc1O)Br 1626a_100020643023_100000212140 [0,2,0,0,0,0|1,0,0]=3 8905 B14R1.918 CCCNC(=O)c1cc(ccc1O)Br 240690a_100020643023_100000212140 [0,2,0,0,0,0|1,0,0]=3 8906 B14R1.918 CCCNC(=O)c1cc(ccc1O)Br 527a_100020643023_100000212140 [0,2,0,0,0,0|1,0,0]=3 8907 B14R1.918 CCCNC(=O)c1cc(ccc1O)C 240690a_100020643023_100000229998 [0,2,0,0,0,0|1,0,0]=3 8908 B14R1.918 CCCNC(=O)c1cc(ccc1O)C 527a_100020643023_100000229998 [0,2,0,0,0,0|1,0,0]=3 8909 B14R1.918 CCCNC(=O)c1cc(ccc1O)Cl 11a_100020643023_100000212143 [0,2,0,0,0,0|1,0,0]=3 8910 B14R1.918 CCCNC(=O)c1cc(ccc1O)Cl 1626a_100020643023_100000212143 [0,2,0,0,0,0|1,0,0]=3 8911 B14R1.918 CCCNC(=O)c1cc(ccc1O)Cl 240690a_100020643023_100000212143 [0,2,0,0,0,0|1,0,0]=3 8912 B14R1.918 CCCNC(=O)c1cc(ccc1O)Cl 527a_100020643023_100000212143 [0,2,0,0,0,0|1,0,0]=3 8913 B14R1.918 CCCNC(=O)c1cc(ccc1O)F 240690a_100020643023_100000742286 [0,2,0,0,0,0|1,0,0]=3 8914 B14R1.918 CCCNC(=O)c1cc(ccc1O)F 527a_100020643023_100000742286 [0,2,0,0,0,0|1,0,0]=3 8915 B14R1.918 CCCNC(=O)c1cc(ccc1O)I 240690a_100020643023_100000212111 [0,2,0,0,0,0|1,0,0]=3 8916 B14R1.918 CCCNC(=O)c1cc(ccc1O)I 527a_100020643023_100000212111 [0,2,0,0,0,0|1,0,0]=3 8917 B14R1.918 CCNCC(=O)c1cc(ccc1Br)Cl 2230a_100015525214_100012361344 [0,2,0,0,0,0|2,0,0]=4 8918 B14R1.918 CCNCC(=O)c1cc(ccc1C)C 2230a_100015525214_100000183774 [0,2,0,0,0,0|2,0,0]=4 8919 B14R1.918 CCNCC(=O)c1cc(ccc1Cl)Cl 2230a_100015525214_100000183120 [0,2,0,0,0,0|2,0,0]=4 8920 B14R1.918 CCNN=C(C)c1cc(ccc1O)Br 4a_100000756455_100000212127 [0,2,0,0,0,0|2,0,0]=4 8921 B14R1.918 CCNN=C(C)c1cc(ccc1O)C 4a_100000756455_100000195442 [0,2,0,0,0,0|2,0,0]=4 8922 B14R1.918 CCNN=C(C)c1cc(ccc1O)Cl 4a_100000756455_100000185566 [0,2,0,0,0,0|2,0,0]=4 8923 B14R1.918 CCNN=C(C)c1cc(ccc1O)F 4a_100000756455_100000182812 [0,2,0,0,0,0|2,0,0]=4 8924 B14R1.918 CCNN=C(C)c1cc(ccc1O)I 4a_100000756455_100010712555 [0,2,0,0,0,0|2,0,0]=4 8925 B14R1.918 CCNN=C(C)c1cc(ccc1O)O 4a_100000756455_100000183313 [0,2,0,0,0,0|2,0,0]=4 8926 B14R1.918 CCNNC(=O)c1cc(ccc1Br)Br 22a_100000756455_100000690610 [0,2,0,0,0,0|2,0,0]=4 8927 B14R1.918 CCNNC(=O)c1cc(ccc1Br)C 22a_100000756455_100000689033 [0,2,0,0,0,0|2,0,0]=4 8928 B14R1.918 CCNNC(=O)c1cc(ccc1Br)Cl 22a_100000756455_100000736951 [0,2,0,0,0,0|2,0,0]=4 8929 B14R1.918 CCNNC(=O)c1cc(ccc1Br)F 22a_100000756455_100000212315 [0,2,0,0,0,0|2,0,0]=4 8930 B14R1.918 CCNNC(=O)c1cc(ccc1Br)I 22a_100000756455_100000698340 [0,2,0,0,0,0|2,0,0]=4 8931 B14R1.918 CCNNC(=O)c1cc(ccc1Br)O 22a_100000756455_100012352043 [0,2,0,0,0,0|2,0,0]=4 8932 B14R1.918 CCNNC(=O)c1cc(ccc1C)Br 22a_100000756455_100000759961 [0,2,0,0,0,0|2,0,0]=4 8933 B14R1.918 CCNNC(=O)c1cc(ccc1C)C 22a_100000756455_100000195421 [0,2,0,0,0,0|2,0,0]=4 8934 B14R1.918 CCNNC(=O)c1cc(ccc1C)Cl 22a_100000756455_100000692595 [0,2,0,0,0,0|2,0,0]=4 8935 B14R1.918 CCNNC(=O)c1cc(ccc1C)F 22a_100000756455_100000240043 [0,2,0,0,0,0|2,0,0]=4 8936 B14R1.918 CCNNC(=O)c1cc(ccc1C)I 22a_100000756455_100000688012 [0,2,0,0,0,0|2,0,0]=4 8937 B14R1.918 CCNNC(=O)c1cc(ccc1C)O 22a_100000756455_100000687834 [0,2,0,0,0,0|2,0,0]=4 8938 B14R1.918 CCNNC(=O)c1cc(ccc1Cl)Br 22a_100000756455_100000211212 [0,2,0,0,0,0|2,0,0]=4 8939 B14R1.918 CCNNC(=O)c1cc(ccc1Cl)C 22a_100000756455_100011290873 [0,2,0,0,0,0|2,0,0]=4 8940 B14R1.918 CCNNC(=O)c1cc(ccc1Cl)Cl 22a_100000756455_100000210642 [0,2,0,0,0,0|2,0,0]=4 8941 B14R1.918 CCNNC(=O)c1cc(ccc1Cl)F 22a_100000756455_100011219680 [0,2,0,0,0,0|2,0,0]=4 8942 B14R1.918 CCNNC(=O)c1cc(ccc1Cl)I 22a_100000756455_100000688013 [0,2,0,0,0,0|2,0,0]=4 8943 B14R1.918 CCNNC(=O)c1cc(ccc1Cl)O 22a_100000756455_100000719527 [0,2,0,0,0,0|2,0,0]=4 8944 B14R1.918 CCNNC(=O)c1cc(ccc1F)Br 22a_100000756455_100000212322 [0,2,0,0,0,0|2,0,0]=4 8945 B14R1.918 CCNNC(=O)c1cc(ccc1F)C 22a_100000756455_100000749327 [0,2,0,0,0,0|2,0,0]=4 8946 B14R1.918 CCNNC(=O)c1cc(ccc1F)Cl 22a_100000756455_100000214954 [0,2,0,0,0,0|2,0,0]=4 8947 B14R1.918 CCNNC(=O)c1cc(ccc1F)F 22a_100000756455_100000198512 [0,2,0,0,0,0|2,0,0]=4 8948 B14R1.918 CCNNC(=O)c1cc(ccc1F)I 22a_100000756455_100000688014 [0,2,0,0,0,0|2,0,0]=4 8949 B14R1.918 CCNNC(=O)c1cc(ccc1F)O 22a_100000756455_100000037260 [0,2,0,0,0,0|2,0,0]=4 8950 B14R1.918 CCNNC(=O)c1cc(ccc1I)Br 22a_100000756455_100000183945 [0,2,0,0,0,0|2,0,0]=4 8951 B14R1.918 CCNNC(=O)c1cc(ccc1I)C 22a_100000756455_100000057929 [0,2,0,0,0,0|2,0,0]=4 8952 B14R1.918 CCNNC(=O)c1cc(ccc1I)Cl 22a_100000756455_100000739379 [0,2,0,0,0,0|2,0,0]=4 8953 B14R1.918 CCNNC(=O)c1cc(ccc1I)F 22a_100000756455_100000748905 [0,2,0,0,0,0|2,0,0]=4 8954 B14R1.918 CCNNC(=O)c1cc(ccc1I)I 22a_100000756455_100000750460 [0,2,0,0,0,0|2,0,0]=4 8955 B14R1.918 CCNNC(=O)c1cc(ccc1I)O 22a_100000756455_200009995701 [0,2,0,0,0,0|2,0,0]=4 8956 B14R1.918 CCNNC(=O)c1cc(ccc1O)Br 22a_100000756455_100000212140 [0,2,0,0,0,0|1,0,0]=3 8957 B14R1.918 CCNNC(=O)c1cc(ccc1O)C 22a_100000756455_100000229998 [0,2,0,0,0,0|1,0,0]=3 8958 B14R1.918 CCNNC(=O)c1cc(ccc1O)Cl 22a_100000756455_100000212143 [0,2,0,0,0,0|1,0,0]=3 8959 B14R1.918 CCNNC(=O)c1cc(ccc1O)F 22a_100000756455_100000742286 [0,2,0,0,0,0|1,0,0]=3 8960 B14R1.918 CCNNC(=O)c1cc(ccc1O)I 22a_100000756455_100000212111 [0,2,0,0,0,0|1,0,0]=3 8961 B14R1.918 CCOCC(=O)c1cc(ccc1Br)Cl 34a_100121572206_100012361344 [0,2,0,0,0,0|1,0,0]=3 8962 B14R1.918 CCOCC(=O)c1cc(ccc1C)C 34a_100121572206_100000183774 [0,2,0,0,0,0|1,0,0]=3 8963 B14R1.918 CCOCC(=O)c1cc(ccc1Cl)F 34a_100121572206_200010187420 [0,2,0,0,0,0|1,0,0]=3 8964 B14R1.918 CCOCC(=O)c1cc(ccc1F)F 34a_100121572206_100000211571 [0,2,0,0,0,0|1,0,0]=3 8965 B14R1.918 CCOCC(=O)c1cc(ccc1O)Br 34a_100121572206_200009828000 [0,2,0,0,0,0|0,0,0]=2 8966 B14R1.918 CCOCC(=O)c1cc(ccc1O)F 34a_100121572206_100009814381 [0,2,0,0,0,0|0,0,0]=2 8967 B14R1.918 CCOCC(=O)c1cc(ccc1O)O 34a_100121572206_100009814097 [0,2,0,0,0,0|0,0,0]=2 8968 B14R1.918 CCSCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_100000210202 [0,2,0,0,0,0|1,1,0]=4 8969 B14R1.918 CCSCC(=O)c1cc(ccc1C)C 62a_100000183774_100000210202 [0,2,0,0,0,0|1,1,0]=4 8970 B14R1.918 CCSCC(=O)c1cc(ccc1C)C 62a_100000210202_100000183774 [0,2,0,0,0,0|1,1,0]=4 8971 B14R1.918 CCSCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_100000210202 [0,2,0,0,0,0|1,1,0]=4 8972 B14R1.918 CCSCC(=O)c1cc(ccc1Cl)F 62a_100000210202_200010187420 [0,2,0,0,0,0|1,1,0]=4 8973 B14R1.918 CCSCC(=O)c1cc(ccc1Cl)F 62a_200010187420_100000210202 [0,2,0,0,0,0|1,1,0]=4 8974 B14R1.918 CCSCC(=O)c1cc(ccc1F)F 62a_100000210202_100000211571 [0,2,0,0,0,0|1,1,0]=4 8975 B14R1.918 CCSCC(=O)c1cc(ccc1F)F 62a_100000211571_100000210202 [0,2,0,0,0,0|1,1,0]=4 8976 B14R1.918 CCSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000210202 [0,2,0,0,0,0|0,1,0]=3 8977 B14R1.918 CCSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000210202 [0,2,0,0,0,0|0,1,0]=3 8978 B14R1.918 CCSCC(=O)c1cc(ccc1O)F 62a_100000210202_100009814381 [0,2,0,0,0,0|0,1,0]=3 8979 B14R1.918 CCSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000210202 [0,2,0,0,0,0|0,1,0]=3 8980 B14R1.918 CCSCC(=O)c1cc(ccc1O)O 62a_100000210202_100009814097 [0,2,0,0,0,0|0,1,0]=3 8981 B14R1.918 CCSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000210202 [0,2,0,0,0,0|0,1,0]=3 8982 B14R1.918 COCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000233755 [0,2,0,0,0,0|2,0,0]=4 8983 B14R1.918 COCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000233755 [0,2,0,0,0,0|2,0,0]=4 8984 B14R1.918 COCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000233755 [0,2,0,0,0,0|2,0,0]=4 8985 B14R1.918 COCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000233755 [0,2,0,0,0,0|2,0,0]=4 8986 B14R1.918 COCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000233755 [0,2,0,0,0,0|2,0,0]=4 8987 B14R1.918 COCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000233755 [0,2,0,0,0,0|2,0,0]=4 8988 B14R1.918 COCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000233755 [0,2,0,0,0,0|2,0,0]=4 8989 B14R1.918 COCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000233755 [0,2,0,0,0,0|2,0,0]=4 8990 B14R1.918 COCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000233755 [0,2,0,0,0,0|2,0,0]=4 8991 B14R1.918 COCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000233755 [0,2,0,0,0,0|2,0,0]=4 8992 B14R1.918 COCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000233755 [0,2,0,0,0,0|2,0,0]=4 8993 B14R1.918 COCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000233755 [0,2,0,0,0,0|2,0,0]=4 8994 B14R1.918 COCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000233755 [0,2,0,0,0,0|2,0,0]=4 8995 B14R1.918 COCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000233755 [0,2,0,0,0,0|2,0,0]=4 8996 B14R1.918 COCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000233755 [0,2,0,0,0,0|2,0,0]=4 8997 B14R1.918 COCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000233755 [0,2,0,0,0,0|2,0,0]=4 8998 B14R1.918 COCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000233755 [0,2,0,0,0,0|2,0,0]=4 8999 B14R1.918 COCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000233755 [0,2,0,0,0,0|2,0,0]=4 9000 B14R1.918 COCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000233755 [0,2,0,0,0,0|2,0,0]=4 9001 B14R1.918 COCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000233755 [0,2,0,0,0,0|2,0,0]=4 9002 B14R1.918 COCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000233755 [0,2,0,0,0,0|2,0,0]=4 9003 B14R1.918 COCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000233755 [0,2,0,0,0,0|2,0,0]=4 9004 B14R1.918 COCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000233755 [0,2,0,0,0,0|2,0,0]=4 9005 B14R1.918 COCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000233755 [0,2,0,0,0,0|2,0,0]=4 9006 B14R1.918 COCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000233755 [0,2,0,0,0,0|2,0,0]=4 9007 B14R1.918 COCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000233755 [0,2,0,0,0,0|2,0,0]=4 9008 B14R1.918 COCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000233755 [0,2,0,0,0,0|2,0,0]=4 9009 B14R1.918 COCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000233755 [0,2,0,0,0,0|2,0,0]=4 9010 B14R1.918 COCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000233755 [0,2,0,0,0,0|2,0,0]=4 9011 B14R1.918 COCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000233755 [0,2,0,0,0,0|2,0,0]=4 9012 B14R1.918 COCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000233755 [0,2,0,0,0,0|1,0,0]=3 9013 B14R1.918 COCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000233755 [0,2,0,0,0,0|1,0,0]=3 9014 B14R1.918 COCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000233755 [0,2,0,0,0,0|1,0,0]=3 9015 B14R1.918 COCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000233755 [0,2,0,0,0,0|1,0,0]=3 9016 B14R1.918 COCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000233755 [0,2,0,0,0,0|1,0,0]=3 9017 B14R1.918 COCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000233755 [0,2,0,0,0,0|1,0,0]=3 9018 B14R1.918 CSCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000751147 [0,2,0,0,0,0|2,0,0]=4 9019 B14R1.918 CSCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000751147 [0,2,0,0,0,0|2,0,0]=4 9020 B14R1.918 CSCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000751147 [0,2,0,0,0,0|2,0,0]=4 9021 B14R1.918 CSCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000751147 [0,2,0,0,0,0|2,0,0]=4 9022 B14R1.918 CSCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000751147 [0,2,0,0,0,0|2,0,0]=4 9023 B14R1.918 CSCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000751147 [0,2,0,0,0,0|2,0,0]=4 9024 B14R1.918 CSCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000751147 [0,2,0,0,0,0|2,0,0]=4 9025 B14R1.918 CSCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000751147 [0,2,0,0,0,0|2,0,0]=4 9026 B14R1.918 CSCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000751147 [0,2,0,0,0,0|2,0,0]=4 9027 B14R1.918 CSCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000751147 [0,2,0,0,0,0|2,0,0]=4 9028 B14R1.918 CSCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000751147 [0,2,0,0,0,0|2,0,0]=4 9029 B14R1.918 CSCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000751147 [0,2,0,0,0,0|2,0,0]=4 9030 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000751147 [0,2,0,0,0,0|2,0,0]=4 9031 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000751147 [0,2,0,0,0,0|2,0,0]=4 9032 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000751147 [0,2,0,0,0,0|2,0,0]=4 9033 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000751147 [0,2,0,0,0,0|2,0,0]=4 9034 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000751147 [0,2,0,0,0,0|2,0,0]=4 9035 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000751147 [0,2,0,0,0,0|2,0,0]=4 9036 B14R1.918 CSCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000751147 [0,2,0,0,0,0|2,0,0]=4 9037 B14R1.918 CSCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000751147 [0,2,0,0,0,0|2,0,0]=4 9038 B14R1.918 CSCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000751147 [0,2,0,0,0,0|2,0,0]=4 9039 B14R1.918 CSCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000751147 [0,2,0,0,0,0|2,0,0]=4 9040 B14R1.918 CSCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000751147 [0,2,0,0,0,0|2,0,0]=4 9041 B14R1.918 CSCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000751147 [0,2,0,0,0,0|2,0,0]=4 9042 B14R1.918 CSCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000751147 [0,2,0,0,0,0|2,0,0]=4 9043 B14R1.918 CSCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000751147 [0,2,0,0,0,0|2,0,0]=4 9044 B14R1.918 CSCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000751147 [0,2,0,0,0,0|2,0,0]=4 9045 B14R1.918 CSCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000751147 [0,2,0,0,0,0|2,0,0]=4 9046 B14R1.918 CSCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000751147 [0,2,0,0,0,0|2,0,0]=4 9047 B14R1.918 CSCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000751147 [0,2,0,0,0,0|2,0,0]=4 9048 B14R1.918 CSCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000751147 [0,2,0,0,0,0|1,0,0]=3 9049 B14R1.918 CSCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000751147 [0,2,0,0,0,0|1,0,0]=3 9050 B14R1.918 CSCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000751147 [0,2,0,0,0,0|1,0,0]=3 9051 B14R1.918 CSCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000751147 [0,2,0,0,0,0|1,0,0]=3 9052 B14R1.918 CSCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000751147 [0,2,0,0,0,0|1,0,0]=3 9053 B14R1.918 CSCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000751147 [0,2,0,0,0,0|1,0,0]=3 9054 B14R1.918 Cc1ccc(c(c1)C(=O)CCC#N)O 1458a_100000229998_100011215226 [0,2,0,0,0,0|1,0,1]=4 9055 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)Br 1458a_100000689033_100011934791 [0,2,0,0,0,0|2,0,0]=4 9056 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)C 1458a_100000195421_100011934791 [0,2,0,0,0,0|2,0,0]=4 9057 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)Cl 1458a_100011290873_100011934791 [0,2,0,0,0,0|2,0,0]=4 9058 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)F 1458a_100000749327_100011934791 [0,2,0,0,0,0|2,0,0]=4 9059 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)I 1458a_100000057929_100011934791 [0,2,0,0,0,0|2,0,0]=4 9060 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)O 1458a_100000229998_100011934791 [0,2,0,0,0,0|1,0,0]=3 9061 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)Br 1458a_100000689033_100011215043 [0,2,0,0,0,0|2,0,0]=4 9062 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)C 1458a_100000195421_100011215043 [0,2,0,0,0,0|2,0,0]=4 9063 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)Cl 1458a_100011290873_100011215043 [0,2,0,0,0,0|2,0,0]=4 9064 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)F 1458a_100000749327_100011215043 [0,2,0,0,0,0|2,0,0]=4 9065 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)I 1458a_100000057929_100011215043 [0,2,0,0,0,0|2,0,0]=4 9066 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)O 1458a_100000229998_100011215043 [0,2,0,0,0,0|1,0,0]=3 9067 B14R1.918 Cc1ccc(c(c1)C(=O)NCC#N)O 527a_100000734998_100000229998 [0,2,0,0,0,0|1,0,1]=4 9068 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)Br 11a_100000724931_100000689033 [0,2,0,0,0,0|2,0,0]=4 9069 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)Br 1626a_100000724931_100000689033 [0,2,0,0,0,0|2,0,0]=4 9070 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)Br 240690a_100000724931_100000689033 [0,2,0,0,0,0|2,0,0]=4 9071 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)Br 527a_100000724931_100000689033 [0,2,0,0,0,0|2,0,0]=4 9072 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)C 11a_100000724931_100000195421 [0,2,0,0,0,0|2,0,0]=4 9073 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)C 1626a_100000724931_100000195421 [0,2,0,0,0,0|2,0,0]=4 9074 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)C 240690a_100000724931_100000195421 [0,2,0,0,0,0|2,0,0]=4 9075 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)C 527a_100000724931_100000195421 [0,2,0,0,0,0|2,0,0]=4 9076 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)Cl 11a_100000724931_100011290873 [0,2,0,0,0,0|2,0,0]=4 9077 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)Cl 1626a_100000724931_100011290873 [0,2,0,0,0,0|2,0,0]=4 9078 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)Cl 240690a_100000724931_100011290873 [0,2,0,0,0,0|2,0,0]=4 9079 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)Cl 527a_100000724931_100011290873 [0,2,0,0,0,0|2,0,0]=4 9080 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)F 11a_100000724931_100000749327 [0,2,0,0,0,0|2,0,0]=4 9081 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)F 1626a_100000724931_100000749327 [0,2,0,0,0,0|2,0,0]=4 9082 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)F 240690a_100000724931_100000749327 [0,2,0,0,0,0|2,0,0]=4 9083 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)F 527a_100000724931_100000749327 [0,2,0,0,0,0|2,0,0]=4 9084 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)I 11a_100000724931_100000057929 [0,2,0,0,0,0|2,0,0]=4 9085 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)I 1626a_100000724931_100000057929 [0,2,0,0,0,0|2,0,0]=4 9086 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)I 240690a_100000724931_100000057929 [0,2,0,0,0,0|2,0,0]=4 9087 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)I 527a_100000724931_100000057929 [0,2,0,0,0,0|2,0,0]=4 9088 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)O 240690a_100000724931_100000229998 [0,2,0,0,0,0|1,0,0]=3 9089 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)O 527a_100000724931_100000229998 [0,2,0,0,0,0|1,0,0]=3 9090 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)Br 240690a_100000210304_100000689033 [0,2,0,0,0,0|2,0,0]=4 9091 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)Br 527a_100000210304_100000689033 [0,2,0,0,0,0|2,0,0]=4 9092 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)C 240690a_100000210304_100000195421 [0,2,0,0,0,0|2,0,0]=4 9093 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)C 527a_100000210304_100000195421 [0,2,0,0,0,0|2,0,0]=4 9094 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)Cl 240690a_100000210304_100011290873 [0,2,0,0,0,0|2,0,0]=4 9095 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)Cl 527a_100000210304_100011290873 [0,2,0,0,0,0|2,0,0]=4 9096 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)F 240690a_100000210304_100000749327 [0,2,0,0,0,0|2,0,0]=4 9097 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)F 527a_100000210304_100000749327 [0,2,0,0,0,0|2,0,0]=4 9098 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)I 240690a_100000210304_100000057929 [0,2,0,0,0,0|2,0,0]=4 9099 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)I 527a_100000210304_100000057929 [0,2,0,0,0,0|2,0,0]=4 9100 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)O 240690a_100000210304_100000229998 [0,2,0,0,0,0|1,0,0]=3 9101 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)O 527a_100000210304_100000229998 [0,2,0,0,0,0|1,0,0]=3 9102 B14R1.918 Cc1ccc(cc1C(=O)CCCF)Br 1458a_100000759961_100011934791 [0,2,0,0,0,0|2,0,0]=4 9103 B14R1.918 Cc1ccc(cc1C(=O)CCCF)Cl 1458a_100000692595_100011934791 [0,2,0,0,0,0|2,0,0]=4 9104 B14R1.918 Cc1ccc(cc1C(=O)CCCF)F 1458a_100000240043_100011934791 [0,2,0,0,0,0|2,0,0]=4 9105 B14R1.918 Cc1ccc(cc1C(=O)CCCF)I 1458a_100000688012_100011934791 [0,2,0,0,0,0|2,0,0]=4 9106 B14R1.918 Cc1ccc(cc1C(=O)CCCF)O 1458a_100000687834_100011934791 [0,2,0,0,0,0|2,0,0]=4 9107 B14R1.918 Cc1ccc(cc1C(=O)CCCO)Br 1458a_100000759961_100011215043 [0,2,0,0,0,0|2,0,0]=4 9108 B14R1.918 Cc1ccc(cc1C(=O)CCCO)Cl 1458a_100000692595_100011215043 [0,2,0,0,0,0|2,0,0]=4 9109 B14R1.918 Cc1ccc(cc1C(=O)CCCO)F 1458a_100000240043_100011215043 [0,2,0,0,0,0|2,0,0]=4 9110 B14R1.918 Cc1ccc(cc1C(=O)CCCO)I 1458a_100000688012_100011215043 [0,2,0,0,0,0|2,0,0]=4 9111 B14R1.918 Cc1ccc(cc1C(=O)CCCO)O 1458a_100000687834_100011215043 [0,2,0,0,0,0|2,0,0]=4 9112 B14R1.918 Cc1ccc(cc1C(=O)NCCF)Br 11a_100000724931_100000759961 [0,2,0,0,0,0|2,0,0]=4 9113 B14R1.918 Cc1ccc(cc1C(=O)NCCF)Br 1626a_100000724931_100000759961 [0,2,0,0,0,0|2,0,0]=4 9114 B14R1.918 Cc1ccc(cc1C(=O)NCCF)Br 240690a_100000724931_100000759961 [0,2,0,0,0,0|2,0,0]=4 9115 B14R1.918 Cc1ccc(cc1C(=O)NCCF)Br 527a_100000724931_100000759961 [0,2,0,0,0,0|2,0,0]=4 9116 B14R1.918 Cc1ccc(cc1C(=O)NCCF)Cl 11a_100000724931_100000692595 [0,2,0,0,0,0|2,0,0]=4 9117 B14R1.918 Cc1ccc(cc1C(=O)NCCF)Cl 1626a_100000724931_100000692595 [0,2,0,0,0,0|2,0,0]=4 9118 B14R1.918 Cc1ccc(cc1C(=O)NCCF)Cl 240690a_100000724931_100000692595 [0,2,0,0,0,0|2,0,0]=4 9119 B14R1.918 Cc1ccc(cc1C(=O)NCCF)Cl 527a_100000724931_100000692595 [0,2,0,0,0,0|2,0,0]=4 9120 B14R1.918 Cc1ccc(cc1C(=O)NCCF)F 11a_100000724931_100000240043 [0,2,0,0,0,0|2,0,0]=4 9121 B14R1.918 Cc1ccc(cc1C(=O)NCCF)F 1626a_100000724931_100000240043 [0,2,0,0,0,0|2,0,0]=4 9122 B14R1.918 Cc1ccc(cc1C(=O)NCCF)F 240690a_100000724931_100000240043 [0,2,0,0,0,0|2,0,0]=4 9123 B14R1.918 Cc1ccc(cc1C(=O)NCCF)F 527a_100000724931_100000240043 [0,2,0,0,0,0|2,0,0]=4 9124 B14R1.918 Cc1ccc(cc1C(=O)NCCF)I 11a_100000724931_100000688012 [0,2,0,0,0,0|2,0,0]=4 9125 B14R1.918 Cc1ccc(cc1C(=O)NCCF)I 1626a_100000724931_100000688012 [0,2,0,0,0,0|2,0,0]=4 9126 B14R1.918 Cc1ccc(cc1C(=O)NCCF)I 240690a_100000724931_100000688012 [0,2,0,0,0,0|2,0,0]=4 9127 B14R1.918 Cc1ccc(cc1C(=O)NCCF)I 527a_100000724931_100000688012 [0,2,0,0,0,0|2,0,0]=4 9128 B14R1.918 Cc1ccc(cc1C(=O)NCCF)O 240690a_100000724931_100000687834 [0,2,0,0,0,0|2,0,0]=4 9129 B14R1.918 Cc1ccc(cc1C(=O)NCCO)Br 240690a_100000210304_100000759961 [0,2,0,0,0,0|2,0,0]=4 9130 B14R1.918 Cc1ccc(cc1C(=O)NCCO)Br 527a_100000210304_100000759961 [0,2,0,0,0,0|2,0,0]=4 9131 B14R1.918 Cc1ccc(cc1C(=O)NCCO)Cl 240690a_100000210304_100000692595 [0,2,0,0,0,0|2,0,0]=4 9132 B14R1.918 Cc1ccc(cc1C(=O)NCCO)Cl 527a_100000210304_100000692595 [0,2,0,0,0,0|2,0,0]=4 9133 B14R1.918 Cc1ccc(cc1C(=O)NCCO)F 240690a_100000210304_100000240043 [0,2,0,0,0,0|2,0,0]=4 9134 B14R1.918 Cc1ccc(cc1C(=O)NCCO)F 527a_100000210304_100000240043 [0,2,0,0,0,0|2,0,0]=4 9135 B14R1.918 Cc1ccc(cc1C(=O)NCCO)I 240690a_100000210304_100000688012 [0,2,0,0,0,0|2,0,0]=4 9136 B14R1.918 Cc1ccc(cc1C(=O)NCCO)I 527a_100000210304_100000688012 [0,2,0,0,0,0|2,0,0]=4 9137 B14R1.918 Cc1ccc(cc1C(=O)NCCO)O 240690a_100000210304_100000687834 [0,2,0,0,0,0|2,0,0]=4 9138 B14R1.918 N#CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011215226 [0,2,0,0,0,0|1,0,1]=4 9139 B14R1.918 N#CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011215226 [0,2,0,0,0,0|1,0,1]=4 9140 B14R1.918 N#CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011215226 [0,2,0,0,0,0|1,0,1]=4 9141 B14R1.918 N#CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011215226 [0,2,0,0,0,0|1,0,1]=4 9142 B14R1.918 N#CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011215226 [0,2,0,0,0,0|1,0,1]=4 9143 B14R1.918 N#CCNC(=O)c1cc(ccc1O)Br 1626a_100000734998_100000212140 [0,2,0,0,0,0|1,0,1]=4 9144 B14R1.918 N#CCNC(=O)c1cc(ccc1O)Br 527a_100000734998_100000212140 [0,2,0,0,0,0|1,0,1]=4 9145 B14R1.918 N#CCNC(=O)c1cc(ccc1O)Cl 1626a_100000734998_100000212143 [0,2,0,0,0,0|1,0,1]=4 9146 B14R1.918 N#CCNC(=O)c1cc(ccc1O)Cl 527a_100000734998_100000212143 [0,2,0,0,0,0|1,0,1]=4 9147 B14R1.918 N#CCNC(=O)c1cc(ccc1O)F 527a_100000734998_100000742286 [0,2,0,0,0,0|1,0,1]=4 9148 B14R1.918 N#CCNC(=O)c1cc(ccc1O)I 527a_100000734998_100000212111 [0,2,0,0,0,0|1,0,1]=4 9149 B14R1.918 O=C(CCCF)c1cc(ccc1Br)Br 1458a_100000690610_100011934791 [0,2,0,0,0,0|2,0,0]=4 9150 B14R1.918 O=C(CCCF)c1cc(ccc1Br)Cl 1458a_100000736951_100011934791 [0,2,0,0,0,0|2,0,0]=4 9151 B14R1.918 O=C(CCCF)c1cc(ccc1Br)F 1458a_100000212315_100011934791 [0,2,0,0,0,0|2,0,0]=4 9152 B14R1.918 O=C(CCCF)c1cc(ccc1Br)I 1458a_100000698340_100011934791 [0,2,0,0,0,0|2,0,0]=4 9153 B14R1.918 O=C(CCCF)c1cc(ccc1Br)O 1458a_100012352043_100011934791 [0,2,0,0,0,0|2,0,0]=4 9154 B14R1.918 O=C(CCCF)c1cc(ccc1Cl)Br 1458a_100000211212_100011934791 [0,2,0,0,0,0|2,0,0]=4 9155 B14R1.918 O=C(CCCF)c1cc(ccc1Cl)Cl 1458a_100000210642_100011934791 [0,2,0,0,0,0|2,0,0]=4 9156 B14R1.918 O=C(CCCF)c1cc(ccc1Cl)F 1458a_100011219680_100011934791 [0,2,0,0,0,0|2,0,0]=4 9157 B14R1.918 O=C(CCCF)c1cc(ccc1Cl)I 1458a_100000688013_100011934791 [0,2,0,0,0,0|2,0,0]=4 9158 B14R1.918 O=C(CCCF)c1cc(ccc1Cl)O 1458a_100000719527_100011934791 [0,2,0,0,0,0|2,0,0]=4 9159 B14R1.918 O=C(CCCF)c1cc(ccc1F)Br 1458a_100000212322_100011934791 [0,2,0,0,0,0|2,0,0]=4 9160 B14R1.918 O=C(CCCF)c1cc(ccc1F)Cl 1458a_100000214954_100011934791 [0,2,0,0,0,0|2,0,0]=4 9161 B14R1.918 O=C(CCCF)c1cc(ccc1F)F 1458a_100000198512_100011934791 [0,2,0,0,0,0|2,0,0]=4 9162 B14R1.918 O=C(CCCF)c1cc(ccc1F)I 1458a_100000688014_100011934791 [0,2,0,0,0,0|2,0,0]=4 9163 B14R1.918 O=C(CCCF)c1cc(ccc1F)O 1458a_100000037260_100011934791 [0,2,0,0,0,0|2,0,0]=4 9164 B14R1.918 O=C(CCCF)c1cc(ccc1I)Br 1458a_100000183945_100011934791 [0,2,0,0,0,0|2,0,0]=4 9165 B14R1.918 O=C(CCCF)c1cc(ccc1I)Cl 1458a_100000739379_100011934791 [0,2,0,0,0,0|2,0,0]=4 9166 B14R1.918 O=C(CCCF)c1cc(ccc1I)F 1458a_100000748905_100011934791 [0,2,0,0,0,0|2,0,0]=4 9167 B14R1.918 O=C(CCCF)c1cc(ccc1I)I 1458a_100000750460_100011934791 [0,2,0,0,0,0|2,0,0]=4 9168 B14R1.918 O=C(CCCF)c1cc(ccc1I)O 1458a_200009995701_100011934791 [0,2,0,0,0,0|2,0,0]=4 9169 B14R1.918 O=C(CCCF)c1cc(ccc1O)Br 1458a_100000212140_100011934791 [0,2,0,0,0,0|1,0,0]=3 9170 B14R1.918 O=C(CCCF)c1cc(ccc1O)Cl 1458a_100000212143_100011934791 [0,2,0,0,0,0|1,0,0]=3 9171 B14R1.918 O=C(CCCF)c1cc(ccc1O)F 1458a_100000742286_100011934791 [0,2,0,0,0,0|1,0,0]=3 9172 B14R1.918 O=C(CCCF)c1cc(ccc1O)I 1458a_100000212111_100011934791 [0,2,0,0,0,0|1,0,0]=3 9173 B14R1.918 O=C(CCCF)c1cc(ccc1O)O 1458a_100000758025_100011934791 [0,2,0,0,0,0|1,0,0]=3 9174 B14R1.918 O=C(CCCO)c1cc(ccc1Br)Br 1458a_100000690610_100011215043 [0,2,0,0,0,0|2,0,0]=4 9175 B14R1.918 O=C(CCCO)c1cc(ccc1Br)Cl 1458a_100000736951_100011215043 [0,2,0,0,0,0|2,0,0]=4 9176 B14R1.918 O=C(CCCO)c1cc(ccc1Br)F 1458a_100000212315_100011215043 [0,2,0,0,0,0|2,0,0]=4 9177 B14R1.918 O=C(CCCO)c1cc(ccc1Br)I 1458a_100000698340_100011215043 [0,2,0,0,0,0|2,0,0]=4 9178 B14R1.918 O=C(CCCO)c1cc(ccc1Br)O 1458a_100012352043_100011215043 [0,2,0,0,0,0|2,0,0]=4 9179 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)Br 1458a_100000211212_100011215043 [0,2,0,0,0,0|2,0,0]=4 9180 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)Cl 1458a_100000210642_100011215043 [0,2,0,0,0,0|2,0,0]=4 9181 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)F 1458a_100011219680_100011215043 [0,2,0,0,0,0|2,0,0]=4 9182 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)I 1458a_100000688013_100011215043 [0,2,0,0,0,0|2,0,0]=4 9183 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)O 1458a_100000719527_100011215043 [0,2,0,0,0,0|2,0,0]=4 9184 B14R1.918 O=C(CCCO)c1cc(ccc1F)Br 1458a_100000212322_100011215043 [0,2,0,0,0,0|2,0,0]=4 9185 B14R1.918 O=C(CCCO)c1cc(ccc1F)Cl 1458a_100000214954_100011215043 [0,2,0,0,0,0|2,0,0]=4 9186 B14R1.918 O=C(CCCO)c1cc(ccc1F)F 1458a_100000198512_100011215043 [0,2,0,0,0,0|2,0,0]=4 9187 B14R1.918 O=C(CCCO)c1cc(ccc1F)I 1458a_100000688014_100011215043 [0,2,0,0,0,0|2,0,0]=4 9188 B14R1.918 O=C(CCCO)c1cc(ccc1F)O 1458a_100000037260_100011215043 [0,2,0,0,0,0|2,0,0]=4 9189 B14R1.918 O=C(CCCO)c1cc(ccc1I)Br 1458a_100000183945_100011215043 [0,2,0,0,0,0|2,0,0]=4 9190 B14R1.918 O=C(CCCO)c1cc(ccc1I)Cl 1458a_100000739379_100011215043 [0,2,0,0,0,0|2,0,0]=4 9191 B14R1.918 O=C(CCCO)c1cc(ccc1I)F 1458a_100000748905_100011215043 [0,2,0,0,0,0|2,0,0]=4 9192 B14R1.918 O=C(CCCO)c1cc(ccc1I)I 1458a_100000750460_100011215043 [0,2,0,0,0,0|2,0,0]=4 9193 B14R1.918 O=C(CCCO)c1cc(ccc1I)O 1458a_200009995701_100011215043 [0,2,0,0,0,0|2,0,0]=4 9194 B14R1.918 O=C(CCCO)c1cc(ccc1O)Br 1458a_100000212140_100011215043 [0,2,0,0,0,0|1,0,0]=3 9195 B14R1.918 O=C(CCCO)c1cc(ccc1O)Cl 1458a_100000212143_100011215043 [0,2,0,0,0,0|1,0,0]=3 9196 B14R1.918 O=C(CCCO)c1cc(ccc1O)F 1458a_100000742286_100011215043 [0,2,0,0,0,0|1,0,0]=3 9197 B14R1.918 O=C(CCCO)c1cc(ccc1O)I 1458a_100000212111_100011215043 [0,2,0,0,0,0|1,0,0]=3 9198 B14R1.918 O=C(CCCO)c1cc(ccc1O)O 1458a_100000758025_100011215043 [0,2,0,0,0,0|1,0,0]=3 9199 B14R1.918 O=C(CSCF)c1cc(ccc1O)Br 62a_200009828000_100015361967 [0,2,0,0,0,0|1,1,0]=4 9200 B14R1.918 O=C(CSCF)c1cc(ccc1O)Cl 62a_200009816716_100015361967 [0,2,0,0,0,0|1,1,0]=4 9201 B14R1.918 O=C(CSCF)c1cc(ccc1O)F 62a_100009814381_100015361967 [0,2,0,0,0,0|1,1,0]=4 9202 B14R1.918 O=C(CSCF)c1cc(ccc1O)F 62a_100015361967_100009814381 [0,2,0,0,0,0|1,1,0]=4 9203 B14R1.918 O=C(CSCF)c1cc(ccc1O)O 62a_100009814097_100015361967 [0,2,0,0,0,0|1,1,0]=4 9204 B14R1.918 O=C(CSCF)c1cc(ccc1O)O 62a_100015361967_100009814097 [0,2,0,0,0,0|1,1,0]=4 9205 B14R1.918 O=C(NCCF)c1cc(ccc1Br)Br 11a_100000724931_100000690610 [0,2,0,0,0,0|2,0,0]=4 9206 B14R1.918 O=C(NCCF)c1cc(ccc1Br)Br 1626a_100000724931_100000690610 [0,2,0,0,0,0|2,0,0]=4 9207 B14R1.918 O=C(NCCF)c1cc(ccc1Br)Br 240690a_100000724931_100000690610 [0,2,0,0,0,0|2,0,0]=4 9208 B14R1.918 O=C(NCCF)c1cc(ccc1Br)Br 527a_100000724931_100000690610 [0,2,0,0,0,0|2,0,0]=4 9209 B14R1.918 O=C(NCCF)c1cc(ccc1Br)Cl 11a_100000724931_100000736951 [0,2,0,0,0,0|2,0,0]=4 9210 B14R1.918 O=C(NCCF)c1cc(ccc1Br)Cl 1626a_100000724931_100000736951 [0,2,0,0,0,0|2,0,0]=4 9211 B14R1.918 O=C(NCCF)c1cc(ccc1Br)Cl 240690a_100000724931_100000736951 [0,2,0,0,0,0|2,0,0]=4 9212 B14R1.918 O=C(NCCF)c1cc(ccc1Br)Cl 527a_100000724931_100000736951 [0,2,0,0,0,0|2,0,0]=4 9213 B14R1.918 O=C(NCCF)c1cc(ccc1Br)F 11a_100000724931_100000212315 [0,2,0,0,0,0|2,0,0]=4 9214 B14R1.918 O=C(NCCF)c1cc(ccc1Br)F 1626a_100000724931_100000212315 [0,2,0,0,0,0|2,0,0]=4 9215 B14R1.918 O=C(NCCF)c1cc(ccc1Br)F 240690a_100000724931_100000212315 [0,2,0,0,0,0|2,0,0]=4 9216 B14R1.918 O=C(NCCF)c1cc(ccc1Br)F 527a_100000724931_100000212315 [0,2,0,0,0,0|2,0,0]=4 9217 B14R1.918 O=C(NCCF)c1cc(ccc1Br)I 11a_100000724931_100000698340 [0,2,0,0,0,0|2,0,0]=4 9218 B14R1.918 O=C(NCCF)c1cc(ccc1Br)I 1626a_100000724931_100000698340 [0,2,0,0,0,0|2,0,0]=4 9219 B14R1.918 O=C(NCCF)c1cc(ccc1Br)I 240690a_100000724931_100000698340 [0,2,0,0,0,0|2,0,0]=4 9220 B14R1.918 O=C(NCCF)c1cc(ccc1Br)I 527a_100000724931_100000698340 [0,2,0,0,0,0|2,0,0]=4 9221 B14R1.918 O=C(NCCF)c1cc(ccc1Br)O 240690a_100000724931_100012352043 [0,2,0,0,0,0|2,0,0]=4 9222 B14R1.918 O=C(NCCF)c1cc(ccc1Br)O 527a_100000724931_100012352043 [0,2,0,0,0,0|2,0,0]=4 9223 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)Br 11a_100000724931_100000211212 [0,2,0,0,0,0|2,0,0]=4 9224 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)Br 1626a_100000724931_100000211212 [0,2,0,0,0,0|2,0,0]=4 9225 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)Br 240690a_100000724931_100000211212 [0,2,0,0,0,0|2,0,0]=4 9226 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)Br 527a_100000724931_100000211212 [0,2,0,0,0,0|2,0,0]=4 9227 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)Cl 11a_100000724931_100000210642 [0,2,0,0,0,0|2,0,0]=4 9228 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)Cl 1626a_100000724931_100000210642 [0,2,0,0,0,0|2,0,0]=4 9229 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)Cl 240690a_100000724931_100000210642 [0,2,0,0,0,0|2,0,0]=4 9230 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)Cl 527a_100000724931_100000210642 [0,2,0,0,0,0|2,0,0]=4 9231 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)F 11a_100000724931_100011219680 [0,2,0,0,0,0|2,0,0]=4 9232 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)F 1626a_100000724931_100011219680 [0,2,0,0,0,0|2,0,0]=4 9233 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)F 240690a_100000724931_100011219680 [0,2,0,0,0,0|2,0,0]=4 9234 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)F 527a_100000724931_100011219680 [0,2,0,0,0,0|2,0,0]=4 9235 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)I 11a_100000724931_100000688013 [0,2,0,0,0,0|2,0,0]=4 9236 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)I 1626a_100000724931_100000688013 [0,2,0,0,0,0|2,0,0]=4 9237 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)I 240690a_100000724931_100000688013 [0,2,0,0,0,0|2,0,0]=4 9238 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)I 527a_100000724931_100000688013 [0,2,0,0,0,0|2,0,0]=4 9239 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)O 240690a_100000724931_100000719527 [0,2,0,0,0,0|2,0,0]=4 9240 B14R1.918 O=C(NCCF)c1cc(ccc1Cl)O 527a_100000724931_100000719527 [0,2,0,0,0,0|2,0,0]=4 9241 B14R1.918 O=C(NCCF)c1cc(ccc1F)Br 11a_100000724931_100000212322 [0,2,0,0,0,0|2,0,0]=4 9242 B14R1.918 O=C(NCCF)c1cc(ccc1F)Br 1626a_100000724931_100000212322 [0,2,0,0,0,0|2,0,0]=4 9243 B14R1.918 O=C(NCCF)c1cc(ccc1F)Br 240690a_100000724931_100000212322 [0,2,0,0,0,0|2,0,0]=4 9244 B14R1.918 O=C(NCCF)c1cc(ccc1F)Br 527a_100000724931_100000212322 [0,2,0,0,0,0|2,0,0]=4 9245 B14R1.918 O=C(NCCF)c1cc(ccc1F)Cl 11a_100000724931_100000214954 [0,2,0,0,0,0|2,0,0]=4 9246 B14R1.918 O=C(NCCF)c1cc(ccc1F)Cl 1626a_100000724931_100000214954 [0,2,0,0,0,0|2,0,0]=4 9247 B14R1.918 O=C(NCCF)c1cc(ccc1F)Cl 240690a_100000724931_100000214954 [0,2,0,0,0,0|2,0,0]=4 9248 B14R1.918 O=C(NCCF)c1cc(ccc1F)Cl 527a_100000724931_100000214954 [0,2,0,0,0,0|2,0,0]=4 9249 B14R1.918 O=C(NCCF)c1cc(ccc1F)F 11a_100000724931_100000198512 [0,2,0,0,0,0|2,0,0]=4 9250 B14R1.918 O=C(NCCF)c1cc(ccc1F)F 1626a_100000724931_100000198512 [0,2,0,0,0,0|2,0,0]=4 9251 B14R1.918 O=C(NCCF)c1cc(ccc1F)F 240690a_100000724931_100000198512 [0,2,0,0,0,0|2,0,0]=4 9252 B14R1.918 O=C(NCCF)c1cc(ccc1F)F 527a_100000724931_100000198512 [0,2,0,0,0,0|2,0,0]=4 9253 B14R1.918 O=C(NCCF)c1cc(ccc1F)I 11a_100000724931_100000688014 [0,2,0,0,0,0|2,0,0]=4 9254 B14R1.918 O=C(NCCF)c1cc(ccc1F)I 1626a_100000724931_100000688014 [0,2,0,0,0,0|2,0,0]=4 9255 B14R1.918 O=C(NCCF)c1cc(ccc1F)I 240690a_100000724931_100000688014 [0,2,0,0,0,0|2,0,0]=4 9256 B14R1.918 O=C(NCCF)c1cc(ccc1F)I 527a_100000724931_100000688014 [0,2,0,0,0,0|2,0,0]=4 9257 B14R1.918 O=C(NCCF)c1cc(ccc1F)O 240690a_100000724931_100000037260 [0,2,0,0,0,0|2,0,0]=4 9258 B14R1.918 O=C(NCCF)c1cc(ccc1F)O 527a_100000724931_100000037260 [0,2,0,0,0,0|2,0,0]=4 9259 B14R1.918 O=C(NCCF)c1cc(ccc1I)Br 11a_100000724931_100000183945 [0,2,0,0,0,0|2,0,0]=4 9260 B14R1.918 O=C(NCCF)c1cc(ccc1I)Br 1626a_100000724931_100000183945 [0,2,0,0,0,0|2,0,0]=4 9261 B14R1.918 O=C(NCCF)c1cc(ccc1I)Br 240690a_100000724931_100000183945 [0,2,0,0,0,0|2,0,0]=4 9262 B14R1.918 O=C(NCCF)c1cc(ccc1I)Cl 11a_100000724931_100000739379 [0,2,0,0,0,0|2,0,0]=4 9263 B14R1.918 O=C(NCCF)c1cc(ccc1I)Cl 1626a_100000724931_100000739379 [0,2,0,0,0,0|2,0,0]=4 9264 B14R1.918 O=C(NCCF)c1cc(ccc1I)Cl 240690a_100000724931_100000739379 [0,2,0,0,0,0|2,0,0]=4 9265 B14R1.918 O=C(NCCF)c1cc(ccc1I)Cl 527a_100000724931_100000739379 [0,2,0,0,0,0|2,0,0]=4 9266 B14R1.918 O=C(NCCF)c1cc(ccc1I)F 11a_100000724931_100000748905 [0,2,0,0,0,0|2,0,0]=4 9267 B14R1.918 O=C(NCCF)c1cc(ccc1I)F 1626a_100000724931_100000748905 [0,2,0,0,0,0|2,0,0]=4 9268 B14R1.918 O=C(NCCF)c1cc(ccc1I)F 240690a_100000724931_100000748905 [0,2,0,0,0,0|2,0,0]=4 9269 B14R1.918 O=C(NCCF)c1cc(ccc1I)F 527a_100000724931_100000748905 [0,2,0,0,0,0|2,0,0]=4 9270 B14R1.918 O=C(NCCF)c1cc(ccc1I)I 11a_100000724931_100000750460 [0,2,0,0,0,0|2,0,0]=4 9271 B14R1.918 O=C(NCCF)c1cc(ccc1I)I 1626a_100000724931_100000750460 [0,2,0,0,0,0|2,0,0]=4 9272 B14R1.918 O=C(NCCF)c1cc(ccc1I)I 240690a_100000724931_100000750460 [0,2,0,0,0,0|2,0,0]=4 9273 B14R1.918 O=C(NCCF)c1cc(ccc1I)I 527a_100000724931_100000750460 [0,2,0,0,0,0|2,0,0]=4 9274 B14R1.918 O=C(NCCF)c1cc(ccc1I)O 1626a_100000724931_200009995701 [0,2,0,0,0,0|2,0,0]=4 9275 B14R1.918 O=C(NCCF)c1cc(ccc1I)O 240690a_100000724931_200009995701 [0,2,0,0,0,0|2,0,0]=4 9276 B14R1.918 O=C(NCCF)c1cc(ccc1I)O 527a_100000724931_200009995701 [0,2,0,0,0,0|2,0,0]=4 9277 B14R1.918 O=C(NCCF)c1cc(ccc1O)Br 1626a_100000724931_100000212140 [0,2,0,0,0,0|1,0,0]=3 9278 B14R1.918 O=C(NCCF)c1cc(ccc1O)Br 240690a_100000724931_100000212140 [0,2,0,0,0,0|1,0,0]=3 9279 B14R1.918 O=C(NCCF)c1cc(ccc1O)Br 527a_100000724931_100000212140 [0,2,0,0,0,0|1,0,0]=3 9280 B14R1.918 O=C(NCCF)c1cc(ccc1O)Cl 11a_100000724931_100000212143 [0,2,0,0,0,0|1,0,0]=3 9281 B14R1.918 O=C(NCCF)c1cc(ccc1O)Cl 1626a_100000724931_100000212143 [0,2,0,0,0,0|1,0,0]=3 9282 B14R1.918 O=C(NCCF)c1cc(ccc1O)Cl 240690a_100000724931_100000212143 [0,2,0,0,0,0|1,0,0]=3 9283 B14R1.918 O=C(NCCF)c1cc(ccc1O)Cl 527a_100000724931_100000212143 [0,2,0,0,0,0|1,0,0]=3 9284 B14R1.918 O=C(NCCF)c1cc(ccc1O)F 240690a_100000724931_100000742286 [0,2,0,0,0,0|1,0,0]=3 9285 B14R1.918 O=C(NCCF)c1cc(ccc1O)F 527a_100000724931_100000742286 [0,2,0,0,0,0|1,0,0]=3 9286 B14R1.918 O=C(NCCF)c1cc(ccc1O)I 240690a_100000724931_100000212111 [0,2,0,0,0,0|1,0,0]=3 9287 B14R1.918 O=C(NCCF)c1cc(ccc1O)I 527a_100000724931_100000212111 [0,2,0,0,0,0|1,0,0]=3 9288 B14R1.918 O=C(NCCO)c1cc(ccc1Br)Br 240690a_100000210304_100000690610 [0,2,0,0,0,0|2,0,0]=4 9289 B14R1.918 O=C(NCCO)c1cc(ccc1Br)Br 527a_100000210304_100000690610 [0,2,0,0,0,0|2,0,0]=4 9290 B14R1.918 O=C(NCCO)c1cc(ccc1Br)Cl 240690a_100000210304_100000736951 [0,2,0,0,0,0|2,0,0]=4 9291 B14R1.918 O=C(NCCO)c1cc(ccc1Br)Cl 527a_100000210304_100000736951 [0,2,0,0,0,0|2,0,0]=4 9292 B14R1.918 O=C(NCCO)c1cc(ccc1Br)F 240690a_100000210304_100000212315 [0,2,0,0,0,0|2,0,0]=4 9293 B14R1.918 O=C(NCCO)c1cc(ccc1Br)F 527a_100000210304_100000212315 [0,2,0,0,0,0|2,0,0]=4 9294 B14R1.918 O=C(NCCO)c1cc(ccc1Br)I 240690a_100000210304_100000698340 [0,2,0,0,0,0|2,0,0]=4 9295 B14R1.918 O=C(NCCO)c1cc(ccc1Br)I 527a_100000210304_100000698340 [0,2,0,0,0,0|2,0,0]=4 9296 B14R1.918 O=C(NCCO)c1cc(ccc1Br)O 240690a_100000210304_100012352043 [0,2,0,0,0,0|2,0,0]=4 9297 B14R1.918 O=C(NCCO)c1cc(ccc1Br)O 527a_100000210304_100012352043 [0,2,0,0,0,0|2,0,0]=4 9298 B14R1.918 O=C(NCCO)c1cc(ccc1Cl)Br 240690a_100000210304_100000211212 [0,2,0,0,0,0|2,0,0]=4 9299 B14R1.918 O=C(NCCO)c1cc(ccc1Cl)Br 527a_100000210304_100000211212 [0,2,0,0,0,0|2,0,0]=4 9300 B14R1.918 O=C(NCCO)c1cc(ccc1Cl)Cl 240690a_100000210304_100000210642 [0,2,0,0,0,0|2,0,0]=4 9301 B14R1.918 O=C(NCCO)c1cc(ccc1Cl)Cl 527a_100000210304_100000210642 [0,2,0,0,0,0|2,0,0]=4 9302 B14R1.918 O=C(NCCO)c1cc(ccc1Cl)F 240690a_100000210304_100011219680 [0,2,0,0,0,0|2,0,0]=4 9303 B14R1.918 O=C(NCCO)c1cc(ccc1Cl)F 527a_100000210304_100011219680 [0,2,0,0,0,0|2,0,0]=4 9304 B14R1.918 O=C(NCCO)c1cc(ccc1Cl)I 240690a_100000210304_100000688013 [0,2,0,0,0,0|2,0,0]=4 9305 B14R1.918 O=C(NCCO)c1cc(ccc1Cl)I 527a_100000210304_100000688013 [0,2,0,0,0,0|2,0,0]=4 9306 B14R1.918 O=C(NCCO)c1cc(ccc1Cl)O 240690a_100000210304_100000719527 [0,2,0,0,0,0|2,0,0]=4 9307 B14R1.918 O=C(NCCO)c1cc(ccc1Cl)O 527a_100000210304_100000719527 [0,2,0,0,0,0|2,0,0]=4 9308 B14R1.918 O=C(NCCO)c1cc(ccc1F)Br 240690a_100000210304_100000212322 [0,2,0,0,0,0|2,0,0]=4 9309 B14R1.918 O=C(NCCO)c1cc(ccc1F)Br 527a_100000210304_100000212322 [0,2,0,0,0,0|2,0,0]=4 9310 B14R1.918 O=C(NCCO)c1cc(ccc1F)Cl 240690a_100000210304_100000214954 [0,2,0,0,0,0|2,0,0]=4 9311 B14R1.918 O=C(NCCO)c1cc(ccc1F)Cl 527a_100000210304_100000214954 [0,2,0,0,0,0|2,0,0]=4 9312 B14R1.918 O=C(NCCO)c1cc(ccc1F)F 240690a_100000210304_100000198512 [0,2,0,0,0,0|2,0,0]=4 9313 B14R1.918 O=C(NCCO)c1cc(ccc1F)F 527a_100000210304_100000198512 [0,2,0,0,0,0|2,0,0]=4 9314 B14R1.918 O=C(NCCO)c1cc(ccc1F)I 240690a_100000210304_100000688014 [0,2,0,0,0,0|2,0,0]=4 9315 B14R1.918 O=C(NCCO)c1cc(ccc1F)I 527a_100000210304_100000688014 [0,2,0,0,0,0|2,0,0]=4 9316 B14R1.918 O=C(NCCO)c1cc(ccc1F)O 240690a_100000210304_100000037260 [0,2,0,0,0,0|2,0,0]=4 9317 B14R1.918 O=C(NCCO)c1cc(ccc1F)O 527a_100000210304_100000037260 [0,2,0,0,0,0|2,0,0]=4 9318 B14R1.918 O=C(NCCO)c1cc(ccc1I)Br 240690a_100000210304_100000183945 [0,2,0,0,0,0|2,0,0]=4 9319 B14R1.918 O=C(NCCO)c1cc(ccc1I)Cl 240690a_100000210304_100000739379 [0,2,0,0,0,0|2,0,0]=4 9320 B14R1.918 O=C(NCCO)c1cc(ccc1I)Cl 527a_100000210304_100000739379 [0,2,0,0,0,0|2,0,0]=4 9321 B14R1.918 O=C(NCCO)c1cc(ccc1I)F 240690a_100000210304_100000748905 [0,2,0,0,0,0|2,0,0]=4 9322 B14R1.918 O=C(NCCO)c1cc(ccc1I)F 527a_100000210304_100000748905 [0,2,0,0,0,0|2,0,0]=4 9323 B14R1.918 O=C(NCCO)c1cc(ccc1I)I 240690a_100000210304_100000750460 [0,2,0,0,0,0|2,0,0]=4 9324 B14R1.918 O=C(NCCO)c1cc(ccc1I)I 527a_100000210304_100000750460 [0,2,0,0,0,0|2,0,0]=4 9325 B14R1.918 O=C(NCCO)c1cc(ccc1I)O 240690a_100000210304_200009995701 [0,2,0,0,0,0|2,0,0]=4 9326 B14R1.918 O=C(NCCO)c1cc(ccc1I)O 527a_100000210304_200009995701 [0,2,0,0,0,0|2,0,0]=4 9327 B14R1.918 O=C(NCCO)c1cc(ccc1O)Br 240690a_100000210304_100000212140 [0,2,0,0,0,0|1,0,0]=3 9328 B14R1.918 O=C(NCCO)c1cc(ccc1O)Br 527a_100000210304_100000212140 [0,2,0,0,0,0|1,0,0]=3 9329 B14R1.918 O=C(NCCO)c1cc(ccc1O)Cl 240690a_100000210304_100000212143 [0,2,0,0,0,0|1,0,0]=3 9330 B14R1.918 O=C(NCCO)c1cc(ccc1O)Cl 527a_100000210304_100000212143 [0,2,0,0,0,0|1,0,0]=3 9331 B14R1.918 O=C(NCCO)c1cc(ccc1O)F 240690a_100000210304_100000742286 [0,2,0,0,0,0|1,0,0]=3 9332 B14R1.918 O=C(NCCO)c1cc(ccc1O)F 271570a_203496583355_200000206141 [0,2,0,0,0,0|1,0,0]=3 9333 B14R1.918 O=C(NCCO)c1cc(ccc1O)F 527a_100000210304_100000742286 [0,2,0,0,0,0|1,0,0]=3 9334 B14R1.918 O=C(NCCO)c1cc(ccc1O)I 240690a_100000210304_100000212111 [0,2,0,0,0,0|1,0,0]=3 9335 B14R1.918 O=C(NCCO)c1cc(ccc1O)I 527a_100000210304_100000212111 [0,2,0,0,0,0|1,0,0]=3 9336 B14R1.988 CCC(C)C(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000758301 [0,2,0,0,0,0|2,0,0]=4 9337 B14R1.988 CCC(C)C(=O)c1cc(ccc1Br)C 1458a_100000689033_100000758301 [0,2,0,0,0,0|2,0,0]=4 9338 B14R1.988 CCC(C)C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000758301 [0,2,0,0,0,0|2,0,0]=4 9339 B14R1.988 CCC(C)C(=O)c1cc(ccc1Br)F 1458a_100000212315_100000758301 [0,2,0,0,0,0|2,0,0]=4 9340 B14R1.988 CCC(C)C(=O)c1cc(ccc1Br)I 1458a_100000698340_100000758301 [0,2,0,0,0,0|2,0,0]=4 9341 B14R1.988 CCC(C)C(=O)c1cc(ccc1Br)O 1458a_100012352043_100000758301 [0,2,0,0,0,0|2,0,0]=4 9342 B14R1.988 CCC(C)C(=O)c1cc(ccc1C)Br 1458a_100000759961_100000758301 [0,2,0,0,0,0|2,0,0]=4 9343 B14R1.988 CCC(C)C(=O)c1cc(ccc1C)C 1458a_100000195421_100000758301 [0,2,0,0,0,0|2,0,0]=4 9344 B14R1.988 CCC(C)C(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000758301 [0,2,0,0,0,0|2,0,0]=4 9345 B14R1.988 CCC(C)C(=O)c1cc(ccc1C)F 1458a_100000240043_100000758301 [0,2,0,0,0,0|2,0,0]=4 9346 B14R1.988 CCC(C)C(=O)c1cc(ccc1C)I 1458a_100000688012_100000758301 [0,2,0,0,0,0|2,0,0]=4 9347 B14R1.988 CCC(C)C(=O)c1cc(ccc1C)O 1458a_100000687834_100000758301 [0,2,0,0,0,0|2,0,0]=4 9348 B14R1.988 CCC(C)C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000758301 [0,2,0,0,0,0|2,0,0]=4 9349 B14R1.988 CCC(C)C(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000758301 [0,2,0,0,0,0|2,0,0]=4 9350 B14R1.988 CCC(C)C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000758301 [0,2,0,0,0,0|2,0,0]=4 9351 B14R1.988 CCC(C)C(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000758301 [0,2,0,0,0,0|2,0,0]=4 9352 B14R1.988 CCC(C)C(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000758301 [0,2,0,0,0,0|2,0,0]=4 9353 B14R1.988 CCC(C)C(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000758301 [0,2,0,0,0,0|2,0,0]=4 9354 B14R1.988 CCC(C)C(=O)c1cc(ccc1F)Br 1458a_100000212322_100000758301 [0,2,0,0,0,0|2,0,0]=4 9355 B14R1.988 CCC(C)C(=O)c1cc(ccc1F)C 1458a_100000749327_100000758301 [0,2,0,0,0,0|2,0,0]=4 9356 B14R1.988 CCC(C)C(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000758301 [0,2,0,0,0,0|2,0,0]=4 9357 B14R1.988 CCC(C)C(=O)c1cc(ccc1F)F 1458a_100000198512_100000758301 [0,2,0,0,0,0|2,0,0]=4 9358 B14R1.988 CCC(C)C(=O)c1cc(ccc1F)I 1458a_100000688014_100000758301 [0,2,0,0,0,0|2,0,0]=4 9359 B14R1.988 CCC(C)C(=O)c1cc(ccc1F)O 1458a_100000037260_100000758301 [0,2,0,0,0,0|2,0,0]=4 9360 B14R1.988 CCC(C)C(=O)c1cc(ccc1I)Br 1458a_100000183945_100000758301 [0,2,0,0,0,0|2,0,0]=4 9361 B14R1.988 CCC(C)C(=O)c1cc(ccc1I)C 1458a_100000057929_100000758301 [0,2,0,0,0,0|2,0,0]=4 9362 B14R1.988 CCC(C)C(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000758301 [0,2,0,0,0,0|2,0,0]=4 9363 B14R1.988 CCC(C)C(=O)c1cc(ccc1I)F 1458a_100000748905_100000758301 [0,2,0,0,0,0|2,0,0]=4 9364 B14R1.988 CCC(C)C(=O)c1cc(ccc1I)I 1458a_100000750460_100000758301 [0,2,0,0,0,0|2,0,0]=4 9365 B14R1.988 CCC(C)C(=O)c1cc(ccc1I)O 1458a_200009995701_100000758301 [0,2,0,0,0,0|2,0,0]=4 9366 B14R1.988 CCC(C)C(=O)c1cc(ccc1O)Br 1458a_100000212140_100000758301 [0,2,0,0,0,0|1,0,0]=3 9367 B14R1.988 CCC(C)C(=O)c1cc(ccc1O)C 1458a_100000229998_100000758301 [0,2,0,0,0,0|1,0,0]=3 9368 B14R1.988 CCC(C)C(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000758301 [0,2,0,0,0,0|1,0,0]=3 9369 B14R1.988 CCC(C)C(=O)c1cc(ccc1O)F 1458a_100000742286_100000758301 [0,2,0,0,0,0|1,0,0]=3 9370 B14R1.988 CCC(C)C(=O)c1cc(ccc1O)I 1458a_100000212111_100000758301 [0,2,0,0,0,0|1,0,0]=3 9371 B14R1.988 CCC(C)C(=O)c1cc(ccc1O)O 1458a_100000758025_100000758301 [0,2,0,0,0,0|1,0,0]=3 9372 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)Br 11a_100000225621_100000690610 [0,2,0,0,0,0|2,0,0]=4 9373 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)Br 1626a_100000225621_100000690610 [0,2,0,0,0,0|2,0,0]=4 9374 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)Br 240690a_100000225621_100000690610 [0,2,0,0,0,0|2,0,0]=4 9375 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)Br 527a_100000225621_100000690610 [0,2,0,0,0,0|2,0,0]=4 9376 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)C 11a_100000225621_100000689033 [0,2,0,0,0,0|2,0,0]=4 9377 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)C 1626a_100000225621_100000689033 [0,2,0,0,0,0|2,0,0]=4 9378 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)C 240690a_100000225621_100000689033 [0,2,0,0,0,0|2,0,0]=4 9379 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)C 527a_100000225621_100000689033 [0,2,0,0,0,0|2,0,0]=4 9380 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)Cl 11a_100000225621_100000736951 [0,2,0,0,0,0|2,0,0]=4 9381 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)Cl 1626a_100000225621_100000736951 [0,2,0,0,0,0|2,0,0]=4 9382 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)Cl 240690a_100000225621_100000736951 [0,2,0,0,0,0|2,0,0]=4 9383 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)Cl 527a_100000225621_100000736951 [0,2,0,0,0,0|2,0,0]=4 9384 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)F 11a_100000225621_100000212315 [0,2,0,0,0,0|2,0,0]=4 9385 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)F 1626a_100000225621_100000212315 [0,2,0,0,0,0|2,0,0]=4 9386 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)F 240690a_100000225621_100000212315 [0,2,0,0,0,0|2,0,0]=4 9387 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)F 527a_100000225621_100000212315 [0,2,0,0,0,0|2,0,0]=4 9388 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)I 11a_100000225621_100000698340 [0,2,0,0,0,0|2,0,0]=4 9389 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)I 1626a_100000225621_100000698340 [0,2,0,0,0,0|2,0,0]=4 9390 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)I 240690a_100000225621_100000698340 [0,2,0,0,0,0|2,0,0]=4 9391 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)I 527a_100000225621_100000698340 [0,2,0,0,0,0|2,0,0]=4 9392 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)O 240690a_100000225621_100012352043 [0,2,0,0,0,0|2,0,0]=4 9393 B14R1.988 CCN(C)C(=O)c1cc(ccc1Br)O 527a_100000225621_100012352043 [0,2,0,0,0,0|2,0,0]=4 9394 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)Br 11a_100000225621_100000759961 [0,2,0,0,0,0|2,0,0]=4 9395 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)Br 1626a_100000225621_100000759961 [0,2,0,0,0,0|2,0,0]=4 9396 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)Br 240690a_100000225621_100000759961 [0,2,0,0,0,0|2,0,0]=4 9397 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)Br 527a_100000225621_100000759961 [0,2,0,0,0,0|2,0,0]=4 9398 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)C 11a_100000225621_100000195421 [0,2,0,0,0,0|2,0,0]=4 9399 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)C 1626a_100000225621_100000195421 [0,2,0,0,0,0|2,0,0]=4 9400 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)C 240690a_100000225621_100000195421 [0,2,0,0,0,0|2,0,0]=4 9401 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)C 527a_100000225621_100000195421 [0,2,0,0,0,0|2,0,0]=4 9402 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)Cl 11a_100000225621_100000692595 [0,2,0,0,0,0|2,0,0]=4 9403 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)Cl 1626a_100000225621_100000692595 [0,2,0,0,0,0|2,0,0]=4 9404 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)Cl 240690a_100000225621_100000692595 [0,2,0,0,0,0|2,0,0]=4 9405 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)Cl 527a_100000225621_100000692595 [0,2,0,0,0,0|2,0,0]=4 9406 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)F 11a_100000225621_100000240043 [0,2,0,0,0,0|2,0,0]=4 9407 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)F 1626a_100000225621_100000240043 [0,2,0,0,0,0|2,0,0]=4 9408 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)F 240690a_100000225621_100000240043 [0,2,0,0,0,0|2,0,0]=4 9409 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)F 527a_100000225621_100000240043 [0,2,0,0,0,0|2,0,0]=4 9410 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)I 11a_100000225621_100000688012 [0,2,0,0,0,0|2,0,0]=4 9411 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)I 1626a_100000225621_100000688012 [0,2,0,0,0,0|2,0,0]=4 9412 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)I 240690a_100000225621_100000688012 [0,2,0,0,0,0|2,0,0]=4 9413 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)I 527a_100000225621_100000688012 [0,2,0,0,0,0|2,0,0]=4 9414 B14R1.988 CCN(C)C(=O)c1cc(ccc1C)O 240690a_100000225621_100000687834 [0,2,0,0,0,0|2,0,0]=4 9415 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)Br 11a_100000225621_100000211212 [0,2,0,0,0,0|2,0,0]=4 9416 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)Br 1626a_100000225621_100000211212 [0,2,0,0,0,0|2,0,0]=4 9417 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)Br 240690a_100000225621_100000211212 [0,2,0,0,0,0|2,0,0]=4 9418 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)Br 527a_100000225621_100000211212 [0,2,0,0,0,0|2,0,0]=4 9419 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)C 11a_100000225621_100011290873 [0,2,0,0,0,0|2,0,0]=4 9420 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)C 1626a_100000225621_100011290873 [0,2,0,0,0,0|2,0,0]=4 9421 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)C 240690a_100000225621_100011290873 [0,2,0,0,0,0|2,0,0]=4 9422 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)C 527a_100000225621_100011290873 [0,2,0,0,0,0|2,0,0]=4 9423 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)Cl 11a_100000225621_100000210642 [0,2,0,0,0,0|2,0,0]=4 9424 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)Cl 1626a_100000225621_100000210642 [0,2,0,0,0,0|2,0,0]=4 9425 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)Cl 240690a_100000225621_100000210642 [0,2,0,0,0,0|2,0,0]=4 9426 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)Cl 527a_100000225621_100000210642 [0,2,0,0,0,0|2,0,0]=4 9427 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)F 11a_100000225621_100011219680 [0,2,0,0,0,0|2,0,0]=4 9428 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)F 1626a_100000225621_100011219680 [0,2,0,0,0,0|2,0,0]=4 9429 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)F 240690a_100000225621_100011219680 [0,2,0,0,0,0|2,0,0]=4 9430 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)F 527a_100000225621_100011219680 [0,2,0,0,0,0|2,0,0]=4 9431 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)I 11a_100000225621_100000688013 [0,2,0,0,0,0|2,0,0]=4 9432 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)I 1626a_100000225621_100000688013 [0,2,0,0,0,0|2,0,0]=4 9433 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)I 240690a_100000225621_100000688013 [0,2,0,0,0,0|2,0,0]=4 9434 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)I 527a_100000225621_100000688013 [0,2,0,0,0,0|2,0,0]=4 9435 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)O 240690a_100000225621_100000719527 [0,2,0,0,0,0|2,0,0]=4 9436 B14R1.988 CCN(C)C(=O)c1cc(ccc1Cl)O 527a_100000225621_100000719527 [0,2,0,0,0,0|2,0,0]=4 9437 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)Br 11a_100000225621_100000212322 [0,2,0,0,0,0|2,0,0]=4 9438 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)Br 1626a_100000225621_100000212322 [0,2,0,0,0,0|2,0,0]=4 9439 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)Br 240690a_100000225621_100000212322 [0,2,0,0,0,0|2,0,0]=4 9440 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)Br 527a_100000225621_100000212322 [0,2,0,0,0,0|2,0,0]=4 9441 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)C 11a_100000225621_100000749327 [0,2,0,0,0,0|2,0,0]=4 9442 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)C 1626a_100000225621_100000749327 [0,2,0,0,0,0|2,0,0]=4 9443 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)C 240690a_100000225621_100000749327 [0,2,0,0,0,0|2,0,0]=4 9444 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)C 527a_100000225621_100000749327 [0,2,0,0,0,0|2,0,0]=4 9445 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)Cl 11a_100000225621_100000214954 [0,2,0,0,0,0|2,0,0]=4 9446 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)Cl 1626a_100000225621_100000214954 [0,2,0,0,0,0|2,0,0]=4 9447 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)Cl 240690a_100000225621_100000214954 [0,2,0,0,0,0|2,0,0]=4 9448 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)Cl 527a_100000225621_100000214954 [0,2,0,0,0,0|2,0,0]=4 9449 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)F 11a_100000225621_100000198512 [0,2,0,0,0,0|2,0,0]=4 9450 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)F 1626a_100000225621_100000198512 [0,2,0,0,0,0|2,0,0]=4 9451 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)F 240690a_100000225621_100000198512 [0,2,0,0,0,0|2,0,0]=4 9452 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)F 527a_100000225621_100000198512 [0,2,0,0,0,0|2,0,0]=4 9453 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)I 11a_100000225621_100000688014 [0,2,0,0,0,0|2,0,0]=4 9454 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)I 1626a_100000225621_100000688014 [0,2,0,0,0,0|2,0,0]=4 9455 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)I 240690a_100000225621_100000688014 [0,2,0,0,0,0|2,0,0]=4 9456 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)I 527a_100000225621_100000688014 [0,2,0,0,0,0|2,0,0]=4 9457 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)O 240690a_100000225621_100000037260 [0,2,0,0,0,0|2,0,0]=4 9458 B14R1.988 CCN(C)C(=O)c1cc(ccc1F)O 527a_100000225621_100000037260 [0,2,0,0,0,0|2,0,0]=4 9459 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)Br 11a_100000225621_100000183945 [0,2,0,0,0,0|2,0,0]=4 9460 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)Br 1626a_100000225621_100000183945 [0,2,0,0,0,0|2,0,0]=4 9461 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)Br 240690a_100000225621_100000183945 [0,2,0,0,0,0|2,0,0]=4 9462 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)C 11a_100000225621_100000057929 [0,2,0,0,0,0|2,0,0]=4 9463 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)C 1626a_100000225621_100000057929 [0,2,0,0,0,0|2,0,0]=4 9464 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)C 240690a_100000225621_100000057929 [0,2,0,0,0,0|2,0,0]=4 9465 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)C 527a_100000225621_100000057929 [0,2,0,0,0,0|2,0,0]=4 9466 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)Cl 11a_100000225621_100000739379 [0,2,0,0,0,0|2,0,0]=4 9467 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)Cl 1626a_100000225621_100000739379 [0,2,0,0,0,0|2,0,0]=4 9468 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)Cl 240690a_100000225621_100000739379 [0,2,0,0,0,0|2,0,0]=4 9469 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)Cl 527a_100000225621_100000739379 [0,2,0,0,0,0|2,0,0]=4 9470 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)F 11a_100000225621_100000748905 [0,2,0,0,0,0|2,0,0]=4 9471 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)F 1626a_100000225621_100000748905 [0,2,0,0,0,0|2,0,0]=4 9472 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)F 240690a_100000225621_100000748905 [0,2,0,0,0,0|2,0,0]=4 9473 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)F 527a_100000225621_100000748905 [0,2,0,0,0,0|2,0,0]=4 9474 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)I 11a_100000225621_100000750460 [0,2,0,0,0,0|2,0,0]=4 9475 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)I 1626a_100000225621_100000750460 [0,2,0,0,0,0|2,0,0]=4 9476 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)I 240690a_100000225621_100000750460 [0,2,0,0,0,0|2,0,0]=4 9477 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)I 527a_100000225621_100000750460 [0,2,0,0,0,0|2,0,0]=4 9478 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)O 1626a_100000225621_200009995701 [0,2,0,0,0,0|2,0,0]=4 9479 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)O 240690a_100000225621_200009995701 [0,2,0,0,0,0|2,0,0]=4 9480 B14R1.988 CCN(C)C(=O)c1cc(ccc1I)O 527a_100000225621_200009995701 [0,2,0,0,0,0|2,0,0]=4 9481 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)Br 1626a_100000225621_100000212140 [0,2,0,0,0,0|1,0,0]=3 9482 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)Br 240690a_100000225621_100000212140 [0,2,0,0,0,0|1,0,0]=3 9483 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)Br 527a_100000225621_100000212140 [0,2,0,0,0,0|1,0,0]=3 9484 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)C 240690a_100000225621_100000229998 [0,2,0,0,0,0|1,0,0]=3 9485 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)C 527a_100000225621_100000229998 [0,2,0,0,0,0|1,0,0]=3 9486 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)Cl 11a_100000225621_100000212143 [0,2,0,0,0,0|1,0,0]=3 9487 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)Cl 1626a_100000225621_100000212143 [0,2,0,0,0,0|1,0,0]=3 9488 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)Cl 240690a_100000225621_100000212143 [0,2,0,0,0,0|1,0,0]=3 9489 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)Cl 527a_100000225621_100000212143 [0,2,0,0,0,0|1,0,0]=3 9490 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)F 240690a_100000225621_100000742286 [0,2,0,0,0,0|1,0,0]=3 9491 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)F 527a_100000225621_100000742286 [0,2,0,0,0,0|1,0,0]=3 9492 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)I 240690a_100000225621_100000212111 [0,2,0,0,0,0|1,0,0]=3 9493 B14R1.988 CCN(C)C(=O)c1cc(ccc1O)I 527a_100000225621_100000212111 [0,2,0,0,0,0|1,0,0]=3 9494 B14R1.7264 CCCC(=O)c1cc(c(cc1Br)C)F 1458a_200012355688_100000210303 [0,2,0,0,0,0|2,0,0]=4 9495 B14R1.7264 CCCC(=O)c1cc(c(cc1Br)F)C 1458a_100010204433_100000210303 [0,2,0,0,0,0|2,0,0]=4 9496 B14R1.7264 CCCC(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_100000210303 [0,2,0,0,0,0|2,0,0]=4 9497 B14R1.7264 CCCC(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_100000210303 [0,2,0,0,0,0|2,0,0]=4 9498 B14R1.7264 CCCC(=O)c1cc(c(cc1C)Br)C 1458a_100000695896_100000210303 [0,2,0,0,0,0|2,0,0]=4 9499 B14R1.7264 CCCC(=O)c1cc(c(cc1C)Br)F 1458a_100012344525_100000210303 [0,2,0,0,0,0|2,0,0]=4 9500 B14R1.7264 CCCC(=O)c1cc(c(cc1C)C)Br 1458a_100012920494_100000210303 [0,2,0,0,0,0|2,0,0]=4 9501 B14R1.7264 CCCC(=O)c1cc(c(cc1C)C)C 1458a_100011216168_100000210303 [0,2,0,0,0,0|2,0,0]=4 9502 B14R1.7264 CCCC(=O)c1cc(c(cc1C)C)I 1458a_100000723791_100000210303 [0,2,0,0,0,0|2,0,0]=4 9503 B14R1.7264 CCCC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_100000210303 [0,2,0,0,0,0|2,0,0]=4 9504 B14R1.7264 CCCC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_100000210303 [0,2,0,0,0,0|2,0,0]=4 9505 B14R1.7264 CCCC(=O)c1cc(c(cc1C)F)Br 1458a_100000724332_100000210303 [0,2,0,0,0,0|2,0,0]=4 9506 B14R1.7264 CCCC(=O)c1cc(c(cc1C)F)F 1458a_100000062099_100000210303 [0,2,0,0,0,0|2,0,0]=4 9507 B14R1.7264 CCCC(=O)c1cc(c(cc1C)F)I 1458a_100013328184_100000210303 [0,2,0,0,0,0|2,0,0]=4 9508 B14R1.7264 CCCC(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_100000210303 [0,2,0,0,0,0|2,0,0]=4 9509 B14R1.7264 CCCC(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_100000210303 [0,2,0,0,0,0|2,0,0]=4 9510 B14R1.7264 CCCC(=O)c1cc(c(cc1Cl)C)Cl 1458a_100013033594_100000210303 [0,2,0,0,0,0|2,0,0]=4 9511 B14R1.7264 CCCC(=O)c1cc(c(cc1Cl)C)F 1458a_100009857485_100000210303 [0,2,0,0,0,0|2,0,0]=4 9512 B14R1.7264 CCCC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_100000210303 [0,2,0,0,0,0|2,0,0]=4 9513 B14R1.7264 CCCC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_100000210303 [0,2,0,0,0,0|2,0,0]=4 9514 B14R1.7264 CCCC(=O)c1cc(c(cc1Cl)F)C 1458a_100000687843_100000210303 [0,2,0,0,0,0|2,0,0]=4 9515 B14R1.7264 CCCC(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_100000210303 [0,2,0,0,0,0|2,0,0]=4 9516 B14R1.7264 CCCC(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_100000210303 [0,2,0,0,0,0|2,0,0]=4 9517 B14R1.7264 CCCC(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_100000210303 [0,2,0,0,0,0|2,0,0]=4 9518 B14R1.7264 CCCC(=O)c1cc(c(cc1F)Br)C 1458a_100012354683_100000210303 [0,2,0,0,0,0|2,0,0]=4 9519 B14R1.7264 CCCC(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_100000210303 [0,2,0,0,0,0|2,0,0]=4 9520 B14R1.7264 CCCC(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_100000210303 [0,2,0,0,0,0|2,0,0]=4 9521 B14R1.7264 CCCC(=O)c1cc(c(cc1F)C)Br 1458a_100012920545_100000210303 [0,2,0,0,0,0|2,0,0]=4 9522 B14R1.7264 CCCC(=O)c1cc(c(cc1F)C)Cl 1458a_100012180961_100000210303 [0,2,0,0,0,0|2,0,0]=4 9523 B14R1.7264 CCCC(=O)c1cc(c(cc1F)C)F 1458a_100000686409_100000210303 [0,2,0,0,0,0|2,0,0]=4 9524 B14R1.7264 CCCC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_100000210303 [0,2,0,0,0,0|2,0,0]=4 9525 B14R1.7264 CCCC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_100000210303 [0,2,0,0,0,0|2,0,0]=4 9526 B14R1.7264 CCCC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_100000210303 [0,2,0,0,0,0|2,0,0]=4 9527 B14R1.7264 CCCC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_100000210303 [0,2,0,0,0,0|2,0,0]=4 9528 B14R1.7264 CCCC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_100000210303 [0,2,0,0,0,0|2,0,0]=4 9529 B14R1.7264 CCCC(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_100000210303 [0,2,0,0,0,0|2,0,0]=4 9530 B14R1.7264 CCCC(=O)c1cc(c(cc1F)F)C 1458a_100000767126_100000210303 [0,2,0,0,0,0|2,0,0]=4 9531 B14R1.7264 CCCC(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_100000210303 [0,2,0,0,0,0|2,0,0]=4 9532 B14R1.7264 CCCC(=O)c1cc(c(cc1F)F)F 1458a_100000687535_100000210303 [0,2,0,0,0,0|2,0,0]=4 9533 B14R1.7264 CCCC(=O)c1cc(c(cc1F)F)I 1458a_100000691139_100000210303 [0,2,0,0,0,0|2,0,0]=4 9534 B14R1.7264 CCCC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_100000210303 [0,2,0,0,0,0|2,0,0]=4 9535 B14R1.7264 CCCC(=O)c1cc(c(cc1I)C)C 1458a_100010184404_100000210303 [0,2,0,0,0,0|2,0,0]=4 9536 B14R1.7264 CCCC(=O)c1cc(c(cc1I)F)F 1458a_100000688017_100000210303 [0,2,0,0,0,0|2,0,0]=4 9537 B14R1.7264 CCCC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_100000210303 [0,2,0,0,0,0|1,0,0]=3 9538 B14R1.7264 CCCC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_100000210303 [0,2,0,0,0,0|1,0,0]=3 9539 B14R1.7264 CCCC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_100000210303 [0,2,0,0,0,0|1,0,0]=3 9540 B14R1.7264 CCCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000210303 [0,2,0,0,0,0|1,0,0]=3 9541 B14R1.7264 CCCC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_100000210303 [0,2,0,0,0,0|1,0,0]=3 9542 B14R1.7264 CCCC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000210303 [0,2,0,0,0,0|1,0,0]=3 9543 B14R1.7264 CCCC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_100000210303 [0,2,0,0,0,0|1,0,0]=3 9544 B14R1.7264 CCCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100000210303 [0,2,0,0,0,0|1,0,0]=3 9545 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)C)F 11a_100015525214_200012355688 [0,2,0,0,0,0|2,0,0]=4 9546 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)C)F 240690a_100015525214_200012355688 [0,2,0,0,0,0|2,0,0]=4 9547 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)C)F 527a_100015525214_200012355688 [0,2,0,0,0,0|2,0,0]=4 9548 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)F)C 11a_100015525214_100010204433 [0,2,0,0,0,0|2,0,0]=4 9549 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)F)C 240690a_100015525214_100010204433 [0,2,0,0,0,0|2,0,0]=4 9550 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)F)C 527a_100015525214_100010204433 [0,2,0,0,0,0|2,0,0]=4 9551 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)F)Cl 11a_100015525214_100012921620 [0,2,0,0,0,0|2,0,0]=4 9552 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)F)Cl 240690a_100015525214_100012921620 [0,2,0,0,0,0|2,0,0]=4 9553 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)F)Cl 527a_100015525214_100012921620 [0,2,0,0,0,0|2,0,0]=4 9554 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)F)F 11a_100015525214_100000685074 [0,2,0,0,0,0|2,0,0]=4 9555 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)F)F 240690a_100015525214_100000685074 [0,2,0,0,0,0|2,0,0]=4 9556 B14R1.7264 CCNC(=O)c1cc(c(cc1Br)F)F 527a_100015525214_100000685074 [0,2,0,0,0,0|2,0,0]=4 9557 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Br)C 11a_100015525214_100000695896 [0,2,0,0,0,0|2,0,0]=4 9558 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Br)C 240690a_100015525214_100000695896 [0,2,0,0,0,0|2,0,0]=4 9559 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Br)C 527a_100015525214_100000695896 [0,2,0,0,0,0|2,0,0]=4 9560 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Br)F 11a_100015525214_100012344525 [0,2,0,0,0,0|2,0,0]=4 9561 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Br)F 240690a_100015525214_100012344525 [0,2,0,0,0,0|2,0,0]=4 9562 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Br)F 527a_100015525214_100012344525 [0,2,0,0,0,0|2,0,0]=4 9563 B14R1.7264 CCNC(=O)c1cc(c(cc1C)C)Br 11a_100015525214_100012920494 [0,2,0,0,0,0|2,0,0]=4 9564 B14R1.7264 CCNC(=O)c1cc(c(cc1C)C)Br 240690a_100015525214_100012920494 [0,2,0,0,0,0|2,0,0]=4 9565 B14R1.7264 CCNC(=O)c1cc(c(cc1C)C)Br 527a_100015525214_100012920494 [0,2,0,0,0,0|2,0,0]=4 9566 B14R1.7264 CCNC(=O)c1cc(c(cc1C)C)C 11a_100015525214_100011216168 [0,2,0,0,0,0|2,0,0]=4 9567 B14R1.7264 CCNC(=O)c1cc(c(cc1C)C)C 240690a_100015525214_100011216168 [0,2,0,0,0,0|2,0,0]=4 9568 B14R1.7264 CCNC(=O)c1cc(c(cc1C)C)C 527a_100015525214_100011216168 [0,2,0,0,0,0|2,0,0]=4 9569 B14R1.7264 CCNC(=O)c1cc(c(cc1C)C)I 11a_100015525214_100000723791 [0,2,0,0,0,0|2,0,0]=4 9570 B14R1.7264 CCNC(=O)c1cc(c(cc1C)C)I 240690a_100015525214_100000723791 [0,2,0,0,0,0|2,0,0]=4 9571 B14R1.7264 CCNC(=O)c1cc(c(cc1C)C)I 527a_100015525214_100000723791 [0,2,0,0,0,0|2,0,0]=4 9572 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Cl)Cl 11a_100015525214_100010439669 [0,2,0,0,0,0|2,0,0]=4 9573 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Cl)Cl 240690a_100015525214_100010439669 [0,2,0,0,0,0|2,0,0]=4 9574 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Cl)Cl 527a_100015525214_100010439669 [0,2,0,0,0,0|2,0,0]=4 9575 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Cl)F 11a_100015525214_200010768543 [0,2,0,0,0,0|2,0,0]=4 9576 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Cl)F 240690a_100015525214_200010768543 [0,2,0,0,0,0|2,0,0]=4 9577 B14R1.7264 CCNC(=O)c1cc(c(cc1C)Cl)F 527a_100015525214_200010768543 [0,2,0,0,0,0|2,0,0]=4 9578 B14R1.7264 CCNC(=O)c1cc(c(cc1C)F)Br 11a_100015525214_100000724332 [0,2,0,0,0,0|2,0,0]=4 9579 B14R1.7264 CCNC(=O)c1cc(c(cc1C)F)Br 240690a_100015525214_100000724332 [0,2,0,0,0,0|2,0,0]=4 9580 B14R1.7264 CCNC(=O)c1cc(c(cc1C)F)Br 527a_100015525214_100000724332 [0,2,0,0,0,0|2,0,0]=4 9581 B14R1.7264 CCNC(=O)c1cc(c(cc1C)F)F 11a_100015525214_100000062099 [0,2,0,0,0,0|2,0,0]=4 9582 B14R1.7264 CCNC(=O)c1cc(c(cc1C)F)F 240690a_100015525214_100000062099 [0,2,0,0,0,0|2,0,0]=4 9583 B14R1.7264 CCNC(=O)c1cc(c(cc1C)F)F 527a_100015525214_100000062099 [0,2,0,0,0,0|2,0,0]=4 9584 B14R1.7264 CCNC(=O)c1cc(c(cc1C)F)I 11a_100015525214_100013328184 [0,2,0,0,0,0|2,0,0]=4 9585 B14R1.7264 CCNC(=O)c1cc(c(cc1C)F)I 240690a_100015525214_100013328184 [0,2,0,0,0,0|2,0,0]=4 9586 B14R1.7264 CCNC(=O)c1cc(c(cc1C)F)I 527a_100015525214_100013328184 [0,2,0,0,0,0|2,0,0]=4 9587 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Br)Cl 11a_100015525214_100000246132 [0,2,0,0,0,0|2,0,0]=4 9588 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Br)Cl 240690a_100015525214_100000246132 [0,2,0,0,0,0|2,0,0]=4 9589 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Br)Cl 527a_100015525214_100000246132 [0,2,0,0,0,0|2,0,0]=4 9590 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Br)F 11a_100015525214_100000724438 [0,2,0,0,0,0|2,0,0]=4 9591 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Br)F 240690a_100015525214_100000724438 [0,2,0,0,0,0|2,0,0]=4 9592 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Br)F 527a_100015525214_100000724438 [0,2,0,0,0,0|2,0,0]=4 9593 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)C)Cl 11a_100015525214_100013033594 [0,2,0,0,0,0|2,0,0]=4 9594 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)C)Cl 240690a_100015525214_100013033594 [0,2,0,0,0,0|2,0,0]=4 9595 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)C)Cl 527a_100015525214_100013033594 [0,2,0,0,0,0|2,0,0]=4 9596 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)C)F 11a_100015525214_100009857485 [0,2,0,0,0,0|2,0,0]=4 9597 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)C)F 240690a_100015525214_100009857485 [0,2,0,0,0,0|2,0,0]=4 9598 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)C)F 527a_100015525214_100009857485 [0,2,0,0,0,0|2,0,0]=4 9599 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 11a_100015525214_100011934218 [0,2,0,0,0,0|2,0,0]=4 9600 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 240690a_100015525214_100011934218 [0,2,0,0,0,0|2,0,0]=4 9601 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 527a_100015525214_100011934218 [0,2,0,0,0,0|2,0,0]=4 9602 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Cl)F 11a_100015525214_100000212284 [0,2,0,0,0,0|2,0,0]=4 9603 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Cl)F 240690a_100015525214_100000212284 [0,2,0,0,0,0|2,0,0]=4 9604 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)Cl)F 527a_100015525214_100000212284 [0,2,0,0,0,0|2,0,0]=4 9605 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)F)C 11a_100015525214_100000687843 [0,2,0,0,0,0|2,0,0]=4 9606 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)F)C 240690a_100015525214_100000687843 [0,2,0,0,0,0|2,0,0]=4 9607 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)F)C 527a_100015525214_100000687843 [0,2,0,0,0,0|2,0,0]=4 9608 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)F)F 11a_100015525214_100025704182 [0,2,0,0,0,0|2,0,0]=4 9609 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)F)F 240690a_100015525214_100025704182 [0,2,0,0,0,0|2,0,0]=4 9610 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)F)F 527a_100015525214_100025704182 [0,2,0,0,0,0|2,0,0]=4 9611 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)F)I 11a_100015525214_100012920486 [0,2,0,0,0,0|2,0,0]=4 9612 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)F)I 240690a_100015525214_100012920486 [0,2,0,0,0,0|2,0,0]=4 9613 B14R1.7264 CCNC(=O)c1cc(c(cc1Cl)F)I 527a_100015525214_100012920486 [0,2,0,0,0,0|2,0,0]=4 9614 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)Br 11a_100015525214_200011217225 [0,2,0,0,0,0|2,0,0]=4 9615 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)Br 240690a_100015525214_200011217225 [0,2,0,0,0,0|2,0,0]=4 9616 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)Br 527a_100015525214_200011217225 [0,2,0,0,0,0|2,0,0]=4 9617 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)C 11a_100015525214_100012354683 [0,2,0,0,0,0|2,0,0]=4 9618 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)C 240690a_100015525214_100012354683 [0,2,0,0,0,0|2,0,0]=4 9619 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)C 527a_100015525214_100012354683 [0,2,0,0,0,0|2,0,0]=4 9620 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)Cl 11a_100015525214_100012347732 [0,2,0,0,0,0|2,0,0]=4 9621 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)Cl 240690a_100015525214_100012347732 [0,2,0,0,0,0|2,0,0]=4 9622 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)Cl 527a_100015525214_100012347732 [0,2,0,0,0,0|2,0,0]=4 9623 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)F 11a_100015525214_100012024349 [0,2,0,0,0,0|2,0,0]=4 9624 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)F 240690a_100015525214_100012024349 [0,2,0,0,0,0|2,0,0]=4 9625 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Br)F 527a_100015525214_100012024349 [0,2,0,0,0,0|2,0,0]=4 9626 B14R1.7264 CCNC(=O)c1cc(c(cc1F)C)Br 11a_100015525214_100012920545 [0,2,0,0,0,0|2,0,0]=4 9627 B14R1.7264 CCNC(=O)c1cc(c(cc1F)C)Br 240690a_100015525214_100012920545 [0,2,0,0,0,0|2,0,0]=4 9628 B14R1.7264 CCNC(=O)c1cc(c(cc1F)C)Br 527a_100015525214_100012920545 [0,2,0,0,0,0|2,0,0]=4 9629 B14R1.7264 CCNC(=O)c1cc(c(cc1F)C)Cl 11a_100015525214_100012180961 [0,2,0,0,0,0|2,0,0]=4 9630 B14R1.7264 CCNC(=O)c1cc(c(cc1F)C)Cl 240690a_100015525214_100012180961 [0,2,0,0,0,0|2,0,0]=4 9631 B14R1.7264 CCNC(=O)c1cc(c(cc1F)C)Cl 527a_100015525214_100012180961 [0,2,0,0,0,0|2,0,0]=4 9632 B14R1.7264 CCNC(=O)c1cc(c(cc1F)C)F 11a_100015525214_100000686409 [0,2,0,0,0,0|2,0,0]=4 9633 B14R1.7264 CCNC(=O)c1cc(c(cc1F)C)F 240690a_100015525214_100000686409 [0,2,0,0,0,0|2,0,0]=4 9634 B14R1.7264 CCNC(=O)c1cc(c(cc1F)C)F 527a_100015525214_100000686409 [0,2,0,0,0,0|2,0,0]=4 9635 B14R1.7264 CCNC(=O)c1cc(c(cc1F)C)O 240690a_100015525214_100009839767 [0,2,0,0,0,0|2,0,0]=4 9636 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)Br 11a_100015525214_100011217226 [0,2,0,0,0,0|2,0,0]=4 9637 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)Br 240690a_100015525214_100011217226 [0,2,0,0,0,0|2,0,0]=4 9638 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)Br 527a_100015525214_100011217226 [0,2,0,0,0,0|2,0,0]=4 9639 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)Cl 11a_100015525214_100011217469 [0,2,0,0,0,0|2,0,0]=4 9640 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)Cl 240690a_100015525214_100011217469 [0,2,0,0,0,0|2,0,0]=4 9641 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)Cl 527a_100015525214_100011217469 [0,2,0,0,0,0|2,0,0]=4 9642 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)F 11a_100015525214_100000690020 [0,2,0,0,0,0|2,0,0]=4 9643 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)F 240690a_100015525214_100000690020 [0,2,0,0,0,0|2,0,0]=4 9644 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)F 527a_100015525214_100000690020 [0,2,0,0,0,0|2,0,0]=4 9645 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)I 11a_100015525214_100012920488 [0,2,0,0,0,0|2,0,0]=4 9646 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)I 240690a_100015525214_100012920488 [0,2,0,0,0,0|2,0,0]=4 9647 B14R1.7264 CCNC(=O)c1cc(c(cc1F)Cl)I 527a_100015525214_100012920488 [0,2,0,0,0,0|2,0,0]=4 9648 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)Br 11a_100015525214_100000718434 [0,2,0,0,0,0|2,0,0]=4 9649 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)Br 240690a_100015525214_100000718434 [0,2,0,0,0,0|2,0,0]=4 9650 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)Br 527a_100015525214_100000718434 [0,2,0,0,0,0|2,0,0]=4 9651 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)C 11a_100015525214_100000767126 [0,2,0,0,0,0|2,0,0]=4 9652 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)C 240690a_100015525214_100000767126 [0,2,0,0,0,0|2,0,0]=4 9653 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)C 527a_100015525214_100000767126 [0,2,0,0,0,0|2,0,0]=4 9654 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)Cl 11a_100015525214_100011997751 [0,2,0,0,0,0|2,0,0]=4 9655 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)Cl 240690a_100015525214_100011997751 [0,2,0,0,0,0|2,0,0]=4 9656 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)Cl 527a_100015525214_100011997751 [0,2,0,0,0,0|2,0,0]=4 9657 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)F 11a_100015525214_100000687535 [0,2,0,0,0,0|2,0,0]=4 9658 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)F 240690a_100015525214_100000687535 [0,2,0,0,0,0|2,0,0]=4 9659 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)F 527a_100015525214_100000687535 [0,2,0,0,0,0|2,0,0]=4 9660 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)I 11a_100015525214_100000691139 [0,2,0,0,0,0|2,0,0]=4 9661 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)I 240690a_100015525214_100000691139 [0,2,0,0,0,0|2,0,0]=4 9662 B14R1.7264 CCNC(=O)c1cc(c(cc1F)F)I 527a_100015525214_100000691139 [0,2,0,0,0,0|2,0,0]=4 9663 B14R1.7264 CCNC(=O)c1cc(c(cc1F)O)Cl 240690a_100015525214_200009924051 [0,2,0,0,0,0|2,0,0]=4 9664 B14R1.7264 CCNC(=O)c1cc(c(cc1F)O)Cl 527a_100015525214_200009924051 [0,2,0,0,0,0|2,0,0]=4 9665 B14R1.7264 CCNC(=O)c1cc(c(cc1I)C)C 11a_100015525214_100010184404 [0,2,0,0,0,0|2,0,0]=4 9666 B14R1.7264 CCNC(=O)c1cc(c(cc1I)C)C 240690a_100015525214_100010184404 [0,2,0,0,0,0|2,0,0]=4 9667 B14R1.7264 CCNC(=O)c1cc(c(cc1I)C)C 527a_100015525214_100010184404 [0,2,0,0,0,0|2,0,0]=4 9668 B14R1.7264 CCNC(=O)c1cc(c(cc1I)F)F 11a_100015525214_100000688017 [0,2,0,0,0,0|2,0,0]=4 9669 B14R1.7264 CCNC(=O)c1cc(c(cc1I)F)F 240690a_100015525214_100000688017 [0,2,0,0,0,0|2,0,0]=4 9670 B14R1.7264 CCNC(=O)c1cc(c(cc1I)F)F 527a_100015525214_100000688017 [0,2,0,0,0,0|2,0,0]=4 9671 B14R1.7264 CCNC(=O)c1cc(c(cc1O)Br)F 240690a_100015525214_100010827371 [0,2,0,0,0,0|1,0,0]=3 9672 B14R1.7264 CCNC(=O)c1cc(c(cc1O)Br)F 527a_100015525214_100010827371 [0,2,0,0,0,0|1,0,0]=3 9673 B14R1.7264 CCNC(=O)c1cc(c(cc1O)C)Br 240690a_100015525214_100010233826 [0,2,0,0,0,0|1,0,0]=3 9674 B14R1.7264 CCNC(=O)c1cc(c(cc1O)C)Br 527a_100015525214_100010233826 [0,2,0,0,0,0|1,0,0]=3 9675 B14R1.7264 CCNC(=O)c1cc(c(cc1O)C)C 240690a_100015525214_100009831561 [0,2,0,0,0,0|1,0,0]=3 9676 B14R1.7264 CCNC(=O)c1cc(c(cc1O)C)C 527a_100015525214_100009831561 [0,2,0,0,0,0|1,0,0]=3 9677 B14R1.7264 CCNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100015525214_200009814723 [0,2,0,0,0,0|1,0,0]=3 9678 B14R1.7264 CCNC(=O)c1cc(c(cc1O)Cl)Br 527a_100015525214_200009814723 [0,2,0,0,0,0|1,0,0]=3 9679 B14R1.7264 CCNC(=O)c1cc(c(cc1O)F)Br 240690a_100015525214_100010188153 [0,2,0,0,0,0|1,0,0]=3 9680 B14R1.7264 CCNC(=O)c1cc(c(cc1O)F)Br 527a_100015525214_100010188153 [0,2,0,0,0,0|1,0,0]=3 9681 B14R1.7264 CCNC(=O)c1cc(c(cc1O)F)Cl 240690a_100015525214_100009910333 [0,2,0,0,0,0|1,0,0]=3 9682 B14R1.7264 CCNC(=O)c1cc(c(cc1O)F)Cl 527a_100015525214_100009910333 [0,2,0,0,0,0|1,0,0]=3 9683 B14R1.7264 CCNC(=O)c1cc(c(cc1O)F)F 240690a_100015525214_100012182723 [0,2,0,0,0,0|1,0,0]=3 9684 B14R1.7264 CCNC(=O)c1cc(c(cc1O)F)F 527a_100015525214_100012182723 [0,2,0,0,0,0|1,0,0]=3 9685 B14R1.7264 CCNC(=O)c1cc(c(cc1O)O)Br 527a_100015525214_100009813906 [0,2,0,0,0,0|1,0,0]=3 9686 B14R1.7264 CCOC(=O)c1cc(c(cc1C)C)O 271570a_203496583355_100012360142 [0,2,0,0,0,0|1,0,0]=3 9687 B14R1.7264 CCOC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100012920295 [0,2,0,0,0,0|1,0,0]=3 9688 B14R1.7264 CCOC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100010827328 [0,2,0,0,0,0|1,0,0]=3 9689 B14R1.7264 CCOC(=O)c1cc(c(cc1O)F)F 271570a_203496583355_100010195690 [0,2,0,0,0,0|0,0,0]=2 9690 B14R1.7264 CCOC(=O)c1cn(c(=O)cc1O)C 271570a_203496583355_100010188062 [0,2,0,0,0,0|1,0,0]=3 9691 B14R1.7264 CNNC(=O)c1cc(c(cc1O)Br)F 22a_100016993582_100010827371 [0,2,0,0,0,0|2,0,0]=4 9692 B14R1.7264 CNNC(=O)c1cc(c(cc1O)C)Br 22a_100016993582_100010233826 [0,2,0,0,0,0|2,0,0]=4 9693 B14R1.7264 CNNC(=O)c1cc(c(cc1O)C)C 22a_100016993582_100009831561 [0,2,0,0,0,0|2,0,0]=4 9694 B14R1.7264 CNNC(=O)c1cc(c(cc1O)Cl)Br 22a_100016993582_200009814723 [0,2,0,0,0,0|2,0,0]=4 9695 B14R1.7264 CNNC(=O)c1cc(c(cc1O)F)Br 22a_100016993582_100010188153 [0,2,0,0,0,0|2,0,0]=4 9696 B14R1.7264 CNNC(=O)c1cc(c(cc1O)F)Cl 22a_100016993582_100009910333 [0,2,0,0,0,0|2,0,0]=4 9697 B14R1.7264 CNNC(=O)c1cc(c(cc1O)F)F 22a_100016993582_100012182723 [0,2,0,0,0,0|2,0,0]=4 9698 B14R1.7264 CNNC(=O)c1cc(c(cc1O)O)Br 22a_100016993582_100009813906 [0,2,0,0,0,0|2,0,0]=4 9699 B14R1.7264 Cc1cc(c(cc1Br)C(=O)CCF)O 1458a_100010233826_100011217306 [0,2,0,0,0,0|2,0,0]=4 9700 B14R1.7264 Cc1cc(c(cc1Br)C(=O)CCO)O 1458a_100010233826_100000211926 [0,2,0,0,0,0|2,0,0]=4 9701 B14R1.7264 Cc1cc(c(cc1C)C(=O)CCF)O 1458a_100009831561_100011217306 [0,2,0,0,0,0|2,0,0]=4 9702 B14R1.7264 Cc1cc(c(cc1C)C(=O)CCO)O 1458a_100009831561_100000211926 [0,2,0,0,0,0|2,0,0]=4 9703 B14R1.7264 O=C(CCF)c1cc(c(cc1O)Br)F 1458a_100010827371_100011217306 [0,2,0,0,0,0|2,0,0]=4 9704 B14R1.7264 O=C(CCF)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100011217306 [0,2,0,0,0,0|2,0,0]=4 9705 B14R1.7264 O=C(CCF)c1cc(c(cc1O)F)Br 1458a_100010188153_100011217306 [0,2,0,0,0,0|2,0,0]=4 9706 B14R1.7264 O=C(CCF)c1cc(c(cc1O)F)Cl 1458a_100009910333_100011217306 [0,2,0,0,0,0|2,0,0]=4 9707 B14R1.7264 O=C(CCF)c1cc(c(cc1O)F)F 1458a_100012182723_100011217306 [0,2,0,0,0,0|2,0,0]=4 9708 B14R1.7264 O=C(CCF)c1cc(c(cc1O)O)Br 1458a_100009813906_100011217306 [0,2,0,0,0,0|2,0,0]=4 9709 B14R1.7264 O=C(CCO)c1cc(c(cc1O)Br)F 1458a_100010827371_100000211926 [0,2,0,0,0,0|2,0,0]=4 9710 B14R1.7264 O=C(CCO)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000211926 [0,2,0,0,0,0|2,0,0]=4 9711 B14R1.7264 O=C(CCO)c1cc(c(cc1O)F)Br 1458a_100010188153_100000211926 [0,2,0,0,0,0|2,0,0]=4 9712 B14R1.7264 O=C(CCO)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000211926 [0,2,0,0,0,0|2,0,0]=4 9713 B14R1.7264 O=C(CCO)c1cc(c(cc1O)F)F 1458a_100012182723_100000211926 [0,2,0,0,0,0|2,0,0]=4 9714 B14R1.7264 O=C(CCO)c1cc(c(cc1O)O)Br 1458a_100009813906_100000211926 [0,2,0,0,0,0|2,0,0]=4 9715 B14R1.95 C#Cc1ccccc1C(=O)C(C)CC 1458a_100011243808_100000758301 [0,2,0,0,0,0|2,0,0]=4 9716 B14R1.95 C#Cc1ccccc1C(=O)N(C)CC 527a_100000225621_100011243808 [0,2,0,0,0,0|2,0,0]=4 9717 B14R1.95 C=Cc1ccccc1C(=O)C(C)CC 1458a_100011830265_100000758301 [0,2,0,0,0,0|2,0,0]=4 9718 B14R1.95 C=Cc1ccccc1C(=O)N(C)CC 1626a_100000225621_100011830265 [0,2,0,0,0,0|2,0,0]=4 9719 B14R1.95 CCC(C)C(=O)c1ccccc1C#N 1458a_100000742908_100000758301 [0,2,0,0,0,0|2,0,0]=4 9720 B14R1.95 CCC(C)C(=O)c1ccccc1CO 1458a_100011301526_100000758301 [0,2,0,0,0,0|1,0,0]=3 9721 B14R1.95 CCC(C)C(=O)c1ccccc1I=O 1458a_100000032414_100000758301 [0,2,0,0,0,0|1,0,1]=4 9722 B14R1.95 CCC(C)C(=O)c1ccccc1OC 1458a_100000185835_100000758301 [0,2,0,0,0,0|1,0,0]=3 9723 B14R1.95 CCC(C)C(=O)c1ccccc1SC 1458a_100000183967_100000758301 [0,2,0,0,0,0|1,1,0]=4 9724 B14R1.95 CCN(C)C(=O)c1ccccc1C#N 11a_100000225621_100000742908 [0,2,0,0,0,0|2,0,0]=4 9725 B14R1.95 CCN(C)C(=O)c1ccccc1C#N 1626a_100000225621_100000742908 [0,2,0,0,0,0|2,0,0]=4 9726 B14R1.95 CCN(C)C(=O)c1ccccc1C#N 527a_100000225621_100000742908 [0,2,0,0,0,0|2,0,0]=4 9727 B14R1.95 CCN(C)C(=O)c1ccccc1I=O 1626a_100000225621_100000032414 [0,2,0,0,0,0|1,0,1]=4 9728 B14R1.95 CCN(C)C(=O)c1ccccc1I=O 240690a_100000225621_100000032414 [0,2,0,0,0,0|1,0,1]=4 9729 B14R1.95 CCN(C)C(=O)c1ccccc1I=O 527a_100000225621_100000032414 [0,2,0,0,0,0|1,0,1]=4 9730 B14R1.95 CCN(C)C(=O)c1ccccc1OC 11a_100000225621_100000185835 [0,2,0,0,0,0|1,0,0]=3 9731 B14R1.95 CCN(C)C(=O)c1ccccc1OC 1626a_100000225621_100000185835 [0,2,0,0,0,0|1,0,0]=3 9732 B14R1.95 CCN(C)C(=O)c1ccccc1OC 240690a_100000225621_100000185835 [0,2,0,0,0,0|1,0,0]=3 9733 B14R1.95 CCN(C)C(=O)c1ccccc1OC 527a_100000225621_100000185835 [0,2,0,0,0,0|1,0,0]=3 9734 B14R1.95 CCN(C)C(=O)c1ccccc1SC 11a_100000225621_100000183967 [0,2,0,0,0,0|1,1,0]=4 9735 B14R1.95 CCN(C)C(=O)c1ccccc1SC 1626a_100000225621_100000183967 [0,2,0,0,0,0|1,1,0]=4 9736 B14R1.95 CCN(C)C(=O)c1ccccc1SC 240690a_100000225621_100000183967 [0,2,0,0,0,0|1,1,0]=4 9737 B14R1.95 CCN(C)C(=O)c1ccccc1SC 527a_100000225621_100000183967 [0,2,0,0,0,0|1,1,0]=4 9738 B14R1.95 CCc1ccccc1C(=O)C(C)CC 1458a_100000689120_100000758301 [0,2,0,0,0,0|2,0,0]=4 9739 B14R1.95 CCc1ccccc1C(=O)N(C)CC 11a_100000225621_100000689120 [0,2,0,0,0,0|2,0,0]=4 9740 B14R1.95 CCc1ccccc1C(=O)N(C)CC 1626a_100000225621_100000689120 [0,2,0,0,0,0|2,0,0]=4 9741 B14R1.95 CCc1ccccc1C(=O)N(C)CC 240690a_100000225621_100000689120 [0,2,0,0,0,0|2,0,0]=4 9742 B14R1.95 CCc1ccccc1C(=O)N(C)CC 527a_100000225621_100000689120 [0,2,0,0,0,0|2,0,0]=4 9743 B14R1.263 C=C=Cc1ccccc1C(=O)NCC 271570a_100015277604_200000155173 [0,2,0,0,0,0|2,0,0]=4 9744 B14R1.263 C=C=Cc1ccccc1C(=O)OCC 271570a_100015277604_100000169879 [0,2,0,0,0,0|1,0,0]=3 9745 B14R1.263 C=C=Cc1cccnc1C(=O)OCC 271570a_100015277604_100012351660 [0,2,0,0,0,0|2,0,0]=4 9746 B14R1.263 C=C=Cc1ccncc1C(=O)OCC 271570a_100015277604_100016987518 [0,2,0,0,0,0|2,0,0]=4 9747 B14R1.263 C=C=Cc1cnccc1C(=O)OCC 271570a_100015277604_100010238393 [0,2,0,0,0,0|2,0,0]=4 9748 B14R1.263 C=C=Cc1ncccc1C(=O)OCC 271570a_100015277604_100000170124 [0,2,0,0,0,0|2,0,0]=4 9749 B14R1.263 CC=Cc1ccccc1C(=O)NCC 271570a_100016259895_200000155173 [0,2,0,0,0,0|2,0,0]=4 9750 B14R1.263 CC=Cc1ccccc1C(=O)OCC 271570a_100016259895_100000169879 [0,2,0,0,0,0|1,0,0]=3 9751 B14R1.263 CC=Cc1cccnc1C(=O)OCC 271570a_100016259895_100012351660 [0,2,0,0,0,0|2,0,0]=4 9752 B14R1.263 CC=Cc1ccncc1C(=O)OCC 271570a_100016259895_100016987518 [0,2,0,0,0,0|2,0,0]=4 9753 B14R1.263 CC=Cc1cnccc1C(=O)OCC 271570a_100016259895_100010238393 [0,2,0,0,0,0|2,0,0]=4 9754 B14R1.263 CC=Cc1ncccc1C(=O)OCC 271570a_100016259895_100000170124 [0,2,0,0,0,0|2,0,0]=4 9755 B14R1.263 CCCC(=O)c1ccccc1CC#N 1458a_100000010604_100000210303 [0,2,0,0,0,0|2,0,0]=4 9756 B14R1.263 CCCC(=O)c1ccccc1COC 1458a_100000737999_100000210303 [0,2,0,0,0,0|1,0,0]=3 9757 B14R1.263 CCCC(=O)c1ccccc1N=[N+]=[N-] 1458a_100009827904_100000210303 [0,2,0,0,0,0|2,0,0]=4 9758 B14R1.263 CCCC(=O)c1ccccc1OCC 1458a_100000211144_100000210303 [0,2,0,0,0,0|1,0,0]=3 9759 B14R1.263 CCCC(=O)c1ccccc1OCC 34a_200000073644_100000210202 [0,2,0,0,0,0|1,0,0]=3 9760 B14R1.263 CCCC(=O)c1ccccc1OCC 7a_200000073644_100000210202 [0,2,0,0,0,0|1,0,0]=3 9761 B14R1.263 CCCC(=O)c1ccccc1OCF 34a_200000073644_100015361967 [0,2,0,0,0,0|1,0,0]=3 9762 B14R1.263 CCCC(=O)c1ccccc1OCF 7a_200000073644_100015361967 [0,2,0,0,0,0|1,0,0]=3 9763 B14R1.263 CCCC(=O)c1ccccc1SCC 1458a_100000195471_100000210303 [0,2,0,0,0,0|1,1,0]=4 9764 B14R1.263 CCNC(=O)c1ccccc1CC#N 11a_100015525214_100000010604 [0,2,0,0,0,0|2,0,0]=4 9765 B14R1.263 CCNC(=O)c1ccccc1COC 11a_100015525214_100000737999 [0,2,0,0,0,0|1,0,0]=3 9766 B14R1.263 CCNC(=O)c1ccccc1COC 240690a_100015525214_100000737999 [0,2,0,0,0,0|1,0,0]=3 9767 B14R1.263 CCNC(=O)c1ccccc1COC 527a_100015525214_100000737999 [0,2,0,0,0,0|1,0,0]=3 9768 B14R1.263 CCNC(=O)c1ccccc1N=[N+]=[N-] 240690a_100015525214_100009827904 [0,2,0,0,0,0|2,0,0]=4 9769 B14R1.263 CCNC(=O)c1ccccc1NCC 27a_100015525214_200000155173 [0,2,0,0,0,0|2,0,0]=4 9770 B14R1.263 CCNC(=O)c1ccccc1NCC 34a_100000205978_100000210202 [0,2,0,0,0,0|2,0,0]=4 9771 B14R1.263 CCNC(=O)c1ccccc1NCF 34a_100000205978_100015361967 [0,2,0,0,0,0|2,0,0]=4 9772 B14R1.263 CCNC(=O)c1ccccc1OCC 11a_100015525214_100000211144 [0,2,0,0,0,0|1,0,0]=3 9773 B14R1.263 CCNC(=O)c1ccccc1OCC 240690a_100015525214_100000211144 [0,2,0,0,0,0|1,0,0]=3 9774 B14R1.263 CCNC(=O)c1ccccc1OCC 34a_100000192205_100000210202 [0,2,0,0,0,0|1,0,0]=3 9775 B14R1.263 CCNC(=O)c1ccccc1OCC 527a_100015525214_100000211144 [0,2,0,0,0,0|1,0,0]=3 9776 B14R1.263 CCNC(=O)c1ccccc1OCC 7a_100000192205_100000210202 [0,2,0,0,0,0|1,0,0]=3 9777 B14R1.263 CCNC(=O)c1ccccc1OCF 34a_100000192205_100015361967 [0,2,0,0,0,0|1,0,0]=3 9778 B14R1.263 CCNC(=O)c1ccccc1OCF 7a_100000192205_100015361967 [0,2,0,0,0,0|1,0,0]=3 9779 B14R1.263 CCNC(=O)c1ccccc1SCC 11a_100015525214_100000195471 [0,2,0,0,0,0|1,1,0]=4 9780 B14R1.263 CCNC(=O)c1ccccc1SCC 240690a_100015525214_100000195471 [0,2,0,0,0,0|1,1,0]=4 9781 B14R1.263 CCNC(=O)c1ccccc1SCC 527a_100015525214_100000195471 [0,2,0,0,0,0|1,1,0]=4 9782 B14R1.263 CCNC(=O)c1ccccc1SCC 62a_100000210202_200000155173 [0,2,0,0,0,0|1,1,0]=4 9783 B14R1.263 CCNC(=O)c1ccccc1SCC 62a_200000155173_100000210202 [0,2,0,0,0,0|1,1,0]=4 9784 B14R1.263 CCNC(=O)c1ccccc1SCF 62a_100015361967_200000155173 [0,2,0,0,0,0|1,1,0]=4 9785 B14R1.263 CCNC(=O)c1ccccc1SCF 62a_200000155173_100015361967 [0,2,0,0,0,0|1,1,0]=4 9786 B14R1.263 CCNc1ccncc1C(=O)OCC 27a_100015525214_100016987518 [0,2,0,0,0,0|2,0,0]=4 9787 B14R1.263 CCNc1ncccc1C(=O)OCC 27a_100015525214_100000170124 [0,2,0,0,0,0|2,0,0]=4 9788 B14R1.263 CCOC(=O)c1ccccc1CNC 2230a_106832991635_100009816840 [0,2,0,0,0,0|1,0,0]=3 9789 B14R1.263 CCOC(=O)c1ccccc1CNC 270004a_106832991635_200000006220 [0,2,0,0,0,0|1,0,0]=3 9790 B14R1.263 CCOC(=O)c1ccccc1CNC 34a_100102657272_100009816840 [0,2,0,0,0,0|1,0,0]=3 9791 B14R1.263 CCOC(=O)c1ccccc1CNC 7a_106832991635_100009816840 [0,2,0,0,0,0|1,0,0]=3 9792 B14R1.263 CCOC(=O)c1ccccc1COC 34a_100138415774_100009816840 [0,2,0,0,0,0|0,0,0]=2 9793 B14R1.263 CCOC(=O)c1ccccc1CSC 62a_100009816840_200000210301 [0,2,0,0,0,0|0,1,0]=3 9794 B14R1.263 CCOC(=O)c1ccccc1CSC 62a_200000210301_100009816840 [0,2,0,0,0,0|0,1,0]=3 9795 B14R1.263 CCOC(=O)c1ccccc1CS[13CH3] 62a_100009816840_200025704644 [0,2,0,0,0,0|0,1,0]=3 9796 B14R1.263 CCOC(=O)c1ccccc1CS[13CH3] 62a_200025704644_100009816840 [0,2,0,0,0,0|0,1,0]=3 9797 B14R1.263 CCOC(=O)c1ccccc1OCC 7a_100000169922_100000210202 [0,2,0,0,0,0|0,0,0]=2 9798 B14R1.263 CCOC(=O)c1ccccc1OCF 7a_100000169922_100015361967 [0,2,0,0,0,0|0,0,0]=2 9799 B14R1.263 CCOC(=O)c1ccccc1SCC 62a_100000169876_100000210202 [0,2,0,0,0,0|0,1,0]=3 9800 B14R1.263 CCOC(=O)c1ccccc1SCC 62a_100000210202_100000169879 [0,2,0,0,0,0|0,1,0]=3 9801 B14R1.263 CCOC(=O)c1ccccc1SCF 62a_100000169876_100015361967 [0,2,0,0,0,0|0,1,0]=3 9802 B14R1.263 CCOC(=O)c1ccccc1SCF 62a_100015361967_100000169879 [0,2,0,0,0,0|0,1,0]=3 9803 B14R1.263 CCOC(=O)c1cccnc1SCC 62a_100000210202_100000170124 [0,2,0,0,0,0|1,1,0]=4 9804 B14R1.263 CCOC(=O)c1cccnc1SCC 62a_100011291640_100000210202 [0,2,0,0,0,0|1,1,0]=4 9805 B14R1.263 CCOC(=O)c1cccnc1SCF 62a_100011291640_100015361967 [0,2,0,0,0,0|1,1,0]=4 9806 B14R1.263 CCOC(=O)c1cccnc1SCF 62a_100015361967_100000170124 [0,2,0,0,0,0|1,1,0]=4 9807 B14R1.263 CCOC(=O)c1ccncc1SCC 62a_100000210202_100010238393 [0,2,0,0,0,0|1,1,0]=4 9808 B14R1.263 CCOC(=O)c1ccncc1SCC 62a_100010238393_100000210202 [0,2,0,0,0,0|1,1,0]=4 9809 B14R1.263 CCOC(=O)c1ccncc1SCF 62a_100010238393_100015361967 [0,2,0,0,0,0|1,1,0]=4 9810 B14R1.263 CCOC(=O)c1ccncc1SCF 62a_100015361967_100010238393 [0,2,0,0,0,0|1,1,0]=4 9811 B14R1.263 CCOC(=O)c1cnccc1SCC 62a_100000210202_100016987518 [0,2,0,0,0,0|1,1,0]=4 9812 B14R1.263 CCOC(=O)c1cnccc1SCF 62a_100015361967_100016987518 [0,2,0,0,0,0|1,1,0]=4 9813 B14R1.263 CCOC(=O)c1ncccc1OCC 7a_200011376064_100000210202 [0,2,0,0,0,0|1,0,0]=3 9814 B14R1.263 CCOC(=O)c1ncccc1OCF 7a_200011376064_100015361967 [0,2,0,0,0,0|1,0,0]=3 9815 B14R1.263 CCOC(=O)c1ncccc1SCC 62a_100000210202_100012351660 [0,2,0,0,0,0|1,1,0]=4 9816 B14R1.263 CCOC(=O)c1ncccc1SCC 62a_100012351660_100000210202 [0,2,0,0,0,0|1,1,0]=4 9817 B14R1.263 CCOC(=O)c1ncccc1SCF 62a_100012351660_100015361967 [0,2,0,0,0,0|1,1,0]=4 9818 B14R1.263 CCOC(=O)c1ncccc1SCF 62a_100015361967_100012351660 [0,2,0,0,0,0|1,1,0]=4 9819 B14R1.263 CCOc1ccccc1C(=O)CCCl 7a_100009873196_100000210202 [0,2,0,0,0,0|2,0,0]=4 9820 B14R1.263 CCOc1ccccc1C(=O)CCF 1458a_100000211144_100011217306 [0,2,0,0,0,0|2,0,0]=4 9821 B14R1.263 CCOc1ccccc1C(=O)CCO 1458a_100000211144_100000211926 [0,2,0,0,0,0|2,0,0]=4 9822 B14R1.263 CCOc1ccccc1C(=O)NNC 22a_100016993582_100000211144 [0,2,0,0,0,0|2,0,0]=4 9823 B14R1.263 CCOc1ccccc1C(C)OCC 7a_100000246524_100000210202 [0,2,0,0,0,0|1,0,1]=4 9824 B14R1.263 CNNC(=O)c1ccccc1COC 22a_100016993582_100000737999 [0,2,0,0,0,0|2,0,0]=4 9825 B14R1.263 COCc1ccccc1C(=O)CCF 1458a_100000737999_100011217306 [0,2,0,0,0,0|2,0,0]=4 9826 B14R1.263 COCc1ccccc1C(=O)CCO 1458a_100000737999_100000211926 [0,2,0,0,0,0|2,0,0]=4 9827 B14R1.263 O=C(CCCl)c1ccccc1OCF 7a_100009873196_100015361967 [0,2,0,0,0,0|2,0,0]=4 9828 B14R1.623 C=C(C)c1ccccc1C(=O)NCC 271570a_100000694244_200000155173 [0,2,0,0,0,0|2,0,0]=4 9829 B14R1.623 C=C(C)c1ccccc1C(=O)OCC 271570a_100000694244_100000169879 [0,2,0,0,0,0|1,0,0]=3 9830 B14R1.623 C=C(C)c1cccnc1C(=O)OCC 271570a_100000694244_100012351660 [0,2,0,0,0,0|2,0,0]=4 9831 B14R1.623 C=C(C)c1ccncc1C(=O)OCC 271570a_100000694244_100016987518 [0,2,0,0,0,0|2,0,0]=4 9832 B14R1.623 C=C(C)c1cnccc1C(=O)OCC 271570a_100000694244_100010238393 [0,2,0,0,0,0|2,0,0]=4 9833 B14R1.623 C=C(C)c1ncccc1C(=O)OCC 271570a_100000694244_100000170124 [0,2,0,0,0,0|2,0,0]=4 9834 B14R1.623 CCCC(=O)c1ccccc1C(C)C 1458a_100011941426_100000210303 [0,2,0,0,0,0|2,0,0]=4 9835 B14R1.623 CCCC(=O)c1ccccc1C(F)F 1458a_100009872251_100000210303 [0,2,0,0,0,0|2,0,0]=4 9836 B14R1.623 CCCC(=O)c1ccccc1I(=O)=O 1458a_100000061294_100000210303 [0,2,0,0,0,0|1,0,1]=4 9837 B14R1.623 CCCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000210303 [0,2,0,0,0,0|2,0,0]=4 9838 B14R1.623 CCCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100000210303 [0,2,0,0,0,0|1,0,1]=4 9839 B14R1.623 CCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210303 [0,2,0,0,0,0|1,0,1]=4 9840 B14R1.623 CCNC(=O)c1ccccc1C(C)C 11a_100015525214_100011941426 [0,2,0,0,0,0|2,0,0]=4 9841 B14R1.623 CCNC(=O)c1ccccc1C(C)C 240690a_100015525214_100011941426 [0,2,0,0,0,0|2,0,0]=4 9842 B14R1.623 CCNC(=O)c1ccccc1C(C)C 527a_100015525214_100011941426 [0,2,0,0,0,0|2,0,0]=4 9843 B14R1.623 CCNC(=O)c1ccccc1C(F)F 11a_100015525214_100009872251 [0,2,0,0,0,0|2,0,0]=4 9844 B14R1.623 CCNC(=O)c1ccccc1C(F)F 240690a_100015525214_100009872251 [0,2,0,0,0,0|2,0,0]=4 9845 B14R1.623 CCNC(=O)c1ccccc1C(F)F 527a_100015525214_100009872251 [0,2,0,0,0,0|2,0,0]=4 9846 B14R1.623 CCNC(=O)c1ccccc1I(=O)=O 240690a_100015525214_100000061294 [0,2,0,0,0,0|1,0,1]=4 9847 B14R1.623 CCNC(=O)c1ccccc1N(C)C 11a_100015525214_100011218752 [0,2,0,0,0,0|2,0,0]=4 9848 B14R1.623 CCNC(=O)c1ccccc1N(C)C 240690a_100015525214_100011218752 [0,2,0,0,0,0|2,0,0]=4 9849 B14R1.623 CCNC(=O)c1ccccc1N(C)C 27a_100102631434_200000155173 [0,2,0,0,0,0|2,0,0]=4 9850 B14R1.623 CCNC(=O)c1ccccc1N(C)C 527a_100015525214_100011218752 [0,2,0,0,0,0|2,0,0]=4 9851 B14R1.623 CCNC(=O)c1ccccc1S(=O)C 240690a_100015525214_100000204632 [0,2,0,0,0,0|1,0,1]=4 9852 B14R1.623 CCNC(=O)c1ccccc1[N+](=O)[O-] 11a_100015525214_100000188706 [0,2,0,0,0,0|1,0,1]=4 9853 B14R1.623 CCNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100015525214_100000188706 [0,2,0,0,0,0|1,0,1]=4 9854 B14R1.623 CCNC(=O)c1ccccc1[N+](=O)[O-] 527a_100015525214_100000188706 [0,2,0,0,0,0|1,0,1]=4 9855 B14R1.623 CCOC(=O)c1ccccc1N(C)C 2230a_100160572725_200000210301 [0,2,0,0,0,0|1,0,0]=3 9856 B14R1.623 CCOC(=O)c1ccccc1N(C)C 269982a_100160572725_200000210301 [0,2,0,0,0,0|1,0,0]=3 9857 B14R1.623 CCOC(=O)c1ccccc1N(C)[13CH3] 2230a_100160572725_200025704644 [0,2,0,0,0,0|1,0,0]=3 9858 B14R1.623 CCOC(=O)c1ccccc1N(C)[13CH3] 269982a_100160572725_200025704644 [0,2,0,0,0,0|1,0,0]=3 9859 B14R1.623 CCOC(=O)c1cccnc1N(C)C 27a_100102631434_100000170124 [0,2,0,0,0,0|2,0,0]=4 9860 B14R1.623 CCOC(=O)c1cnccc1N(C)C 27a_100102631434_100016987518 [0,2,0,0,0,0|2,0,0]=4 9861 B14R1.939 C#CCCC(=O)c1ccccc1CO 1458a_100011301526_100000753159 [0,2,0,0,0,0|1,0,1]=4 9862 B14R1.939 C#CCCC(=O)c1ccccc1OC 1458a_100000185835_100000753159 [0,2,0,0,0,0|1,0,1]=4 9863 B14R1.939 C#CCNC(=O)c1ccccc1OC 11a_100000212058_100000185835 [0,2,0,0,0,0|1,0,1]=4 9864 B14R1.939 C#CCNC(=O)c1ccccc1OC 1626a_100000212058_100000185835 [0,2,0,0,0,0|1,0,1]=4 9865 B14R1.939 C#CCNC(=O)c1ccccc1OC 240690a_100000212058_100000185835 [0,2,0,0,0,0|1,0,1]=4 9866 B14R1.939 C#CCNC(=O)c1ccccc1OC 527a_100000212058_100000185835 [0,2,0,0,0,0|1,0,1]=4 9867 B14R1.939 C#Cc1ccccc1C(=O)CCCC 1458a_100011243808_100000210211 [0,2,0,0,0,0|2,0,0]=4 9868 B14R1.939 C#Cc1ccccc1C(=O)CCCF 1458a_100011243808_100011934791 [0,2,0,0,0,0|2,0,0]=4 9869 B14R1.939 C#Cc1ccccc1C(=O)CCCO 1458a_100011243808_100011215043 [0,2,0,0,0,0|2,0,0]=4 9870 B14R1.939 C#Cc1ccccc1C(=O)CCOC 1458a_100011243808_100000233755 [0,2,0,0,0,0|2,0,0]=4 9871 B14R1.939 C#Cc1ccccc1C(=O)CCSC 1458a_100011243808_100000751147 [0,2,0,0,0,0|2,0,0]=4 9872 B14R1.939 C#Cc1ccccc1C(=O)NCCC 527a_100020643023_100011243808 [0,2,0,0,0,0|2,0,0]=4 9873 B14R1.939 C#Cc1ccccc1C(=O)NCCF 527a_100000724931_100011243808 [0,2,0,0,0,0|2,0,0]=4 9874 B14R1.939 C#Cc1ccccc1C(=O)NCCO 527a_100000210304_100011243808 [0,2,0,0,0,0|2,0,0]=4 9875 B14R1.939 C#Cc1ccccc1C(=O)NNCC 22a_100000756455_100011243808 [0,2,0,0,0,0|2,0,0]=4 9876 B14R1.939 C/C=C/CC(=O)c1ccccc1CO 1458a_100011301526_100102629194 [0,2,0,0,0,0|1,0,1]=4 9877 B14R1.939 C/C=C/CC(=O)c1ccccc1OC 1458a_100000185835_100102629194 [0,2,0,0,0,0|1,0,1]=4 9878 B14R1.939 C=CCCC(=O)c1ccccc1CO 1458a_100011301526_100000754431 [0,2,0,0,0,0|1,0,1]=4 9879 B14R1.939 C=CCCC(=O)c1ccccc1OC 1458a_100000185835_100000754431 [0,2,0,0,0,0|1,0,1]=4 9880 B14R1.939 C=CCNC(=O)c1ccccc1OC 1626a_100020586998_100000185835 [0,2,0,0,0,0|1,0,1]=4 9881 B14R1.939 C=CCNC(=O)c1ccccc1OC 240690a_100020586998_100000185835 [0,2,0,0,0,0|1,0,1]=4 9882 B14R1.939 C=CCNC(=O)c1ccccc1OC 527a_100020586998_100000185835 [0,2,0,0,0,0|1,0,1]=4 9883 B14R1.939 C=Cc1ccccc1C(=O)CCCC 1458a_100011830265_100000210211 [0,2,0,0,0,0|2,0,0]=4 9884 B14R1.939 C=Cc1ccccc1C(=O)CCCF 1458a_100011830265_100011934791 [0,2,0,0,0,0|2,0,0]=4 9885 B14R1.939 C=Cc1ccccc1C(=O)CCCO 1458a_100011830265_100011215043 [0,2,0,0,0,0|2,0,0]=4 9886 B14R1.939 C=Cc1ccccc1C(=O)CCOC 1458a_100011830265_100000233755 [0,2,0,0,0,0|2,0,0]=4 9887 B14R1.939 C=Cc1ccccc1C(=O)CCSC 1458a_100011830265_100000751147 [0,2,0,0,0,0|2,0,0]=4 9888 B14R1.939 C=Cc1ccccc1C(=O)NCCC 1626a_100020643023_100011830265 [0,2,0,0,0,0|2,0,0]=4 9889 B14R1.939 C=Cc1ccccc1C(=O)NCCC 271570a_100011290941_200000152266 [0,2,0,0,0,0|2,0,0]=4 9890 B14R1.939 C=Cc1ccccc1C(=O)NCCF 1626a_100000724931_100011830265 [0,2,0,0,0,0|2,0,0]=4 9891 B14R1.939 C=Cc1ccccc1C(=O)NCCO 271570a_100011290941_200000158863 [0,2,0,0,0,0|2,0,0]=4 9892 B14R1.939 C=Cc1ccccc1C(=O)NNCC 22a_100000756455_100011830265 [0,2,0,0,0,0|2,0,0]=4 9893 B14R1.939 CC#CCC(=O)c1ccccc1CO 1458a_100011301526_100000748600 [0,2,0,0,0,0|1,0,1]=4 9894 B14R1.939 CC#CCC(=O)c1ccccc1OC 1458a_100000185835_100000748600 [0,2,0,0,0,0|1,0,1]=4 9895 B14R1.939 CC=CCC(=O)c1ccccc1CO 1458a_100011301526_100000070051 [0,2,0,0,0,0|1,0,1]=4 9896 B14R1.939 CC=CCC(=O)c1ccccc1OC 1458a_100000185835_100000070051 [0,2,0,0,0,0|1,0,1]=4 9897 B14R1.939 CC=NNC(=O)c1ccccc1OC 4a_100000189102_200000210099 [0,2,0,0,0,0|1,0,1]=4 9898 B14R1.939 CCCCC(=O)c1ccccc1C#N 1458a_100000742908_100000210211 [0,2,0,0,0,0|2,0,0]=4 9899 B14R1.939 CCCCC(=O)c1ccccc1CC 1458a_100000689120_100000210211 [0,2,0,0,0,0|2,0,0]=4 9900 B14R1.939 CCCCC(=O)c1ccccc1CO 1458a_100011301526_100000210211 [0,2,0,0,0,0|1,0,0]=3 9901 B14R1.939 CCCCC(=O)c1ccccc1I=O 1458a_100000032414_100000210211 [0,2,0,0,0,0|1,0,1]=4 9902 B14R1.939 CCCCC(=O)c1ccccc1OC 1458a_100000185835_100000210211 [0,2,0,0,0,0|1,0,0]=3 9903 B14R1.939 CCCCC(=O)c1ccccc1SC 1458a_100000183967_100000210211 [0,2,0,0,0,0|1,1,0]=4 9904 B14R1.939 CCCNC(=O)c1ccccc1C#N 11a_100020643023_100000742908 [0,2,0,0,0,0|2,0,0]=4 9905 B14R1.939 CCCNC(=O)c1ccccc1C#N 1626a_100020643023_100000742908 [0,2,0,0,0,0|2,0,0]=4 9906 B14R1.939 CCCNC(=O)c1ccccc1C#N 527a_100020643023_100000742908 [0,2,0,0,0,0|2,0,0]=4 9907 B14R1.939 CCCNC(=O)c1ccccc1CC 11a_100020643023_100000689120 [0,2,0,0,0,0|2,0,0]=4 9908 B14R1.939 CCCNC(=O)c1ccccc1CC 1626a_100020643023_100000689120 [0,2,0,0,0,0|2,0,0]=4 9909 B14R1.939 CCCNC(=O)c1ccccc1CC 240690a_100020643023_100000689120 [0,2,0,0,0,0|2,0,0]=4 9910 B14R1.939 CCCNC(=O)c1ccccc1CC 527a_100020643023_100000689120 [0,2,0,0,0,0|2,0,0]=4 9911 B14R1.939 CCCNC(=O)c1ccccc1I=O 1626a_100020643023_100000032414 [0,2,0,0,0,0|1,0,1]=4 9912 B14R1.939 CCCNC(=O)c1ccccc1I=O 240690a_100020643023_100000032414 [0,2,0,0,0,0|1,0,1]=4 9913 B14R1.939 CCCNC(=O)c1ccccc1I=O 527a_100020643023_100000032414 [0,2,0,0,0,0|1,0,1]=4 9914 B14R1.939 CCCNC(=O)c1ccccc1NC 27a_100102657272_200000152266 [0,2,0,0,0,0|2,0,0]=4 9915 B14R1.939 CCCNC(=O)c1ccccc1NC 34a_100000181257_200000210301 [0,2,0,0,0,0|2,0,0]=4 9916 B14R1.939 CCCNC(=O)c1ccccc1N[13CH3] 34a_100000181257_200025704644 [0,2,0,0,0,0|2,0,0]=4 9917 B14R1.939 CCCNC(=O)c1ccccc1OC 11a_100020643023_100000185835 [0,2,0,0,0,0|1,0,0]=3 9918 B14R1.939 CCCNC(=O)c1ccccc1OC 1626a_100020643023_100000185835 [0,2,0,0,0,0|1,0,0]=3 9919 B14R1.939 CCCNC(=O)c1ccccc1OC 240690a_100020643023_100000185835 [0,2,0,0,0,0|1,0,0]=3 9920 B14R1.939 CCCNC(=O)c1ccccc1OC 527a_100020643023_100000185835 [0,2,0,0,0,0|1,0,0]=3 9921 B14R1.939 CCCNC(=O)c1ccccc1SC 11a_100020643023_100000183967 [0,2,0,0,0,0|1,1,0]=4 9922 B14R1.939 CCCNC(=O)c1ccccc1SC 1626a_100020643023_100000183967 [0,2,0,0,0,0|1,1,0]=4 9923 B14R1.939 CCCNC(=O)c1ccccc1SC 240690a_100020643023_100000183967 [0,2,0,0,0,0|1,1,0]=4 9924 B14R1.939 CCCNC(=O)c1ccccc1SC 527a_100020643023_100000183967 [0,2,0,0,0,0|1,1,0]=4 9925 B14R1.939 CCCNC(=O)c1ccccc1SC 62a_200000152266_200000210301 [0,2,0,0,0,0|1,1,0]=4 9926 B14R1.939 CCCNC(=O)c1ccccc1SC 62a_200000210301_200000152266 [0,2,0,0,0,0|1,1,0]=4 9927 B14R1.939 CCCNC(=O)c1ccccc1S[13CH3] 62a_200000152266_200025704644 [0,2,0,0,0,0|1,1,0]=4 9928 B14R1.939 CCCNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000152266 [0,2,0,0,0,0|1,1,0]=4 9929 B14R1.939 CCCOC(=O)c1ccccc1OC 7a_100000169924_200000210301 [0,2,0,0,0,0|0,0,0]=2 9930 B14R1.939 CCCOC(=O)c1ccccc1O[13CH3] 7a_100000169924_200025704644 [0,2,0,0,0,0|0,0,0]=2 9931 B14R1.939 CCCOC(C)c1ccccc1OC 7a_100000742714_100000210303 [0,2,0,0,0,0|1,0,1]=4 9932 B14R1.939 CCNN=C(C)c1ccccc1OC 4a_100000756455_100000173324 [0,2,0,0,0,0|2,0,0]=4 9933 B14R1.939 CCNNC(=O)c1ccccc1C#N 22a_100000756455_100000742908 [0,2,0,0,0,0|2,0,0]=4 9934 B14R1.939 CCNNC(=O)c1ccccc1CC 22a_100000756455_100000689120 [0,2,0,0,0,0|2,0,0]=4 9935 B14R1.939 CCNNC(=O)c1ccccc1I=O 22a_100000756455_100000032414 [0,2,0,0,0,0|1,0,1]=4 9936 B14R1.939 CCNNC(=O)c1ccccc1OC 22a_100000756455_100000185835 [0,2,0,0,0,0|1,0,0]=3 9937 B14R1.939 CCNNC(=O)c1ccccc1SC 22a_100000756455_100000183967 [0,2,0,0,0,0|1,1,0]=4 9938 B14R1.939 CCOCC(=O)c1ccccc1OC 34a_100121572206_100000195505 [0,2,0,0,0,0|0,0,0]=2 9939 B14R1.939 CCOCC(N)c1ccccc1OC 34a_100000756845_100000210202 [0,2,0,0,0,0|1,0,1]=4 9940 B14R1.939 CCOCN(C)c1ccccc1OC 269982a_100000219746_100000739092 [0,2,0,0,0,0|2,0,0]=4 9941 B14R1.939 CCSCC(=O)c1ccccc1OC 62a_100000195505_100000210202 [0,2,0,0,0,0|0,1,0]=3 9942 B14R1.939 CCc1ccccc1C(=O)CCCF 1458a_100000689120_100011934791 [0,2,0,0,0,0|2,0,0]=4 9943 B14R1.939 CCc1ccccc1C(=O)CCCO 1458a_100000689120_100011215043 [0,2,0,0,0,0|2,0,0]=4 9944 B14R1.939 CCc1ccccc1C(=O)CCOC 1458a_100000689120_100000233755 [0,2,0,0,0,0|2,0,0]=4 9945 B14R1.939 CCc1ccccc1C(=O)CCSC 1458a_100000689120_100000751147 [0,2,0,0,0,0|2,0,0]=4 9946 B14R1.939 CCc1ccccc1C(=O)NCCF 11a_100000724931_100000689120 [0,2,0,0,0,0|2,0,0]=4 9947 B14R1.939 CCc1ccccc1C(=O)NCCF 1626a_100000724931_100000689120 [0,2,0,0,0,0|2,0,0]=4 9948 B14R1.939 CCc1ccccc1C(=O)NCCF 240690a_100000724931_100000689120 [0,2,0,0,0,0|2,0,0]=4 9949 B14R1.939 CCc1ccccc1C(=O)NCCF 527a_100000724931_100000689120 [0,2,0,0,0,0|2,0,0]=4 9950 B14R1.939 CCc1ccccc1C(=O)NCCO 240690a_100000210304_100000689120 [0,2,0,0,0,0|2,0,0]=4 9951 B14R1.939 CCc1ccccc1C(=O)NCCO 527a_100000210304_100000689120 [0,2,0,0,0,0|2,0,0]=4 9952 B14R1.939 CNc1ccccc1C(=O)NCCO 27a_100102657272_200000158863 [0,2,0,0,0,0|2,0,0]=4 9953 B14R1.939 COCCC(=O)c1ccccc1C#N 1458a_100000742908_100000233755 [0,2,0,0,0,0|2,0,0]=4 9954 B14R1.939 COCCC(=O)c1ccccc1CO 1458a_100011301526_100000233755 [0,2,0,0,0,0|1,0,0]=3 9955 B14R1.939 COCCC(=O)c1ccccc1I=O 1458a_100000032414_100000233755 [0,2,0,0,0,0|1,0,1]=4 9956 B14R1.939 COCCC(=O)c1ccccc1OC 1458a_100000185835_100000233755 [0,2,0,0,0,0|1,0,0]=3 9957 B14R1.939 COCCC(=O)c1ccccc1SC 1458a_100000183967_100000233755 [0,2,0,0,0,0|1,1,0]=4 9958 B14R1.939 COc1ccccc1C(=O)CCC#N 1458a_100000185835_100011215226 [0,2,0,0,0,0|1,0,1]=4 9959 B14R1.939 COc1ccccc1C(=O)CCCF 1458a_100000185835_100011934791 [0,2,0,0,0,0|1,0,0]=3 9960 B14R1.939 COc1ccccc1C(=O)CCCO 1458a_100000185835_100011215043 [0,2,0,0,0,0|1,0,0]=3 9961 B14R1.939 COc1ccccc1C(=O)CCSC 1458a_100000185835_100000751147 [0,2,0,0,0,0|1,0,0]=3 9962 B14R1.939 COc1ccccc1C(=O)CSCF 62a_100000195505_100015361967 [0,2,0,0,0,0|1,1,0]=4 9963 B14R1.939 COc1ccccc1C(=O)NCC#N 1626a_100000734998_100000185835 [0,2,0,0,0,0|1,0,1]=4 9964 B14R1.939 COc1ccccc1C(=O)NCC#N 527a_100000734998_100000185835 [0,2,0,0,0,0|1,0,1]=4 9965 B14R1.939 COc1ccccc1C(=O)NCCF 11a_100000724931_100000185835 [0,2,0,0,0,0|1,0,0]=3 9966 B14R1.939 COc1ccccc1C(=O)NCCF 1626a_100000724931_100000185835 [0,2,0,0,0,0|1,0,0]=3 9967 B14R1.939 COc1ccccc1C(=O)NCCF 240690a_100000724931_100000185835 [0,2,0,0,0,0|1,0,0]=3 9968 B14R1.939 COc1ccccc1C(=O)NCCF 527a_100000724931_100000185835 [0,2,0,0,0,0|1,0,0]=3 9969 B14R1.939 COc1ccccc1C(=O)NCCO 240690a_100000210304_100000185835 [0,2,0,0,0,0|1,0,0]=3 9970 B14R1.939 COc1ccccc1C(=O)NCCO 527a_100000210304_100000185835 [0,2,0,0,0,0|1,0,0]=3 9971 B14R1.939 COc1ccccc1C(=O)OCCO 7a_100000229999_200000210301 [0,2,0,0,0,0|0,0,0]=2 9972 B14R1.939 COc1ccccc1C(C)OCCF 7a_100000742714_100011217306 [0,2,0,0,0,0|1,0,1]=4 9973 B14R1.939 COc1ccccc1C(C)OCCO 7a_100000742714_100000211926 [0,2,0,0,0,0|1,0,1]=4 9974 B14R1.939 CSCCC(=O)c1ccccc1C#N 1458a_100000742908_100000751147 [0,2,0,0,0,0|2,0,0]=4 9975 B14R1.939 CSCCC(=O)c1ccccc1CO 1458a_100011301526_100000751147 [0,2,0,0,0,0|1,0,0]=3 9976 B14R1.939 CSCCC(=O)c1ccccc1I=O 1458a_100000032414_100000751147 [0,2,0,0,0,0|1,0,1]=4 9977 B14R1.939 CSCCC(=O)c1ccccc1SC 1458a_100000183967_100000751147 [0,2,0,0,0,0|1,1,0]=4 9978 B14R1.939 CSc1ccccc1C(=O)CCCF 1458a_100000183967_100011934791 [0,2,0,0,0,0|1,1,0]=4 9979 B14R1.939 CSc1ccccc1C(=O)CCCO 1458a_100000183967_100011215043 [0,2,0,0,0,0|1,1,0]=4 9980 B14R1.939 CSc1ccccc1C(=O)NCCF 11a_100000724931_100000183967 [0,2,0,0,0,0|1,1,0]=4 9981 B14R1.939 CSc1ccccc1C(=O)NCCF 1626a_100000724931_100000183967 [0,2,0,0,0,0|1,1,0]=4 9982 B14R1.939 CSc1ccccc1C(=O)NCCF 240690a_100000724931_100000183967 [0,2,0,0,0,0|1,1,0]=4 9983 B14R1.939 CSc1ccccc1C(=O)NCCF 527a_100000724931_100000183967 [0,2,0,0,0,0|1,1,0]=4 9984 B14R1.939 CSc1ccccc1C(=O)NCCO 240690a_100000210304_100000183967 [0,2,0,0,0,0|1,1,0]=4 9985 B14R1.939 CSc1ccccc1C(=O)NCCO 527a_100000210304_100000183967 [0,2,0,0,0,0|1,1,0]=4 9986 B14R1.939 CSc1ccccc1C(=O)NCCO 62a_200000158863_200000210301 [0,2,0,0,0,0|1,1,0]=4 9987 B14R1.939 CSc1ccccc1C(=O)NCCO 62a_200000210301_200000158863 [0,2,0,0,0,0|1,1,0]=4 9988 B14R1.939 N#CCCC(=O)c1ccccc1CO 1458a_100011301526_100011215226 [0,2,0,0,0,0|1,0,1]=4 9989 B14R1.939 N#Cc1ccccc1C(=O)CCCF 1458a_100000742908_100011934791 [0,2,0,0,0,0|2,0,0]=4 9990 B14R1.939 N#Cc1ccccc1C(=O)CCCO 1458a_100000742908_100011215043 [0,2,0,0,0,0|2,0,0]=4 9991 B14R1.939 N#Cc1ccccc1C(=O)NCCF 11a_100000724931_100000742908 [0,2,0,0,0,0|2,0,0]=4 9992 B14R1.939 N#Cc1ccccc1C(=O)NCCF 1626a_100000724931_100000742908 [0,2,0,0,0,0|2,0,0]=4 9993 B14R1.939 N#Cc1ccccc1C(=O)NCCF 527a_100000724931_100000742908 [0,2,0,0,0,0|2,0,0]=4 9994 B14R1.939 N#Cc1ccccc1C(=O)NCCO 527a_100000210304_100000742908 [0,2,0,0,0,0|2,0,0]=4 9995 B14R1.939 O=C(CCCF)c1ccccc1CO 1458a_100011301526_100011934791 [0,2,0,0,0,0|1,0,0]=3 9996 B14R1.939 O=C(CCCO)c1ccccc1CO 1458a_100011301526_100011215043 [0,2,0,0,0,0|1,0,0]=3 9997 B14R1.939 O=Ic1ccccc1C(=O)CCCF 1458a_100000032414_100011934791 [0,2,0,0,0,0|1,0,1]=4 9998 B14R1.939 O=Ic1ccccc1C(=O)CCCO 1458a_100000032414_100011215043 [0,2,0,0,0,0|1,0,1]=4 9999 B14R1.939 O=Ic1ccccc1C(=O)NCCF 1626a_100000724931_100000032414 [0,2,0,0,0,0|1,0,1]=4 10000 B14R1.939 O=Ic1ccccc1C(=O)NCCF 240690a_100000724931_100000032414 [0,2,0,0,0,0|1,0,1]=4 10001 B14R1.939 O=Ic1ccccc1C(=O)NCCF 527a_100000724931_100000032414 [0,2,0,0,0,0|1,0,1]=4 10002 B14R1.939 O=Ic1ccccc1C(=O)NCCO 240690a_100000210304_100000032414 [0,2,0,0,0,0|1,0,1]=4 10003 B14R1.939 O=Ic1ccccc1C(=O)NCCO 527a_100000210304_100000032414 [0,2,0,0,0,0|1,0,1]=4 10004 B14R1.939 [13CH3]Oc1ccccc1C(=O)OCCO 7a_100000229999_200025704644 [0,2,0,0,0,0|0,0,0]=2 10005 B14R1.939 [13CH3]Sc1ccccc1C(=O)NCCO 62a_200000158863_200025704644 [0,2,0,0,0,0|1,1,0]=4 10006 B14R1.939 [13CH3]Sc1ccccc1C(=O)NCCO 62a_200025704644_200000158863 [0,2,0,0,0,0|1,1,0]=4 10007 B14R1.3188 CCNS(=O)(=O)c1ccccc1OC 270084a_100015525214_100000183792 [0,2,0,0,0,0|2,0,0]=4 10008 B14R1.3188 CCNS(=O)(=O)c1ccccc1OC 274078a_100015525214_100000183792 [0,2,0,0,0,0|2,0,0]=4 10009 B14R1.7233 C=Cc1cc(ccc1C(=O)NCC)F 271570a_100011290941_100000203945 [0,2,0,0,0,0|2,0,0]=4 10010 B14R1.7233 C=Cc1cc(ccc1C(=O)OCC)C 271570a_100011290941_200012185120 [0,2,0,0,0,0|1,0,0]=3 10011 B14R1.7233 C=Cc1cc(ccc1C(=O)OCC)Cl 271570a_100011290941_100000047509 [0,2,0,0,0,0|1,0,0]=3 10012 B14R1.7233 C=Cc1cc(ccc1C(=O)OCC)F 271570a_100011290941_100011206307 [0,2,0,0,0,0|1,0,0]=3 10013 B14R1.7233 CCCC(=O)c1ccc(cc1C#N)Br 1458a_100012349539_100000210303 [0,2,0,0,0,0|2,0,0]=4 10014 B14R1.7233 CCCC(=O)c1ccc(cc1C#N)C 1458a_200012184421_100000210303 [0,2,0,0,0,0|2,0,0]=4 10015 B14R1.7233 CCCC(=O)c1ccc(cc1C#N)F 1458a_100012002388_100000210303 [0,2,0,0,0,0|2,0,0]=4 10016 B14R1.7233 CCCC(=O)c1ccc(cc1CC)Br 1458a_200012349896_100000210303 [0,2,0,0,0,0|2,0,0]=4 10017 B14R1.7233 CCCC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100000210303 [0,2,0,0,0,0|1,0,0]=3 10018 B14R1.7233 CCCC(=O)c1ccc(cc1CO)F 1458a_100013035055_100000210303 [0,2,0,0,0,0|1,0,0]=3 10019 B14R1.7233 CCCC(=O)c1ccc(cc1OC)Br 1458a_100000748230_100000210303 [0,2,0,0,0,0|1,0,0]=3 10020 B14R1.7233 CCCC(=O)c1ccc(cc1OC)C 1458a_100000217210_100000210303 [0,2,0,0,0,0|1,0,0]=3 10021 B14R1.7233 CCCC(=O)c1ccc(cc1OC)Cl 1458a_100000217211_100000210303 [0,2,0,0,0,0|1,0,0]=3 10022 B14R1.7233 CCCC(=O)c1ccc(cc1OC)F 1458a_100000239970_100000210303 [0,2,0,0,0,0|1,0,0]=3 10023 B14R1.7233 CCCC(=O)c1ccc(cc1OC)I 1458a_100012353712_100000210303 [0,2,0,0,0,0|1,0,0]=3 10024 B14R1.7233 CCNC(=O)c1ccc(cc1C#N)Br 11a_100015525214_100012349539 [0,2,0,0,0,0|2,0,0]=4 10025 B14R1.7233 CCNC(=O)c1ccc(cc1C#N)Br 240690a_100015525214_100012349539 [0,2,0,0,0,0|2,0,0]=4 10026 B14R1.7233 CCNC(=O)c1ccc(cc1C#N)C 240690a_100015525214_200012184421 [0,2,0,0,0,0|2,0,0]=4 10027 B14R1.7233 CCNC(=O)c1ccc(cc1C#N)C 527a_100015525214_200012184421 [0,2,0,0,0,0|2,0,0]=4 10028 B14R1.7233 CCNC(=O)c1ccc(cc1C#N)F 11a_100015525214_100012002388 [0,2,0,0,0,0|2,0,0]=4 10029 B14R1.7233 CCNC(=O)c1ccc(cc1CC)Br 11a_100015525214_200012349896 [0,2,0,0,0,0|2,0,0]=4 10030 B14R1.7233 CCNC(=O)c1ccc(cc1CC)Br 240690a_100015525214_200012349896 [0,2,0,0,0,0|2,0,0]=4 10031 B14R1.7233 CCNC(=O)c1ccc(cc1CC)Br 527a_100015525214_200012349896 [0,2,0,0,0,0|2,0,0]=4 10032 B14R1.7233 CCNC(=O)c1ccc(cc1CO)F 240690a_100015525214_100013035055 [0,2,0,0,0,0|1,0,0]=3 10033 B14R1.7233 CCNC(=O)c1ccc(cc1NC)F 27a_100102657272_100000203945 [0,2,0,0,0,0|2,0,0]=4 10034 B14R1.7233 CCNC(=O)c1ccc(cc1OC)Br 11a_100015525214_100000748230 [0,2,0,0,0,0|1,0,0]=3 10035 B14R1.7233 CCNC(=O)c1ccc(cc1OC)Br 240690a_100015525214_100000748230 [0,2,0,0,0,0|1,0,0]=3 10036 B14R1.7233 CCNC(=O)c1ccc(cc1OC)Br 527a_100015525214_100000748230 [0,2,0,0,0,0|1,0,0]=3 10037 B14R1.7233 CCNC(=O)c1ccc(cc1OC)C 11a_100015525214_100000217210 [0,2,0,0,0,0|1,0,0]=3 10038 B14R1.7233 CCNC(=O)c1ccc(cc1OC)C 240690a_100015525214_100000217210 [0,2,0,0,0,0|1,0,0]=3 10039 B14R1.7233 CCNC(=O)c1ccc(cc1OC)C 527a_100015525214_100000217210 [0,2,0,0,0,0|1,0,0]=3 10040 B14R1.7233 CCNC(=O)c1ccc(cc1OC)Cl 11a_100015525214_100000217211 [0,2,0,0,0,0|1,0,0]=3 10041 B14R1.7233 CCNC(=O)c1ccc(cc1OC)Cl 240690a_100015525214_100000217211 [0,2,0,0,0,0|1,0,0]=3 10042 B14R1.7233 CCNC(=O)c1ccc(cc1OC)Cl 527a_100015525214_100000217211 [0,2,0,0,0,0|1,0,0]=3 10043 B14R1.7233 CCNC(=O)c1ccc(cc1OC)F 11a_100015525214_100000239970 [0,2,0,0,0,0|1,0,0]=3 10044 B14R1.7233 CCNC(=O)c1ccc(cc1OC)F 240690a_100015525214_100000239970 [0,2,0,0,0,0|1,0,0]=3 10045 B14R1.7233 CCNC(=O)c1ccc(cc1OC)F 527a_100015525214_100000239970 [0,2,0,0,0,0|1,0,0]=3 10046 B14R1.7233 CCNC(=O)c1ccc(cc1OC)I 11a_100015525214_100012353712 [0,2,0,0,0,0|1,0,0]=3 10047 B14R1.7233 CCNC(=O)c1ccc(cc1OC)I 240690a_100015525214_100012353712 [0,2,0,0,0,0|1,0,0]=3 10048 B14R1.7233 CCNC(=O)c1ccc(cc1OC)I 527a_100015525214_100012353712 [0,2,0,0,0,0|1,0,0]=3 10049 B14R1.7233 CCNC(=O)c1ccc(cc1OC)O 271570a_203496583355_200011638406 [0,2,0,0,0,0|1,0,0]=3 10050 B14R1.7233 CCNC(=O)c1ccc(cc1SC)F 62a_100000203945_200000210301 [0,2,0,0,0,0|1,1,0]=4 10051 B14R1.7233 CCNC(=O)c1ccc(cc1SC)F 62a_200000210301_100000203945 [0,2,0,0,0,0|1,1,0]=4 10052 B14R1.7233 CCNC(=O)c1ccc(cc1S[13CH3])F 62a_100000203945_200025704644 [0,2,0,0,0,0|1,1,0]=4 10053 B14R1.7233 CCNC(=O)c1ccc(cc1S[13CH3])F 62a_200025704644_100000203945 [0,2,0,0,0,0|1,1,0]=4 10054 B14R1.7233 CCOC(=O)c1ccc(cc1NC)F 27a_100102657272_100011206307 [0,2,0,0,0,0|1,0,0]=3 10055 B14R1.7233 CCOC(=O)c1ccc(cc1OC)C 7a_200000170860_200000210301 [0,2,0,0,0,0|0,0,0]=2 10056 B14R1.7233 CCOC(=O)c1ccc(cc1OC)F 7a_100011997398_200000210301 [0,2,0,0,0,0|0,0,0]=2 10057 B14R1.7233 CCOC(=O)c1ccc(cc1O[13CH3])C 7a_200000170860_200025704644 [0,2,0,0,0,0|0,0,0]=2 10058 B14R1.7233 CCOC(=O)c1ccc(cc1O[13CH3])F 7a_100011997398_200025704644 [0,2,0,0,0,0|0,0,0]=2 10059 B14R1.7233 CCOC(=O)c1ccc(cc1SC)C 62a_200000210301_200012185120 [0,2,0,0,0,0|0,1,0]=3 10060 B14R1.7233 CCOC(=O)c1ccc(cc1SC)C 62a_200012350802_200000210301 [0,2,0,0,0,0|0,1,0]=3 10061 B14R1.7233 CCOC(=O)c1ccc(cc1SC)Cl 62a_100000047509_200000210301 [0,2,0,0,0,0|0,1,0]=3 10062 B14R1.7233 CCOC(=O)c1ccc(cc1SC)Cl 62a_200000210301_100000047509 [0,2,0,0,0,0|0,1,0]=3 10063 B14R1.7233 CCOC(=O)c1ccc(cc1SC)F 62a_100011206307_200000210301 [0,2,0,0,0,0|0,1,0]=3 10064 B14R1.7233 CCOC(=O)c1ccc(cc1SC)F 62a_200000210301_100011206307 [0,2,0,0,0,0|0,1,0]=3 10065 B14R1.7233 CCOC(=O)c1ccc(cc1S[13CH3])C 62a_200012350802_200025704644 [0,2,0,0,0,0|0,1,0]=3 10066 B14R1.7233 CCOC(=O)c1ccc(cc1S[13CH3])C 62a_200025704644_200012185120 [0,2,0,0,0,0|0,1,0]=3 10067 B14R1.7233 CCOC(=O)c1ccc(cc1S[13CH3])Cl 62a_100000047509_200025704644 [0,2,0,0,0,0|0,1,0]=3 10068 B14R1.7233 CCOC(=O)c1ccc(cc1S[13CH3])Cl 62a_200025704644_100000047509 [0,2,0,0,0,0|0,1,0]=3 10069 B14R1.7233 CCOC(=O)c1ccc(cc1S[13CH3])F 62a_100011206307_200025704644 [0,2,0,0,0,0|0,1,0]=3 10070 B14R1.7233 CCOC(=O)c1ccc(cc1S[13CH3])F 62a_200025704644_100011206307 [0,2,0,0,0,0|0,1,0]=3 10071 B14R1.7233 CCOC(=O)c1ncc(cc1OC)Br 7a_100016103240_200000210301 [0,2,0,0,0,0|1,0,0]=3 10072 B14R1.7233 CCOC(=O)c1ncc(cc1O[13CH3])Br 7a_100016103240_200025704644 [0,2,0,0,0,0|1,0,0]=3 10073 B14R1.7233 CNCC(=O)c1ccc(cc1OC)Cl 7a_106832991635_100012344415 [0,2,0,0,0,0|2,0,0]=4 10074 B14R1.7233 CNNC(=O)c1ccc(cc1CO)Br 22a_100016993582_100010253900 [0,2,0,0,0,0|2,0,0]=4 10075 B14R1.7233 CNNC(=O)c1ccc(cc1OC)Br 22a_100016993582_100000748230 [0,2,0,0,0,0|2,0,0]=4 10076 B14R1.7233 CNNC(=O)c1ccc(cc1OC)C 22a_100016993582_100000217210 [0,2,0,0,0,0|2,0,0]=4 10077 B14R1.7233 CNNC(=O)c1ccc(cc1OC)Cl 22a_100016993582_100000217211 [0,2,0,0,0,0|2,0,0]=4 10078 B14R1.7233 CNNC(=O)c1ccc(cc1OC)F 22a_100016993582_100000239970 [0,2,0,0,0,0|2,0,0]=4 10079 B14R1.7233 CNNC(=O)c1ccc(cc1OC)I 22a_100016993582_100012353712 [0,2,0,0,0,0|2,0,0]=4 10080 B14R1.7233 COc1cc(ccc1C(=O)CCF)Br 1458a_100000748230_100011217306 [0,2,0,0,0,0|2,0,0]=4 10081 B14R1.7233 COc1cc(ccc1C(=O)CCF)C 1458a_100000217210_100011217306 [0,2,0,0,0,0|2,0,0]=4 10082 B14R1.7233 COc1cc(ccc1C(=O)CCF)Cl 1458a_100000217211_100011217306 [0,2,0,0,0,0|2,0,0]=4 10083 B14R1.7233 COc1cc(ccc1C(=O)CCF)F 1458a_100000239970_100011217306 [0,2,0,0,0,0|2,0,0]=4 10084 B14R1.7233 COc1cc(ccc1C(=O)CCF)I 1458a_100012353712_100011217306 [0,2,0,0,0,0|2,0,0]=4 10085 B14R1.7233 COc1cc(ccc1C(=O)CCO)Br 1458a_100000748230_100000211926 [0,2,0,0,0,0|2,0,0]=4 10086 B14R1.7233 COc1cc(ccc1C(=O)CCO)C 1458a_100000217210_100000211926 [0,2,0,0,0,0|2,0,0]=4 10087 B14R1.7233 COc1cc(ccc1C(=O)CCO)Cl 1458a_100000217211_100000211926 [0,2,0,0,0,0|2,0,0]=4 10088 B14R1.7233 COc1cc(ccc1C(=O)CCO)F 1458a_100000239970_100000211926 [0,2,0,0,0,0|2,0,0]=4 10089 B14R1.7233 COc1cc(ccc1C(=O)CCO)I 1458a_100012353712_100000211926 [0,2,0,0,0,0|2,0,0]=4 10090 B14R1.7233 COc1cc(ccc1C(=O)CSC)Cl 62a_100012344415_200000210301 [0,2,0,0,0,0|2,0,0]=4 10091 B14R1.7233 COc1cc(ccc1C(=O)CS[13CH3])Cl 62a_100012344415_200025704644 [0,2,0,0,0,0|2,0,0]=4 10092 B14R1.7233 O=C(CCF)c1ccc(cc1CO)Br 1458a_100010253900_100011217306 [0,2,0,0,0,0|2,0,0]=4 10093 B14R1.7233 O=C(CCF)c1ccc(cc1CO)F 1458a_100013035055_100011217306 [0,2,0,0,0,0|2,0,0]=4 10094 B14R1.7233 O=C(CCO)c1ccc(cc1CO)Br 1458a_100010253900_100000211926 [0,2,0,0,0,0|2,0,0]=4 10095 B14R1.7233 O=C(CCO)c1ccc(cc1CO)F 1458a_100013035055_100000211926 [0,2,0,0,0,0|2,0,0]=4 10096 B14R1.7276 C=Cc1cccc(c1C(=O)OCC)F 271570a_100011290941_100012357633 [0,2,0,0,0,0|1,0,0]=3 10097 B14R1.7276 C=Cc1nccc(c1C(=O)OCC)C 271570a_100011290941_100010068243 [0,2,0,0,0,0|2,0,0]=4 10098 B14R1.7276 CCCC(=O)c1c(cccc1C#N)Br 1458a_200010145881_100000210303 [0,2,0,0,0,0|2,0,0]=4 10099 B14R1.7276 CCCC(=O)c1c(cccc1OC)Br 1458a_100011593405_100000210303 [0,2,0,0,0,0|1,0,0]=3 10100 B14R1.7276 CCCC(=O)c1c(cccc1OC)C 1458a_100000066212_100000210303 [0,2,0,0,0,0|1,0,0]=3 10101 B14R1.7276 CCCC(=O)c1c(cccc1OC)Cl 1458a_100000743539_100000210303 [0,2,0,0,0,0|1,0,0]=3 10102 B14R1.7276 CCCC(=O)c1c(cccc1OC)F 1458a_100000759380_100000210303 [0,2,0,0,0,0|1,0,0]=3 10103 B14R1.7276 CCCC(=O)c1c(cccc1OC)I 1458a_100010179659_100000210303 [0,2,0,0,0,0|1,0,0]=3 10104 B14R1.7276 CCCC(=O)c1c(cccc1OC)O 1458a_100000043310_100000210303 [0,2,0,0,0,0|1,0,0]=3 10105 B14R1.7276 CCNC(=O)c1c(cccc1C#N)Br 240690a_100015525214_200010145881 [0,2,0,0,0,0|2,0,0]=4 10106 B14R1.7276 CCNC(=O)c1c(cccc1OC)Br 11a_100015525214_100011593405 [0,2,0,0,0,0|1,0,0]=3 10107 B14R1.7276 CCNC(=O)c1c(cccc1OC)Br 240690a_100015525214_100011593405 [0,2,0,0,0,0|1,0,0]=3 10108 B14R1.7276 CCNC(=O)c1c(cccc1OC)Br 527a_100015525214_100011593405 [0,2,0,0,0,0|1,0,0]=3 10109 B14R1.7276 CCNC(=O)c1c(cccc1OC)C 11a_100015525214_100000066212 [0,2,0,0,0,0|1,0,0]=3 10110 B14R1.7276 CCNC(=O)c1c(cccc1OC)C 240690a_100015525214_100000066212 [0,2,0,0,0,0|1,0,0]=3 10111 B14R1.7276 CCNC(=O)c1c(cccc1OC)Cl 11a_100015525214_100000743539 [0,2,0,0,0,0|1,0,0]=3 10112 B14R1.7276 CCNC(=O)c1c(cccc1OC)Cl 240690a_100015525214_100000743539 [0,2,0,0,0,0|1,0,0]=3 10113 B14R1.7276 CCNC(=O)c1c(cccc1OC)Cl 527a_100015525214_100000743539 [0,2,0,0,0,0|1,0,0]=3 10114 B14R1.7276 CCNC(=O)c1c(cccc1OC)F 11a_100015525214_100000759380 [0,2,0,0,0,0|1,0,0]=3 10115 B14R1.7276 CCNC(=O)c1c(cccc1OC)F 240690a_100015525214_100000759380 [0,2,0,0,0,0|1,0,0]=3 10116 B14R1.7276 CCNC(=O)c1c(cccc1OC)F 527a_100015525214_100000759380 [0,2,0,0,0,0|1,0,0]=3 10117 B14R1.7276 CCNC(=O)c1c(cccc1OC)I 11a_100015525214_100010179659 [0,2,0,0,0,0|1,0,0]=3 10118 B14R1.7276 CCNC(=O)c1c(cccc1OC)I 240690a_100015525214_100010179659 [0,2,0,0,0,0|1,0,0]=3 10119 B14R1.7276 CCNC(=O)c1c(cccc1OC)I 527a_100015525214_100010179659 [0,2,0,0,0,0|1,0,0]=3 10120 B14R1.7276 CCNC(=O)c1c(cccc1OC)O 240690a_100015525214_100000043310 [0,2,0,0,0,0|1,0,0]=3 10121 B14R1.7276 CCOC(=O)c1c(cccc1NC)F 27a_100102657272_100012357633 [0,2,0,0,0,0|1,0,0]=3 10122 B14R1.7276 CCOC(=O)c1c(cccc1OC)C 7a_100000034863_200000210301 [0,2,0,0,0,0|0,0,0]=2 10123 B14R1.7276 CCOC(=O)c1c(cccc1OC)Cl 7a_200000055446_200000210301 [0,2,0,0,0,0|0,0,0]=2 10124 B14R1.7276 CCOC(=O)c1c(cccc1OC)F 7a_100011997393_200000210301 [0,2,0,0,0,0|0,0,0]=2 10125 B14R1.7276 CCOC(=O)c1c(cccc1O[13CH3])C 7a_100000034863_200025704644 [0,2,0,0,0,0|0,0,0]=2 10126 B14R1.7276 CCOC(=O)c1c(cccc1O[13CH3])Cl 7a_200000055446_200025704644 [0,2,0,0,0,0|0,0,0]=2 10127 B14R1.7276 CCOC(=O)c1c(cccc1O[13CH3])F 7a_100011997393_200025704644 [0,2,0,0,0,0|0,0,0]=2 10128 B14R1.7276 CCOC(=O)c1c(cccc1SC)F 62a_100012357633_200000210301 [0,2,0,0,0,0|0,1,0]=3 10129 B14R1.7276 CCOC(=O)c1c(cccc1SC)F 62a_200000210301_200000170032 [0,2,0,0,0,0|0,1,0]=3 10130 B14R1.7276 CCOC(=O)c1c(cccc1S[13CH3])F 62a_100012357633_200025704644 [0,2,0,0,0,0|0,1,0]=3 10131 B14R1.7276 CCOC(=O)c1c(cccc1S[13CH3])F 62a_200025704644_200000170032 [0,2,0,0,0,0|0,1,0]=3 10132 B14R1.7276 CCOC(=O)c1c(ccnc1NC)C 27a_100102657272_100010068243 [0,2,0,0,0,0|2,0,0]=4 10133 B14R1.7276 CCOC(=O)c1c(ccnc1NC)N 27a_100102657272_100010588025 [0,2,0,0,0,0|2,0,0]=4 10134 B14R1.7276 CCOC(=O)c1c(ccnc1O)OC 271570a_203496583355_200010142526 [0,2,0,0,0,0|1,0,0]=3 10135 B14R1.7276 CCOC(=O)c1c(ccnc1SC)C 62a_100010068243_200000210301 [0,2,0,0,0,0|1,1,0]=4 10136 B14R1.7276 CCOC(=O)c1c(ccnc1SC)C 62a_200000210301_100010068243 [0,2,0,0,0,0|1,1,0]=4 10137 B14R1.7276 CCOC(=O)c1c(ccnc1SC)N 62a_200000210301_100010588025 [0,2,0,0,0,0|1,1,0]=4 10138 B14R1.7276 CCOC(=O)c1c(ccnc1S[13CH3])C 62a_100010068243_200025704644 [0,2,0,0,0,0|1,1,0]=4 10139 B14R1.7276 CCOC(=O)c1c(ccnc1S[13CH3])C 62a_200025704644_100010068243 [0,2,0,0,0,0|1,1,0]=4 10140 B14R1.7276 CCOC(=O)c1c(ccnc1S[13CH3])N 62a_200025704644_100010588025 [0,2,0,0,0,0|1,1,0]=4 10141 B14R1.7276 CNCC(=O)c1c(cccc1OC)Cl 2230a_106832991635_100010768284 [0,2,0,0,0,0|2,0,0]=4 10142 B14R1.7276 CNCC(=O)c1c(cccc1OC)Cl 34a_100102657272_100010768284 [0,2,0,0,0,0|2,0,0]=4 10143 B14R1.7276 CNNC(=O)c1c(cccc1OC)Br 22a_100016993582_100011593405 [0,2,0,0,0,0|2,0,0]=4 10144 B14R1.7276 CNNC(=O)c1c(cccc1OC)C 22a_100016993582_100000066212 [0,2,0,0,0,0|2,0,0]=4 10145 B14R1.7276 CNNC(=O)c1c(cccc1OC)Cl 22a_100016993582_100000743539 [0,2,0,0,0,0|2,0,0]=4 10146 B14R1.7276 CNNC(=O)c1c(cccc1OC)F 22a_100016993582_100000759380 [0,2,0,0,0,0|2,0,0]=4 10147 B14R1.7276 CNNC(=O)c1c(cccc1OC)I 22a_100016993582_100010179659 [0,2,0,0,0,0|2,0,0]=4 10148 B14R1.7276 CNNC(=O)c1c(cccc1OC)O 22a_100016993582_100000043310 [0,2,0,0,0,0|2,0,0]=4 10149 B14R1.7276 COCC(=O)c1c(cccc1OC)Cl 34a_100138415774_100010768284 [0,2,0,0,0,0|2,0,0]=4 10150 B14R1.7276 COc1cccc(c1C(=O)CCF)Br 1458a_100011593405_100011217306 [0,2,0,0,0,0|2,0,0]=4 10151 B14R1.7276 COc1cccc(c1C(=O)CCF)C 1458a_100000066212_100011217306 [0,2,0,0,0,0|2,0,0]=4 10152 B14R1.7276 COc1cccc(c1C(=O)CCF)Cl 1458a_100000743539_100011217306 [0,2,0,0,0,0|2,0,0]=4 10153 B14R1.7276 COc1cccc(c1C(=O)CCF)F 1458a_100000759380_100011217306 [0,2,0,0,0,0|2,0,0]=4 10154 B14R1.7276 COc1cccc(c1C(=O)CCF)I 1458a_100010179659_100011217306 [0,2,0,0,0,0|2,0,0]=4 10155 B14R1.7276 COc1cccc(c1C(=O)CCF)O 1458a_100000043310_100011217306 [0,2,0,0,0,0|2,0,0]=4 10156 B14R1.7276 COc1cccc(c1C(=O)CCO)Br 1458a_100011593405_100000211926 [0,2,0,0,0,0|2,0,0]=4 10157 B14R1.7276 COc1cccc(c1C(=O)CCO)C 1458a_100000066212_100000211926 [0,2,0,0,0,0|2,0,0]=4 10158 B14R1.7276 COc1cccc(c1C(=O)CCO)Cl 1458a_100000743539_100000211926 [0,2,0,0,0,0|2,0,0]=4 10159 B14R1.7276 COc1cccc(c1C(=O)CCO)F 1458a_100000759380_100000211926 [0,2,0,0,0,0|2,0,0]=4 10160 B14R1.7276 COc1cccc(c1C(=O)CCO)I 1458a_100010179659_100000211926 [0,2,0,0,0,0|2,0,0]=4 10161 B14R1.7276 COc1cccc(c1C(=O)CCO)O 1458a_100000043310_100000211926 [0,2,0,0,0,0|2,0,0]=4 10162 B14R1.7276 COc1cccc(c1C(=O)CSC)Cl 62a_100010768284_200000210301 [0,2,0,0,0,0|2,0,0]=4 10163 B14R1.7276 COc1cccc(c1C(=O)CS[13CH3])Cl 62a_100010768284_200025704644 [0,2,0,0,0,0|2,0,0]=4 10164 B14R1.160 C=C(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000730704 [0,2,0,0,0,0|2,0,0]=4 10165 B14R1.160 C=C(C)CCC(=O)c1ccccc1C 1458a_100000212026_100000730704 [0,2,0,0,0,0|2,0,0]=4 10166 B14R1.160 C=C(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000730704 [0,2,0,0,0,0|2,0,0]=4 10167 B14R1.160 C=C(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000730704 [0,2,0,0,0,0|2,0,0]=4 10168 B14R1.160 C=C(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000730704 [0,2,0,0,0,0|2,0,0]=4 10169 B14R1.160 C=C(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000730704 [0,2,0,0,0,0|1,0,0]=3 10170 B14R1.160 C=C(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000730704 [0,2,0,0,0,0|1,0,1]=4 10171 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 11a_100000765925_100000188424 [0,2,0,0,0,0|2,0,0]=4 10172 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 1626a_100000765925_100000188424 [0,2,0,0,0,0|2,0,0]=4 10173 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 240690a_100000765925_100000188424 [0,2,0,0,0,0|2,0,0]=4 10174 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 527a_100000765925_100000188424 [0,2,0,0,0,0|2,0,0]=4 10175 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 11a_100000765925_100000212026 [0,2,0,0,0,0|2,0,0]=4 10176 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 1626a_100000765925_100000212026 [0,2,0,0,0,0|2,0,0]=4 10177 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 240690a_100000765925_100000212026 [0,2,0,0,0,0|2,0,0]=4 10178 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 527a_100000765925_100000212026 [0,2,0,0,0,0|2,0,0]=4 10179 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 11a_100000765925_100000185844 [0,2,0,0,0,0|2,0,0]=4 10180 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 1626a_100000765925_100000185844 [0,2,0,0,0,0|2,0,0]=4 10181 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 240690a_100000765925_100000185844 [0,2,0,0,0,0|2,0,0]=4 10182 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 527a_100000765925_100000185844 [0,2,0,0,0,0|2,0,0]=4 10183 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 11a_100000765925_100000188656 [0,2,0,0,0,0|2,0,0]=4 10184 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 1626a_100000765925_100000188656 [0,2,0,0,0,0|2,0,0]=4 10185 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 240690a_100000765925_100000188656 [0,2,0,0,0,0|2,0,0]=4 10186 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 527a_100000765925_100000188656 [0,2,0,0,0,0|2,0,0]=4 10187 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 11a_100000765925_100000187884 [0,2,0,0,0,0|2,0,0]=4 10188 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 1626a_100000765925_100000187884 [0,2,0,0,0,0|2,0,0]=4 10189 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 240690a_100000765925_100000187884 [0,2,0,0,0,0|2,0,0]=4 10190 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 527a_100000765925_100000187884 [0,2,0,0,0,0|2,0,0]=4 10191 B14R1.160 C=C(C)CNC(=O)c1ccccc1O 240690a_100000765925_100015234032 [0,2,0,0,0,0|1,0,0]=3 10192 B14R1.160 C=C(C)CNC(=O)c1ccccc1[O-] 1626a_100000765925_100009911694 [0,2,0,0,0,0|1,0,1]=4 10193 B14R1.160 C=C(C)CNC(=O)c1ccccc1[O-] 240690a_100000765925_100009911694 [0,2,0,0,0,0|1,0,1]=4 10194 B14R1.160 C=C(C)CNC(=O)c1ccccc1[O-] 527a_100000765925_100009911694 [0,2,0,0,0,0|1,0,1]=4 10195 B14R1.160 CC(=CCC(=O)c1ccccc1O)C 1458a_100015234032_100000761012 [0,2,0,0,0,0|1,0,1]=4 10196 B14R1.160 CC(=NNC(C)C)c1ccccc1O 4a_100000741168_100000188907 [0,2,0,0,0,0|2,0,0]=4 10197 B14R1.160 CC(=O)CCC(=O)c1ccccc1F 1458a_100000070787_100000086012 [0,2,0,0,0,0|2,0,0]=4 10198 B14R1.160 CC(=O)CNC(=O)c1ccccc1C 1458a_100000184812_200000210301 [0,2,0,0,0,0|2,0,0]=4 10199 B14R1.160 CC(=O)CNC(=O)c1ccccc1Cl 1458a_100000182550_200000210301 [0,2,0,0,0,0|2,0,0]=4 10200 B14R1.160 CC(=O)CNC(=O)c1ccccc1F 1458a_100000182453_200000210301 [0,2,0,0,0,0|2,0,0]=4 10201 B14R1.160 CC(=O)CNC(=O)c1ccccc1I 1458a_100000194700_200000210301 [0,2,0,0,0,0|2,0,0]=4 10202 B14R1.160 CC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_200000210301 [0,2,0,0,0,0|1,0,0]=3 10203 B14R1.160 CC(=O)COC(=O)c1ccccc1O 271570a_203496583355_201991511838 [0,2,0,0,0,0|0,0,0]=2 10204 B14R1.160 CC(=O)NNC(=O)c1ccccc1O 22a_100000189765_100015234032 [0,2,0,0,0,0|1,0,1]=4 10205 B14R1.160 CC(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000210312 [0,2,0,0,0,0|2,0,0]=4 10206 B14R1.160 CC(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210312 [0,2,0,0,0,0|2,0,0]=4 10207 B14R1.160 CC(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000210312 [0,2,0,0,0,0|2,0,0]=4 10208 B14R1.160 CC(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000210312 [0,2,0,0,0,0|2,0,0]=4 10209 B14R1.160 CC(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000210312 [0,2,0,0,0,0|1,0,0]=3 10210 B14R1.160 CC(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210312 [0,2,0,0,0,0|1,0,1]=4 10211 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 11a_100000210953_100000188424 [0,2,0,0,0,0|2,0,0]=4 10212 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 1626a_100000210953_100000188424 [0,2,0,0,0,0|2,0,0]=4 10213 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 240690a_100000210953_100000188424 [0,2,0,0,0,0|2,0,0]=4 10214 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 527a_100000210953_100000188424 [0,2,0,0,0,0|2,0,0]=4 10215 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 11a_100000210953_100000185844 [0,2,0,0,0,0|2,0,0]=4 10216 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 1626a_100000210953_100000185844 [0,2,0,0,0,0|2,0,0]=4 10217 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 240690a_100000210953_100000185844 [0,2,0,0,0,0|2,0,0]=4 10218 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 527a_100000210953_100000185844 [0,2,0,0,0,0|2,0,0]=4 10219 B14R1.160 CC(C)CNC(=O)c1ccccc1F 11a_100000210953_100000188656 [0,2,0,0,0,0|2,0,0]=4 10220 B14R1.160 CC(C)CNC(=O)c1ccccc1F 1626a_100000210953_100000188656 [0,2,0,0,0,0|2,0,0]=4 10221 B14R1.160 CC(C)CNC(=O)c1ccccc1F 240690a_100000210953_100000188656 [0,2,0,0,0,0|2,0,0]=4 10222 B14R1.160 CC(C)CNC(=O)c1ccccc1F 527a_100000210953_100000188656 [0,2,0,0,0,0|2,0,0]=4 10223 B14R1.160 CC(C)CNC(=O)c1ccccc1I 11a_100000210953_100000187884 [0,2,0,0,0,0|2,0,0]=4 10224 B14R1.160 CC(C)CNC(=O)c1ccccc1I 1626a_100000210953_100000187884 [0,2,0,0,0,0|2,0,0]=4 10225 B14R1.160 CC(C)CNC(=O)c1ccccc1I 240690a_100000210953_100000187884 [0,2,0,0,0,0|2,0,0]=4 10226 B14R1.160 CC(C)CNC(=O)c1ccccc1I 527a_100000210953_100000187884 [0,2,0,0,0,0|2,0,0]=4 10227 B14R1.160 CC(C)CNC(=O)c1ccccc1O 240690a_100000210953_100015234032 [0,2,0,0,0,0|1,0,0]=3 10228 B14R1.160 CC(C)CNC(=O)c1ccccc1O 271570a_203496583355_200000155729 [0,2,0,0,0,0|1,0,0]=3 10229 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 1626a_100000210953_100009911694 [0,2,0,0,0,0|1,0,1]=4 10230 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 240690a_100000210953_100009911694 [0,2,0,0,0,0|1,0,1]=4 10231 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 527a_100000210953_100009911694 [0,2,0,0,0,0|1,0,1]=4 10232 B14R1.160 CC(C)NCC(=O)c1ccccc1Br 34a_100138425928_100000199116 [0,2,0,0,0,0|2,0,0]=4 10233 B14R1.160 CC(C)NCC(=O)c1ccccc1Cl 34a_100138425928_100000211432 [0,2,0,0,0,0|2,0,0]=4 10234 B14R1.160 CC(C)NCC(=O)c1ccccc1F 34a_100138425928_100000204681 [0,2,0,0,0,0|2,0,0]=4 10235 B14R1.160 CC(C)NNC(=O)c1ccccc1Br 22a_100000741168_100000188424 [0,2,0,0,0,0|2,0,0]=4 10236 B14R1.160 CC(C)NNC(=O)c1ccccc1Cl 22a_100000741168_100000185844 [0,2,0,0,0,0|2,0,0]=4 10237 B14R1.160 CC(C)NNC(=O)c1ccccc1F 22a_100000741168_100000188656 [0,2,0,0,0,0|2,0,0]=4 10238 B14R1.160 CC(C)NNC(=O)c1ccccc1I 22a_100000741168_100000187884 [0,2,0,0,0,0|2,0,0]=4 10239 B14R1.160 CC(C)NNC(=O)c1ccccc1O 22a_100000741168_100015234032 [0,2,0,0,0,0|1,0,0]=3 10240 B14R1.160 CC(C)NNC(=O)c1ccccc1[O-] 22a_100000741168_100009911694 [0,2,0,0,0,0|1,0,1]=4 10241 B14R1.160 CC(C)OCC(=O)c1ccccc1Br 34a_100000212225_100000199116 [0,2,0,0,0,0|1,0,0]=3 10242 B14R1.160 CC(C)OCC(=O)c1ccccc1Cl 34a_100000212225_100000211432 [0,2,0,0,0,0|1,0,0]=3 10243 B14R1.160 CC(C)OCC(=O)c1ccccc1F 34a_100000212225_100000204681 [0,2,0,0,0,0|1,0,0]=3 10244 B14R1.160 CC(C)OCN(C)c1ccccc1O 269982a_100000033821_100000709892 [0,2,0,0,0,0|2,0,0]=4 10245 B14R1.160 CC(C)SCC(=O)c1ccccc1Br 62a_100000199116_100000210206 [0,2,0,0,0,0|1,1,0]=4 10246 B14R1.160 CC(C)SCC(=O)c1ccccc1Cl 62a_100000210206_100000211432 [0,2,0,0,0,0|1,1,0]=4 10247 B14R1.160 CC(C)SCC(=O)c1ccccc1Cl 62a_100000211432_100000210206 [0,2,0,0,0,0|1,1,0]=4 10248 B14R1.160 CC(C)SCC(=O)c1ccccc1F 62a_100000204681_100000210206 [0,2,0,0,0,0|1,1,0]=4 10249 B14R1.160 CC(C)SCC(=O)c1ccccc1F 62a_100000210206_100000204681 [0,2,0,0,0,0|1,1,0]=4 10250 B14R1.160 CC(C)SCC(=O)c1ccccc1O 62a_100000188908_100000210206 [0,2,0,0,0,0|0,1,0]=3 10251 B14R1.160 CC(C)SCC(=O)c1ccccc1O 62a_100000210206_100000188908 [0,2,0,0,0,0|0,1,0]=3 10252 B14R1.160 CC(O)CCC(=O)c1ccccc1Br 1458a_100000188424_100012276601 [0,2,0,0,0,0|2,0,0]=4 10253 B14R1.160 CC(O)CCC(=O)c1ccccc1Cl 1458a_100000185844_100012276601 [0,2,0,0,0,0|2,0,0]=4 10254 B14R1.160 CC(O)CCC(=O)c1ccccc1F 1458a_100000188656_100012276601 [0,2,0,0,0,0|2,0,0]=4 10255 B14R1.160 CC(O)CCC(=O)c1ccccc1I 1458a_100000187884_100012276601 [0,2,0,0,0,0|2,0,0]=4 10256 B14R1.160 CC(O)CCC(=O)c1ccccc1O 1458a_100015234032_100012276601 [0,2,0,0,0,0|1,0,0]=3 10257 B14R1.160 CC(O)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100012276601 [0,2,0,0,0,0|1,0,1]=4 10258 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 11a_100000210904_100000188424 [0,2,0,0,0,0|2,0,0]=4 10259 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 240690a_100000210904_100000188424 [0,2,0,0,0,0|2,0,0]=4 10260 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 527a_100000210904_100000188424 [0,2,0,0,0,0|2,0,0]=4 10261 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 11a_100000210904_100000185844 [0,2,0,0,0,0|2,0,0]=4 10262 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 240690a_100000210904_100000185844 [0,2,0,0,0,0|2,0,0]=4 10263 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 527a_100000210904_100000185844 [0,2,0,0,0,0|2,0,0]=4 10264 B14R1.160 CC(O)CNC(=O)c1ccccc1F 11a_100000210904_100000188656 [0,2,0,0,0,0|2,0,0]=4 10265 B14R1.160 CC(O)CNC(=O)c1ccccc1F 240690a_100000210904_100000188656 [0,2,0,0,0,0|2,0,0]=4 10266 B14R1.160 CC(O)CNC(=O)c1ccccc1F 527a_100000210904_100000188656 [0,2,0,0,0,0|2,0,0]=4 10267 B14R1.160 CC(O)CNC(=O)c1ccccc1I 11a_100000210904_100000187884 [0,2,0,0,0,0|2,0,0]=4 10268 B14R1.160 CC(O)CNC(=O)c1ccccc1I 240690a_100000210904_100000187884 [0,2,0,0,0,0|2,0,0]=4 10269 B14R1.160 CC(O)CNC(=O)c1ccccc1I 527a_100000210904_100000187884 [0,2,0,0,0,0|2,0,0]=4 10270 B14R1.160 CC(O)CNC(=O)c1ccccc1O 240690a_100000210904_100015234032 [0,2,0,0,0,0|1,0,0]=3 10271 B14R1.160 CC(O)CNC(=O)c1ccccc1[O-] 240690a_100000210904_100009911694 [0,2,0,0,0,0|1,0,1]=4 10272 B14R1.160 CC(O)CNC(=O)c1ccccc1[O-] 527a_100000210904_100009911694 [0,2,0,0,0,0|1,0,1]=4 10273 B14R1.160 CN(C)CCC(=O)c1ccccc1F 2230a_100102631434_100000086012 [0,2,0,0,0,0|2,0,0]=4 10274 B14R1.160 CN(C)CCC(=O)c1ccccc1F 269982a_100102631434_100000086012 [0,2,0,0,0,0|2,0,0]=4 10275 B14R1.160 CN(C)CCC(=O)c1ccccc1O 269982a_100102631434_100009873196 [0,2,0,0,0,0|1,0,0]=3 10276 B14R1.160 Cc1ccccc1C(=O)CCC(C)C 1458a_100000212026_100000210312 [0,2,0,0,0,0|2,0,0]=4 10277 B14R1.160 Cc1ccccc1C(=O)CCC(C)O 1458a_100000212026_100012276601 [0,2,0,0,0,0|2,0,0]=4 10278 B14R1.160 Cc1ccccc1C(=O)CNC(C)C 2230a_100138425928_100000741374 [0,2,0,0,0,0|2,0,0]=4 10279 B14R1.160 Cc1ccccc1C(=O)CNC(C)C 34a_100138425928_100000741374 [0,2,0,0,0,0|2,0,0]=4 10280 B14R1.160 Cc1ccccc1C(=O)COC(C)C 34a_100000212225_100000741374 [0,2,0,0,0,0|1,0,0]=3 10281 B14R1.160 Cc1ccccc1C(=O)CSC(C)C 62a_100000210206_100000741374 [0,2,0,0,0,0|1,1,0]=4 10282 B14R1.160 Cc1ccccc1C(=O)CSC(C)C 62a_100000741374_100000210206 [0,2,0,0,0,0|1,1,0]=4 10283 B14R1.160 Cc1ccccc1C(=O)NCC(=O)[13CH3] 1458a_100000184812_200025704644 [0,2,0,0,0,0|2,0,0]=4 10284 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000212026 [0,2,0,0,0,0|2,0,0]=4 10285 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000212026 [0,2,0,0,0,0|2,0,0]=4 10286 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000212026 [0,2,0,0,0,0|2,0,0]=4 10287 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000212026 [0,2,0,0,0,0|2,0,0]=4 10288 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000212026 [0,2,0,0,0,0|2,0,0]=4 10289 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000212026 [0,2,0,0,0,0|2,0,0]=4 10290 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000212026 [0,2,0,0,0,0|2,0,0]=4 10291 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 11a_100000765723_100000212026 [0,2,0,0,0,0|2,0,0]=4 10292 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 1626a_100000765723_100000212026 [0,2,0,0,0,0|2,0,0]=4 10293 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 240690a_100000765723_100000212026 [0,2,0,0,0,0|2,0,0]=4 10294 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 527a_100000765723_100000212026 [0,2,0,0,0,0|2,0,0]=4 10295 B14R1.160 Cc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000212026 [0,2,0,0,0,0|2,0,0]=4 10296 B14R1.160 NC(=O)CNC(=O)c1ccccc1O 240690a_100000711301_100015234032 [0,2,0,0,0,0|1,0,1]=4 10297 B14R1.160 O=C(NCC(F)F)c1ccccc1Br 11a_100000765723_100000188424 [0,2,0,0,0,0|2,0,0]=4 10298 B14R1.160 O=C(NCC(F)F)c1ccccc1Br 1626a_100000765723_100000188424 [0,2,0,0,0,0|2,0,0]=4 10299 B14R1.160 O=C(NCC(F)F)c1ccccc1Br 240690a_100000765723_100000188424 [0,2,0,0,0,0|2,0,0]=4 10300 B14R1.160 O=C(NCC(F)F)c1ccccc1Br 527a_100000765723_100000188424 [0,2,0,0,0,0|2,0,0]=4 10301 B14R1.160 O=C(NCC(F)F)c1ccccc1Cl 11a_100000765723_100000185844 [0,2,0,0,0,0|2,0,0]=4 10302 B14R1.160 O=C(NCC(F)F)c1ccccc1Cl 1626a_100000765723_100000185844 [0,2,0,0,0,0|2,0,0]=4 10303 B14R1.160 O=C(NCC(F)F)c1ccccc1Cl 240690a_100000765723_100000185844 [0,2,0,0,0,0|2,0,0]=4 10304 B14R1.160 O=C(NCC(F)F)c1ccccc1Cl 527a_100000765723_100000185844 [0,2,0,0,0,0|2,0,0]=4 10305 B14R1.160 O=C(NCC(F)F)c1ccccc1F 11a_100000765723_100000188656 [0,2,0,0,0,0|2,0,0]=4 10306 B14R1.160 O=C(NCC(F)F)c1ccccc1F 1626a_100000765723_100000188656 [0,2,0,0,0,0|2,0,0]=4 10307 B14R1.160 O=C(NCC(F)F)c1ccccc1F 240690a_100000765723_100000188656 [0,2,0,0,0,0|2,0,0]=4 10308 B14R1.160 O=C(NCC(F)F)c1ccccc1F 527a_100000765723_100000188656 [0,2,0,0,0,0|2,0,0]=4 10309 B14R1.160 O=C(NCC(F)F)c1ccccc1I 11a_100000765723_100000187884 [0,2,0,0,0,0|2,0,0]=4 10310 B14R1.160 O=C(NCC(F)F)c1ccccc1I 1626a_100000765723_100000187884 [0,2,0,0,0,0|2,0,0]=4 10311 B14R1.160 O=C(NCC(F)F)c1ccccc1I 240690a_100000765723_100000187884 [0,2,0,0,0,0|2,0,0]=4 10312 B14R1.160 O=C(NCC(F)F)c1ccccc1I 527a_100000765723_100000187884 [0,2,0,0,0,0|2,0,0]=4 10313 B14R1.160 O=C(NCC(F)F)c1ccccc1O 240690a_100000765723_100015234032 [0,2,0,0,0,0|1,0,0]=3 10314 B14R1.160 O=C(NCC(F)F)c1ccccc1[O-] 1626a_100000765723_100009911694 [0,2,0,0,0,0|1,0,1]=4 10315 B14R1.160 O=C(NCC(F)F)c1ccccc1[O-] 240690a_100000765723_100009911694 [0,2,0,0,0,0|1,0,1]=4 10316 B14R1.160 O=C(NCC(F)F)c1ccccc1[O-] 527a_100000765723_100009911694 [0,2,0,0,0,0|1,0,1]=4 10317 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1Cl 1458a_100000182550_200025704644 [0,2,0,0,0,0|2,0,0]=4 10318 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1F 1458a_100000182453_200025704644 [0,2,0,0,0,0|2,0,0]=4 10319 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1I 1458a_100000194700_200025704644 [0,2,0,0,0,0|2,0,0]=4 10320 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1O 1458a_100011193979_200025704644 [0,2,0,0,0,0|1,0,0]=3 10321 B14R1.1035 C#CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000731252 [0,2,0,0,0,0|2,0,0]=4 10322 B14R1.1035 C#CCCCC(=O)c1ccccc1C 1458a_100000212026_100000731252 [0,2,0,0,0,0|2,0,0]=4 10323 B14R1.1035 C#CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000731252 [0,2,0,0,0,0|2,0,0]=4 10324 B14R1.1035 C#CCCCC(=O)c1ccccc1F 1458a_100000188656_100000731252 [0,2,0,0,0,0|2,0,0]=4 10325 B14R1.1035 C#CCCCC(=O)c1ccccc1I 1458a_100000187884_100000731252 [0,2,0,0,0,0|2,0,0]=4 10326 B14R1.1035 C#CCCCC(=O)c1ccccc1O 1458a_100015234032_100000731252 [0,2,0,0,0,0|1,0,0]=3 10327 B14R1.1035 C#CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000731252 [0,2,0,0,0,0|1,0,1]=4 10328 B14R1.1035 C#CCCNC(=O)c1ccccc1Br 11a_100000755551_100000188424 [0,2,0,0,0,0|2,0,0]=4 10329 B14R1.1035 C#CCCNC(=O)c1ccccc1Br 1626a_100000755551_100000188424 [0,2,0,0,0,0|2,0,0]=4 10330 B14R1.1035 C#CCCNC(=O)c1ccccc1Br 240690a_100000755551_100000188424 [0,2,0,0,0,0|2,0,0]=4 10331 B14R1.1035 C#CCCNC(=O)c1ccccc1Br 527a_100000755551_100000188424 [0,2,0,0,0,0|2,0,0]=4 10332 B14R1.1035 C#CCCNC(=O)c1ccccc1C 11a_100000755551_100000212026 [0,2,0,0,0,0|2,0,0]=4 10333 B14R1.1035 C#CCCNC(=O)c1ccccc1C 1626a_100000755551_100000212026 [0,2,0,0,0,0|2,0,0]=4 10334 B14R1.1035 C#CCCNC(=O)c1ccccc1C 240690a_100000755551_100000212026 [0,2,0,0,0,0|2,0,0]=4 10335 B14R1.1035 C#CCCNC(=O)c1ccccc1C 527a_100000755551_100000212026 [0,2,0,0,0,0|2,0,0]=4 10336 B14R1.1035 C#CCCNC(=O)c1ccccc1Cl 11a_100000755551_100000185844 [0,2,0,0,0,0|2,0,0]=4 10337 B14R1.1035 C#CCCNC(=O)c1ccccc1Cl 1626a_100000755551_100000185844 [0,2,0,0,0,0|2,0,0]=4 10338 B14R1.1035 C#CCCNC(=O)c1ccccc1Cl 240690a_100000755551_100000185844 [0,2,0,0,0,0|2,0,0]=4 10339 B14R1.1035 C#CCCNC(=O)c1ccccc1Cl 527a_100000755551_100000185844 [0,2,0,0,0,0|2,0,0]=4 10340 B14R1.1035 C#CCCNC(=O)c1ccccc1F 11a_100000755551_100000188656 [0,2,0,0,0,0|2,0,0]=4 10341 B14R1.1035 C#CCCNC(=O)c1ccccc1F 1626a_100000755551_100000188656 [0,2,0,0,0,0|2,0,0]=4 10342 B14R1.1035 C#CCCNC(=O)c1ccccc1F 240690a_100000755551_100000188656 [0,2,0,0,0,0|2,0,0]=4 10343 B14R1.1035 C#CCCNC(=O)c1ccccc1F 527a_100000755551_100000188656 [0,2,0,0,0,0|2,0,0]=4 10344 B14R1.1035 C#CCCNC(=O)c1ccccc1I 11a_100000755551_100000187884 [0,2,0,0,0,0|2,0,0]=4 10345 B14R1.1035 C#CCCNC(=O)c1ccccc1I 1626a_100000755551_100000187884 [0,2,0,0,0,0|2,0,0]=4 10346 B14R1.1035 C#CCCNC(=O)c1ccccc1I 240690a_100000755551_100000187884 [0,2,0,0,0,0|2,0,0]=4 10347 B14R1.1035 C#CCCNC(=O)c1ccccc1I 527a_100000755551_100000187884 [0,2,0,0,0,0|2,0,0]=4 10348 B14R1.1035 C#CCCNC(=O)c1ccccc1O 240690a_100000755551_100015234032 [0,2,0,0,0,0|1,0,0]=3 10349 B14R1.1035 C#CCCNC(=O)c1ccccc1[O-] 1626a_100000755551_100009911694 [0,2,0,0,0,0|1,0,1]=4 10350 B14R1.1035 C#CCCNC(=O)c1ccccc1[O-] 240690a_100000755551_100009911694 [0,2,0,0,0,0|1,0,1]=4 10351 B14R1.1035 C#CCCNC(=O)c1ccccc1[O-] 527a_100000755551_100009911694 [0,2,0,0,0,0|1,0,1]=4 10352 B14R1.1035 C#CCOCC(=O)c1ccccc1Br 34a_100000210247_100000199116 [0,2,0,0,0,0|1,0,1]=4 10353 B14R1.1035 C#CCOCC(=O)c1ccccc1C 34a_100000210247_100000741374 [0,2,0,0,0,0|1,0,1]=4 10354 B14R1.1035 C#CCOCC(=O)c1ccccc1Cl 34a_100000210247_100000211432 [0,2,0,0,0,0|1,0,1]=4 10355 B14R1.1035 C#CCOCC(=O)c1ccccc1F 34a_100000210247_100000204681 [0,2,0,0,0,0|1,0,1]=4 10356 B14R1.1035 C#CCSCC(=O)c1ccccc1O 62a_100000038162_100000188908 [0,2,0,0,0,0|0,1,1]=4 10357 B14R1.1035 C=CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000757094 [0,2,0,0,0,0|2,0,0]=4 10358 B14R1.1035 C=CCCCC(=O)c1ccccc1C 1458a_100000212026_100000757094 [0,2,0,0,0,0|2,0,0]=4 10359 B14R1.1035 C=CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000757094 [0,2,0,0,0,0|2,0,0]=4 10360 B14R1.1035 C=CCCCC(=O)c1ccccc1F 1458a_100000188656_100000757094 [0,2,0,0,0,0|2,0,0]=4 10361 B14R1.1035 C=CCCCC(=O)c1ccccc1I 1458a_100000187884_100000757094 [0,2,0,0,0,0|2,0,0]=4 10362 B14R1.1035 C=CCCCC(=O)c1ccccc1O 1458a_100015234032_100000757094 [0,2,0,0,0,0|1,0,0]=3 10363 B14R1.1035 C=CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000757094 [0,2,0,0,0,0|1,0,1]=4 10364 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 11a_100015191253_100000188424 [0,2,0,0,0,0|2,0,0]=4 10365 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 1626a_100015191253_100000188424 [0,2,0,0,0,0|2,0,0]=4 10366 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 240690a_100015191253_100000188424 [0,2,0,0,0,0|2,0,0]=4 10367 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 527a_100015191253_100000188424 [0,2,0,0,0,0|2,0,0]=4 10368 B14R1.1035 C=CCCNC(=O)c1ccccc1C 11a_100015191253_100000212026 [0,2,0,0,0,0|2,0,0]=4 10369 B14R1.1035 C=CCCNC(=O)c1ccccc1C 1626a_100015191253_100000212026 [0,2,0,0,0,0|2,0,0]=4 10370 B14R1.1035 C=CCCNC(=O)c1ccccc1C 240690a_100015191253_100000212026 [0,2,0,0,0,0|2,0,0]=4 10371 B14R1.1035 C=CCCNC(=O)c1ccccc1C 527a_100015191253_100000212026 [0,2,0,0,0,0|2,0,0]=4 10372 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 11a_100015191253_100000185844 [0,2,0,0,0,0|2,0,0]=4 10373 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 1626a_100015191253_100000185844 [0,2,0,0,0,0|2,0,0]=4 10374 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 240690a_100015191253_100000185844 [0,2,0,0,0,0|2,0,0]=4 10375 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 527a_100015191253_100000185844 [0,2,0,0,0,0|2,0,0]=4 10376 B14R1.1035 C=CCCNC(=O)c1ccccc1F 11a_100015191253_100000188656 [0,2,0,0,0,0|2,0,0]=4 10377 B14R1.1035 C=CCCNC(=O)c1ccccc1F 1626a_100015191253_100000188656 [0,2,0,0,0,0|2,0,0]=4 10378 B14R1.1035 C=CCCNC(=O)c1ccccc1F 240690a_100015191253_100000188656 [0,2,0,0,0,0|2,0,0]=4 10379 B14R1.1035 C=CCCNC(=O)c1ccccc1F 527a_100015191253_100000188656 [0,2,0,0,0,0|2,0,0]=4 10380 B14R1.1035 C=CCCNC(=O)c1ccccc1I 11a_100015191253_100000187884 [0,2,0,0,0,0|2,0,0]=4 10381 B14R1.1035 C=CCCNC(=O)c1ccccc1I 1626a_100015191253_100000187884 [0,2,0,0,0,0|2,0,0]=4 10382 B14R1.1035 C=CCCNC(=O)c1ccccc1I 240690a_100015191253_100000187884 [0,2,0,0,0,0|2,0,0]=4 10383 B14R1.1035 C=CCCNC(=O)c1ccccc1I 527a_100015191253_100000187884 [0,2,0,0,0,0|2,0,0]=4 10384 B14R1.1035 C=CCCNC(=O)c1ccccc1O 240690a_100015191253_100015234032 [0,2,0,0,0,0|1,0,0]=3 10385 B14R1.1035 C=CCCNC(=O)c1ccccc1[O-] 1626a_100015191253_100009911694 [0,2,0,0,0,0|1,0,1]=4 10386 B14R1.1035 C=CCCNC(=O)c1ccccc1[O-] 240690a_100015191253_100009911694 [0,2,0,0,0,0|1,0,1]=4 10387 B14R1.1035 C=CCCNC(=O)c1ccccc1[O-] 527a_100015191253_100009911694 [0,2,0,0,0,0|1,0,1]=4 10388 B14R1.1035 C=CCNNC(=O)c1ccccc1O 22a_100020588587_100015234032 [0,2,0,0,0,0|1,0,1]=4 10389 B14R1.1035 C=CCOCC(=O)c1ccccc1Br 34a_200000210373_100000199116 [0,2,0,0,0,0|1,0,1]=4 10390 B14R1.1035 C=CCOCC(=O)c1ccccc1C 34a_200000210373_100000741374 [0,2,0,0,0,0|1,0,1]=4 10391 B14R1.1035 C=CCOCC(=O)c1ccccc1Cl 34a_200000210373_100000211432 [0,2,0,0,0,0|1,0,1]=4 10392 B14R1.1035 C=CCOCC(=O)c1ccccc1F 34a_200000210373_100000204681 [0,2,0,0,0,0|1,0,1]=4 10393 B14R1.1035 C=CCSCC(=O)c1ccccc1O 62a_100000188908_100000210623 [0,2,0,0,0,0|0,1,1]=4 10394 B14R1.1035 C=CCSCC(=O)c1ccccc1O 62a_100000210623_100000188908 [0,2,0,0,0,0|0,1,1]=4 10395 B14R1.1035 C=COCCC(=O)c1ccccc1O 1458a_100015234032_100000039644 [0,2,0,0,0,0|0,0,2]=4 10396 B14R1.1035 CC#CCNC(=O)c1ccccc1Br 11a_100000685387_100000188424 [0,2,0,0,0,0|2,0,0]=4 10397 B14R1.1035 CC#CCNC(=O)c1ccccc1Br 1626a_100000685387_100000188424 [0,2,0,0,0,0|2,0,0]=4 10398 B14R1.1035 CC#CCNC(=O)c1ccccc1Br 527a_100000685387_100000188424 [0,2,0,0,0,0|2,0,0]=4 10399 B14R1.1035 CC#CCNC(=O)c1ccccc1C 11a_100000685387_100000212026 [0,2,0,0,0,0|2,0,0]=4 10400 B14R1.1035 CC#CCNC(=O)c1ccccc1C 1626a_100000685387_100000212026 [0,2,0,0,0,0|2,0,0]=4 10401 B14R1.1035 CC#CCNC(=O)c1ccccc1C 527a_100000685387_100000212026 [0,2,0,0,0,0|2,0,0]=4 10402 B14R1.1035 CC#CCNC(=O)c1ccccc1Cl 11a_100000685387_100000185844 [0,2,0,0,0,0|2,0,0]=4 10403 B14R1.1035 CC#CCNC(=O)c1ccccc1Cl 1626a_100000685387_100000185844 [0,2,0,0,0,0|2,0,0]=4 10404 B14R1.1035 CC#CCNC(=O)c1ccccc1Cl 527a_100000685387_100000185844 [0,2,0,0,0,0|2,0,0]=4 10405 B14R1.1035 CC#CCNC(=O)c1ccccc1F 11a_100000685387_100000188656 [0,2,0,0,0,0|2,0,0]=4 10406 B14R1.1035 CC#CCNC(=O)c1ccccc1F 1626a_100000685387_100000188656 [0,2,0,0,0,0|2,0,0]=4 10407 B14R1.1035 CC#CCNC(=O)c1ccccc1F 527a_100000685387_100000188656 [0,2,0,0,0,0|2,0,0]=4 10408 B14R1.1035 CC#CCNC(=O)c1ccccc1I 11a_100000685387_100000187884 [0,2,0,0,0,0|2,0,0]=4 10409 B14R1.1035 CC#CCNC(=O)c1ccccc1I 1626a_100000685387_100000187884 [0,2,0,0,0,0|2,0,0]=4 10410 B14R1.1035 CC#CCNC(=O)c1ccccc1I 527a_100000685387_100000187884 [0,2,0,0,0,0|2,0,0]=4 10411 B14R1.1035 CC#CCNC(=O)c1ccccc1[O-] 1626a_100000685387_100009911694 [0,2,0,0,0,0|1,0,1]=4 10412 B14R1.1035 CC#CCNC(=O)c1ccccc1[O-] 527a_100000685387_100009911694 [0,2,0,0,0,0|1,0,1]=4 10413 B14R1.1035 CC(=NNCCO)c1ccccc1O 4a_100000210001_100000188907 [0,2,0,0,0,0|2,0,0]=4 10414 B14R1.1035 CC/C=C\CC(=O)c1ccccc1Br 1458a_100000188424_100103147603 [0,2,0,0,0,0|2,0,0]=4 10415 B14R1.1035 CC/C=C\CC(=O)c1ccccc1C 1458a_100000212026_100103147603 [0,2,0,0,0,0|2,0,0]=4 10416 B14R1.1035 CC/C=C\CC(=O)c1ccccc1Cl 1458a_100000185844_100103147603 [0,2,0,0,0,0|2,0,0]=4 10417 B14R1.1035 CC/C=C\CC(=O)c1ccccc1F 1458a_100000188656_100103147603 [0,2,0,0,0,0|2,0,0]=4 10418 B14R1.1035 CC/C=C\CC(=O)c1ccccc1I 1458a_100000187884_100103147603 [0,2,0,0,0,0|2,0,0]=4 10419 B14R1.1035 CC/C=C\CC(=O)c1ccccc1O 1458a_100015234032_100103147603 [0,2,0,0,0,0|1,0,0]=3 10420 B14R1.1035 CC/C=C\CC(=O)c1ccccc1[O-] 1458a_100009911694_100103147603 [0,2,0,0,0,0|1,0,1]=4 10421 B14R1.1035 CCC#CCC(=O)c1ccccc1Br 1458a_100000188424_100009813939 [0,2,0,0,0,0|2,0,0]=4 10422 B14R1.1035 CCC#CCC(=O)c1ccccc1C 1458a_100000212026_100009813939 [0,2,0,0,0,0|2,0,0]=4 10423 B14R1.1035 CCC#CCC(=O)c1ccccc1Cl 1458a_100000185844_100009813939 [0,2,0,0,0,0|2,0,0]=4 10424 B14R1.1035 CCC#CCC(=O)c1ccccc1F 1458a_100000188656_100009813939 [0,2,0,0,0,0|2,0,0]=4 10425 B14R1.1035 CCC#CCC(=O)c1ccccc1I 1458a_100000187884_100009813939 [0,2,0,0,0,0|2,0,0]=4 10426 B14R1.1035 CCC#CCC(=O)c1ccccc1O 1458a_100015234032_100009813939 [0,2,0,0,0,0|1,0,0]=3 10427 B14R1.1035 CCC#CCC(=O)c1ccccc1[O-] 1458a_100009911694_100009813939 [0,2,0,0,0,0|1,0,1]=4 10428 B14R1.1035 CCC=NNC(=O)c1ccccc1Br 4a_100000183644_100000210100 [0,2,0,0,0,0|2,0,0]=4 10429 B14R1.1035 CCC=NNC(=O)c1ccccc1C 4a_100000181371_100000210100 [0,2,0,0,0,0|2,0,0]=4 10430 B14R1.1035 CCC=NNC(=O)c1ccccc1Cl 4a_100000186534_100000210100 [0,2,0,0,0,0|2,0,0]=4 10431 B14R1.1035 CCC=NNC(=O)c1ccccc1F 4a_100000183521_100000210100 [0,2,0,0,0,0|2,0,0]=4 10432 B14R1.1035 CCC=NNC(=O)c1ccccc1I 4a_100000190081_100000210100 [0,2,0,0,0,0|2,0,0]=4 10433 B14R1.1035 CCCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210326 [0,2,0,0,0,0|2,0,0]=4 10434 B14R1.1035 CCCCCC(=O)c1ccccc1C 1458a_100000212026_100000210326 [0,2,0,0,0,0|2,0,0]=4 10435 B14R1.1035 CCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210326 [0,2,0,0,0,0|2,0,0]=4 10436 B14R1.1035 CCCCCC(=O)c1ccccc1F 1458a_100000188656_100000210326 [0,2,0,0,0,0|2,0,0]=4 10437 B14R1.1035 CCCCCC(=O)c1ccccc1I 1458a_100000187884_100000210326 [0,2,0,0,0,0|2,0,0]=4 10438 B14R1.1035 CCCCCC(=O)c1ccccc1O 1458a_100015234032_100000210326 [0,2,0,0,0,0|1,0,0]=3 10439 B14R1.1035 CCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210326 [0,2,0,0,0,0|1,0,1]=4 10440 B14R1.1035 CCCCNC(=O)c1ccccc1Br 11a_100000102301_100000188424 [0,2,0,0,0,0|2,0,0]=4 10441 B14R1.1035 CCCCNC(=O)c1ccccc1Br 1626a_100000102301_100000188424 [0,2,0,0,0,0|2,0,0]=4 10442 B14R1.1035 CCCCNC(=O)c1ccccc1Br 240690a_100000102301_100000188424 [0,2,0,0,0,0|2,0,0]=4 10443 B14R1.1035 CCCCNC(=O)c1ccccc1Br 527a_100000102301_100000188424 [0,2,0,0,0,0|2,0,0]=4 10444 B14R1.1035 CCCCNC(=O)c1ccccc1C 11a_100000102301_100000212026 [0,2,0,0,0,0|2,0,0]=4 10445 B14R1.1035 CCCCNC(=O)c1ccccc1C 1626a_100000102301_100000212026 [0,2,0,0,0,0|2,0,0]=4 10446 B14R1.1035 CCCCNC(=O)c1ccccc1C 240690a_100000102301_100000212026 [0,2,0,0,0,0|2,0,0]=4 10447 B14R1.1035 CCCCNC(=O)c1ccccc1C 527a_100000102301_100000212026 [0,2,0,0,0,0|2,0,0]=4 10448 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 11a_100000102301_100000185844 [0,2,0,0,0,0|2,0,0]=4 10449 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 1626a_100000102301_100000185844 [0,2,0,0,0,0|2,0,0]=4 10450 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 240690a_100000102301_100000185844 [0,2,0,0,0,0|2,0,0]=4 10451 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 527a_100000102301_100000185844 [0,2,0,0,0,0|2,0,0]=4 10452 B14R1.1035 CCCCNC(=O)c1ccccc1F 11a_100000102301_100000188656 [0,2,0,0,0,0|2,0,0]=4 10453 B14R1.1035 CCCCNC(=O)c1ccccc1F 1626a_100000102301_100000188656 [0,2,0,0,0,0|2,0,0]=4 10454 B14R1.1035 CCCCNC(=O)c1ccccc1F 240690a_100000102301_100000188656 [0,2,0,0,0,0|2,0,0]=4 10455 B14R1.1035 CCCCNC(=O)c1ccccc1F 527a_100000102301_100000188656 [0,2,0,0,0,0|2,0,0]=4 10456 B14R1.1035 CCCCNC(=O)c1ccccc1I 11a_100000102301_100000187884 [0,2,0,0,0,0|2,0,0]=4 10457 B14R1.1035 CCCCNC(=O)c1ccccc1I 1626a_100000102301_100000187884 [0,2,0,0,0,0|2,0,0]=4 10458 B14R1.1035 CCCCNC(=O)c1ccccc1I 240690a_100000102301_100000187884 [0,2,0,0,0,0|2,0,0]=4 10459 B14R1.1035 CCCCNC(=O)c1ccccc1I 527a_100000102301_100000187884 [0,2,0,0,0,0|2,0,0]=4 10460 B14R1.1035 CCCCNC(=O)c1ccccc1O 240690a_100000102301_100015234032 [0,2,0,0,0,0|1,0,0]=3 10461 B14R1.1035 CCCCNC(=O)c1ccccc1O 271570a_203496583355_200000154865 [0,2,0,0,0,0|1,0,0]=3 10462 B14R1.1035 CCCCNC(=O)c1ccccc1[O-] 1626a_100000102301_100009911694 [0,2,0,0,0,0|1,0,1]=4 10463 B14R1.1035 CCCCNC(=O)c1ccccc1[O-] 240690a_100000102301_100009911694 [0,2,0,0,0,0|1,0,1]=4 10464 B14R1.1035 CCCCNC(=O)c1ccccc1[O-] 527a_100000102301_100009911694 [0,2,0,0,0,0|1,0,1]=4 10465 B14R1.1035 CCCNN=C(C)c1ccccc1O 4a_100000740057_100000188907 [0,2,0,0,0,0|2,0,0]=4 10466 B14R1.1035 CCCNNC(=O)c1ccccc1Br 22a_100000740057_100000188424 [0,2,0,0,0,0|2,0,0]=4 10467 B14R1.1035 CCCNNC(=O)c1ccccc1C 22a_100000740057_100000212026 [0,2,0,0,0,0|2,0,0]=4 10468 B14R1.1035 CCCNNC(=O)c1ccccc1Cl 22a_100000740057_100000185844 [0,2,0,0,0,0|2,0,0]=4 10469 B14R1.1035 CCCNNC(=O)c1ccccc1F 22a_100000740057_100000188656 [0,2,0,0,0,0|2,0,0]=4 10470 B14R1.1035 CCCNNC(=O)c1ccccc1I 22a_100000740057_100000187884 [0,2,0,0,0,0|2,0,0]=4 10471 B14R1.1035 CCCNNC(=O)c1ccccc1O 22a_100000740057_100015234032 [0,2,0,0,0,0|1,0,0]=3 10472 B14R1.1035 CCCNNC(=O)c1ccccc1[O-] 22a_100000740057_100009911694 [0,2,0,0,0,0|1,0,1]=4 10473 B14R1.1035 CCCOCC(=O)c1ccccc1Br 34a_100000210258_100000199116 [0,2,0,0,0,0|1,0,0]=3 10474 B14R1.1035 CCCOCC(=O)c1ccccc1C 34a_100000210258_100000741374 [0,2,0,0,0,0|1,0,0]=3 10475 B14R1.1035 CCCOCC(=O)c1ccccc1Cl 34a_100000210258_100000211432 [0,2,0,0,0,0|1,0,0]=3 10476 B14R1.1035 CCCOCC(=O)c1ccccc1F 34a_100000210258_100000204681 [0,2,0,0,0,0|1,0,0]=3 10477 B14R1.1035 CCCSCC(=O)c1ccccc1Br 62a_100000199116_100000210303 [0,2,0,0,0,0|1,1,0]=4 10478 B14R1.1035 CCCSCC(=O)c1ccccc1C 62a_100000210303_100000741374 [0,2,0,0,0,0|1,1,0]=4 10479 B14R1.1035 CCCSCC(=O)c1ccccc1C 62a_100000741374_100000210303 [0,2,0,0,0,0|1,1,0]=4 10480 B14R1.1035 CCCSCC(=O)c1ccccc1Cl 62a_100000210303_100000211432 [0,2,0,0,0,0|1,1,0]=4 10481 B14R1.1035 CCCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210303 [0,2,0,0,0,0|1,1,0]=4 10482 B14R1.1035 CCCSCC(=O)c1ccccc1F 62a_100000204681_100000210303 [0,2,0,0,0,0|1,1,0]=4 10483 B14R1.1035 CCCSCC(=O)c1ccccc1F 62a_100000210303_100000204681 [0,2,0,0,0,0|1,1,0]=4 10484 B14R1.1035 CCCSCC(=O)c1ccccc1O 62a_100000188908_100000210303 [0,2,0,0,0,0|0,1,0]=3 10485 B14R1.1035 CCCSCC(=O)c1ccccc1O 62a_100000210303_100000188908 [0,2,0,0,0,0|0,1,0]=3 10486 B14R1.1035 CCNCCC(=O)c1ccccc1F 2230a_100015525214_100000086012 [0,2,0,0,0,0|2,0,0]=4 10487 B14R1.1035 CCOCCC(=O)c1ccccc1Br 1458a_100000188424_100011215890 [0,2,0,0,0,0|1,0,0]=3 10488 B14R1.1035 CCOCCC(=O)c1ccccc1C 1458a_100000212026_100011215890 [0,2,0,0,0,0|1,0,0]=3 10489 B14R1.1035 CCOCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215890 [0,2,0,0,0,0|1,0,0]=3 10490 B14R1.1035 CCOCCC(=O)c1ccccc1F 1458a_100000188656_100011215890 [0,2,0,0,0,0|1,0,0]=3 10491 B14R1.1035 CCOCCC(=O)c1ccccc1I 1458a_100000187884_100011215890 [0,2,0,0,0,0|1,0,0]=3 10492 B14R1.1035 CCOCCC(=O)c1ccccc1O 1458a_100015234032_100011215890 [0,2,0,0,0,0|0,0,0]=2 10493 B14R1.1035 CCOCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215890 [0,2,0,0,0,0|0,0,1]=3 10494 B14R1.1035 CCOCCN(C)c1ccccc1O 269982a_100000033821_100011215890 [0,2,0,0,0,0|2,0,0]=4 10495 B14R1.1035 CCSCCC(=O)c1ccccc1Br 1458a_100000188424_100000757381 [0,2,0,0,0,0|1,1,0]=4 10496 B14R1.1035 CCSCCC(=O)c1ccccc1C 1458a_100000212026_100000757381 [0,2,0,0,0,0|1,1,0]=4 10497 B14R1.1035 CCSCCC(=O)c1ccccc1Cl 1458a_100000185844_100000757381 [0,2,0,0,0,0|1,1,0]=4 10498 B14R1.1035 CCSCCC(=O)c1ccccc1F 1458a_100000188656_100000757381 [0,2,0,0,0,0|1,1,0]=4 10499 B14R1.1035 CCSCCC(=O)c1ccccc1F 62a_100000086012_100000210202 [0,2,0,0,0,0|1,1,0]=4 10500 B14R1.1035 CCSCCC(=O)c1ccccc1F 62a_100000210202_100000086012 [0,2,0,0,0,0|1,1,0]=4 10501 B14R1.1035 CCSCCC(=O)c1ccccc1I 1458a_100000187884_100000757381 [0,2,0,0,0,0|1,1,0]=4 10502 B14R1.1035 CCSCCC(=O)c1ccccc1O 1458a_100015234032_100000757381 [0,2,0,0,0,0|0,1,0]=3 10503 B14R1.1035 CCSCCC(=O)c1ccccc1O 62a_100000210202_100009873196 [0,2,0,0,0,0|0,1,0]=3 10504 B14R1.1035 CCSCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000757381 [0,2,0,0,0,0|0,1,1]=4 10505 B14R1.1035 CNCCNC(=O)c1ccccc1Cl 2230a_100000737833_200000210301 [0,2,0,0,0,0|2,0,0]=4 10506 B14R1.1035 CNCCNC(=O)c1ccccc1Cl 34a_100000737833_200000210301 [0,2,0,0,0,0|2,0,0]=4 10507 B14R1.1035 COCCCC(=O)c1ccccc1Br 1458a_100000188424_100000740836 [0,2,0,0,0,0|2,0,0]=4 10508 B14R1.1035 COCCCC(=O)c1ccccc1C 1458a_100000212026_100000740836 [0,2,0,0,0,0|2,0,0]=4 10509 B14R1.1035 COCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000740836 [0,2,0,0,0,0|2,0,0]=4 10510 B14R1.1035 COCCCC(=O)c1ccccc1F 1458a_100000188656_100000740836 [0,2,0,0,0,0|2,0,0]=4 10511 B14R1.1035 COCCCC(=O)c1ccccc1I 1458a_100000187884_100000740836 [0,2,0,0,0,0|2,0,0]=4 10512 B14R1.1035 COCCCC(=O)c1ccccc1O 1458a_100015234032_100000740836 [0,2,0,0,0,0|1,0,0]=3 10513 B14R1.1035 COCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000740836 [0,2,0,0,0,0|1,0,1]=4 10514 B14R1.1035 COCCNC(=O)c1ccccc1Br 1626a_100000209980_100000188424 [0,2,0,0,0,0|2,0,0]=4 10515 B14R1.1035 COCCNC(=O)c1ccccc1Br 240690a_100000209980_100000188424 [0,2,0,0,0,0|2,0,0]=4 10516 B14R1.1035 COCCNC(=O)c1ccccc1Br 34a_200000158863_200000210301 [0,2,0,0,0,0|2,0,0]=4 10517 B14R1.1035 COCCNC(=O)c1ccccc1Br 527a_100000209980_100000188424 [0,2,0,0,0,0|2,0,0]=4 10518 B14R1.1035 COCCNC(=O)c1ccccc1Br 7a_200000158863_200000210301 [0,2,0,0,0,0|2,0,0]=4 10519 B14R1.1035 COCCNC(=O)c1ccccc1C 1626a_100000209980_100000212026 [0,2,0,0,0,0|2,0,0]=4 10520 B14R1.1035 COCCNC(=O)c1ccccc1C 240690a_100000209980_100000212026 [0,2,0,0,0,0|2,0,0]=4 10521 B14R1.1035 COCCNC(=O)c1ccccc1C 527a_100000209980_100000212026 [0,2,0,0,0,0|2,0,0]=4 10522 B14R1.1035 COCCNC(=O)c1ccccc1Cl 1626a_100000209980_100000185844 [0,2,0,0,0,0|2,0,0]=4 10523 B14R1.1035 COCCNC(=O)c1ccccc1Cl 240690a_100000209980_100000185844 [0,2,0,0,0,0|2,0,0]=4 10524 B14R1.1035 COCCNC(=O)c1ccccc1Cl 527a_100000209980_100000185844 [0,2,0,0,0,0|2,0,0]=4 10525 B14R1.1035 COCCNC(=O)c1ccccc1F 1626a_100000209980_100000188656 [0,2,0,0,0,0|2,0,0]=4 10526 B14R1.1035 COCCNC(=O)c1ccccc1F 240690a_100000209980_100000188656 [0,2,0,0,0,0|2,0,0]=4 10527 B14R1.1035 COCCNC(=O)c1ccccc1F 527a_100000209980_100000188656 [0,2,0,0,0,0|2,0,0]=4 10528 B14R1.1035 COCCNC(=O)c1ccccc1I 1626a_100000209980_100000187884 [0,2,0,0,0,0|2,0,0]=4 10529 B14R1.1035 COCCNC(=O)c1ccccc1I 240690a_100000209980_100000187884 [0,2,0,0,0,0|2,0,0]=4 10530 B14R1.1035 COCCNC(=O)c1ccccc1I 527a_100000209980_100000187884 [0,2,0,0,0,0|2,0,0]=4 10531 B14R1.1035 COCCNC(=O)c1ccccc1O 240690a_100000209980_100015234032 [0,2,0,0,0,0|1,0,0]=3 10532 B14R1.1035 COCCNC(=O)c1ccccc1[O-] 1626a_100000209980_100009911694 [0,2,0,0,0,0|1,0,1]=4 10533 B14R1.1035 COCCNC(=O)c1ccccc1[O-] 240690a_100000209980_100009911694 [0,2,0,0,0,0|1,0,1]=4 10534 B14R1.1035 COCCNC(=O)c1ccccc1[O-] 527a_100000209980_100009911694 [0,2,0,0,0,0|1,0,1]=4 10535 B14R1.1035 COCSCC(=O)c1ccccc1Br 62a_100000199116_100000766300 [0,2,0,0,0,0|1,1,0]=4 10536 B14R1.1035 COCSCC(=O)c1ccccc1C 62a_100000741374_100000766300 [0,2,0,0,0,0|1,1,0]=4 10537 B14R1.1035 COCSCC(=O)c1ccccc1C 62a_100000766300_100000741374 [0,2,0,0,0,0|1,1,0]=4 10538 B14R1.1035 COCSCC(=O)c1ccccc1Cl 62a_100000211432_100000766300 [0,2,0,0,0,0|1,1,0]=4 10539 B14R1.1035 COCSCC(=O)c1ccccc1Cl 62a_100000766300_100000211432 [0,2,0,0,0,0|1,1,0]=4 10540 B14R1.1035 COCSCC(=O)c1ccccc1F 62a_100000204681_100000766300 [0,2,0,0,0,0|1,1,0]=4 10541 B14R1.1035 COCSCC(=O)c1ccccc1F 62a_100000766300_100000204681 [0,2,0,0,0,0|1,1,0]=4 10542 B14R1.1035 COCSCC(=O)c1ccccc1O 62a_100000188908_100000766300 [0,2,0,0,0,0|0,1,0]=3 10543 B14R1.1035 COCSCC(=O)c1ccccc1O 62a_100000766300_100000188908 [0,2,0,0,0,0|0,1,0]=3 10544 B14R1.1035 CSCCNC(=O)c1ccccc1Br 11a_100020590264_100000188424 [0,2,0,0,0,0|2,0,0]=4 10545 B14R1.1035 CSCCNC(=O)c1ccccc1Br 1626a_100020590264_100000188424 [0,2,0,0,0,0|2,0,0]=4 10546 B14R1.1035 CSCCNC(=O)c1ccccc1Br 240690a_100020590264_100000188424 [0,2,0,0,0,0|2,0,0]=4 10547 B14R1.1035 CSCCNC(=O)c1ccccc1Br 527a_100020590264_100000188424 [0,2,0,0,0,0|2,0,0]=4 10548 B14R1.1035 CSCCNC(=O)c1ccccc1C 11a_100020590264_100000212026 [0,2,0,0,0,0|2,0,0]=4 10549 B14R1.1035 CSCCNC(=O)c1ccccc1C 1626a_100020590264_100000212026 [0,2,0,0,0,0|2,0,0]=4 10550 B14R1.1035 CSCCNC(=O)c1ccccc1C 240690a_100020590264_100000212026 [0,2,0,0,0,0|2,0,0]=4 10551 B14R1.1035 CSCCNC(=O)c1ccccc1C 527a_100020590264_100000212026 [0,2,0,0,0,0|2,0,0]=4 10552 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 11a_100020590264_100000185844 [0,2,0,0,0,0|2,0,0]=4 10553 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 1626a_100020590264_100000185844 [0,2,0,0,0,0|2,0,0]=4 10554 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 240690a_100020590264_100000185844 [0,2,0,0,0,0|2,0,0]=4 10555 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 527a_100020590264_100000185844 [0,2,0,0,0,0|2,0,0]=4 10556 B14R1.1035 CSCCNC(=O)c1ccccc1F 11a_100020590264_100000188656 [0,2,0,0,0,0|2,0,0]=4 10557 B14R1.1035 CSCCNC(=O)c1ccccc1F 1626a_100020590264_100000188656 [0,2,0,0,0,0|2,0,0]=4 10558 B14R1.1035 CSCCNC(=O)c1ccccc1F 240690a_100020590264_100000188656 [0,2,0,0,0,0|2,0,0]=4 10559 B14R1.1035 CSCCNC(=O)c1ccccc1F 527a_100020590264_100000188656 [0,2,0,0,0,0|2,0,0]=4 10560 B14R1.1035 CSCCNC(=O)c1ccccc1I 11a_100020590264_100000187884 [0,2,0,0,0,0|2,0,0]=4 10561 B14R1.1035 CSCCNC(=O)c1ccccc1I 1626a_100020590264_100000187884 [0,2,0,0,0,0|2,0,0]=4 10562 B14R1.1035 CSCCNC(=O)c1ccccc1I 240690a_100020590264_100000187884 [0,2,0,0,0,0|2,0,0]=4 10563 B14R1.1035 CSCCNC(=O)c1ccccc1I 527a_100020590264_100000187884 [0,2,0,0,0,0|2,0,0]=4 10564 B14R1.1035 CSCCNC(=O)c1ccccc1O 240690a_100020590264_100015234032 [0,2,0,0,0,0|1,0,0]=3 10565 B14R1.1035 CSCCNC(=O)c1ccccc1[O-] 1626a_100020590264_100009911694 [0,2,0,0,0,0|1,0,1]=4 10566 B14R1.1035 CSCCNC(=O)c1ccccc1[O-] 240690a_100020590264_100009911694 [0,2,0,0,0,0|1,0,1]=4 10567 B14R1.1035 CSCCNC(=O)c1ccccc1[O-] 527a_100020590264_100009911694 [0,2,0,0,0,0|1,0,1]=4 10568 B14R1.1035 CSCSCC(=O)c1ccccc1Br 62a_100000199116_100011218213 [0,2,0,0,0,0|1,1,0]=4 10569 B14R1.1035 CSCSCC(=O)c1ccccc1C 62a_100000741374_100011218213 [0,2,0,0,0,0|1,1,0]=4 10570 B14R1.1035 CSCSCC(=O)c1ccccc1C 62a_100011218213_100000741374 [0,2,0,0,0,0|1,1,0]=4 10571 B14R1.1035 CSCSCC(=O)c1ccccc1Cl 62a_100000211432_100011218213 [0,2,0,0,0,0|1,1,0]=4 10572 B14R1.1035 CSCSCC(=O)c1ccccc1Cl 62a_100011218213_100000211432 [0,2,0,0,0,0|1,1,0]=4 10573 B14R1.1035 CSCSCC(=O)c1ccccc1F 62a_100000204681_100011218213 [0,2,0,0,0,0|1,1,0]=4 10574 B14R1.1035 CSCSCC(=O)c1ccccc1F 62a_100011218213_100000204681 [0,2,0,0,0,0|1,1,0]=4 10575 B14R1.1035 CSCSCC(=O)c1ccccc1O 62a_100000188908_100011218213 [0,2,0,0,0,0|0,1,0]=3 10576 B14R1.1035 CSCSCC(=O)c1ccccc1O 62a_100011218213_100000188908 [0,2,0,0,0,0|0,1,0]=3 10577 B14R1.1035 Cc1ccccc1C(=O)CCCC#N 1458a_100000212026_100000211468 [0,2,0,0,0,0|2,0,0]=4 10578 B14R1.1035 Cc1ccccc1C(=O)CCCCF 1458a_100000212026_100000729493 [0,2,0,0,0,0|2,0,0]=4 10579 B14R1.1035 Cc1ccccc1C(=O)CCCCO 1458a_100000212026_100000210776 [0,2,0,0,0,0|2,0,0]=4 10580 B14R1.1035 Cc1ccccc1C(=O)CNCCF 34a_100000724931_100000741374 [0,2,0,0,0,0|2,0,0]=4 10581 B14R1.1035 Cc1ccccc1C(=O)CNCCO 2230a_100016997473_100000741374 [0,2,0,0,0,0|2,0,0]=4 10582 B14R1.1035 Cc1ccccc1C(=O)CNCCO 34a_100016990907_100000741374 [0,2,0,0,0,0|2,0,0]=4 10583 B14R1.1035 Cc1ccccc1C(=O)COCCBr 34a_100000211926_100000741374 [0,2,0,0,0,0|1,0,0]=3 10584 B14R1.1035 Cc1ccccc1C(=O)COCCN 34a_100000210304_100000741374 [0,2,0,0,0,0|1,0,0]=3 10585 B14R1.1035 Cc1ccccc1C(=O)CSCCF 62a_100000741374_100011217306 [0,2,0,0,0,0|1,1,0]=4 10586 B14R1.1035 Cc1ccccc1C(=O)CSCCF 62a_100011217306_100000741374 [0,2,0,0,0,0|1,1,0]=4 10587 B14R1.1035 Cc1ccccc1C(=O)CSCCO 62a_100000211926_100000741374 [0,2,0,0,0,0|1,1,0]=4 10588 B14R1.1035 Cc1ccccc1C(=O)CSCCO 62a_100000741374_100000211926 [0,2,0,0,0,0|1,1,0]=4 10589 B14R1.1035 Cc1ccccc1C(=O)NCCC#N 11a_100000720768_100000212026 [0,2,0,0,0,0|2,0,0]=4 10590 B14R1.1035 Cc1ccccc1C(=O)NCCC#N 1626a_100000720768_100000212026 [0,2,0,0,0,0|2,0,0]=4 10591 B14R1.1035 Cc1ccccc1C(=O)NCCC#N 240690a_100000720768_100000212026 [0,2,0,0,0,0|2,0,0]=4 10592 B14R1.1035 Cc1ccccc1C(=O)NCCC#N 527a_100000720768_100000212026 [0,2,0,0,0,0|2,0,0]=4 10593 B14R1.1035 Cc1ccccc1C(=O)NCCCF 11a_100015189416_100000212026 [0,2,0,0,0,0|2,0,0]=4 10594 B14R1.1035 Cc1ccccc1C(=O)NCCCF 1626a_100015189416_100000212026 [0,2,0,0,0,0|2,0,0]=4 10595 B14R1.1035 Cc1ccccc1C(=O)NCCCF 240690a_100015189416_100000212026 [0,2,0,0,0,0|2,0,0]=4 10596 B14R1.1035 Cc1ccccc1C(=O)NCCCF 527a_100015189416_100000212026 [0,2,0,0,0,0|2,0,0]=4 10597 B14R1.1035 Cc1ccccc1C(=O)NCCCO 240690a_100000182051_100000212026 [0,2,0,0,0,0|2,0,0]=4 10598 B14R1.1035 Cc1ccccc1C(=O)NCCCO 527a_100000182051_100000212026 [0,2,0,0,0,0|2,0,0]=4 10599 B14R1.1035 Cc1ccccc1C(=O)NNCCO 22a_100000210001_100000212026 [0,2,0,0,0,0|2,0,0]=4 10600 B14R1.1035 N#CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000211468 [0,2,0,0,0,0|2,0,0]=4 10601 B14R1.1035 N#CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000211468 [0,2,0,0,0,0|2,0,0]=4 10602 B14R1.1035 N#CCCCC(=O)c1ccccc1F 1458a_100000188656_100000211468 [0,2,0,0,0,0|2,0,0]=4 10603 B14R1.1035 N#CCCCC(=O)c1ccccc1I 1458a_100000187884_100000211468 [0,2,0,0,0,0|2,0,0]=4 10604 B14R1.1035 N#CCCCC(=O)c1ccccc1O 1458a_100015234032_100000211468 [0,2,0,0,0,0|1,0,0]=3 10605 B14R1.1035 N#CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000211468 [0,2,0,0,0,0|1,0,1]=4 10606 B14R1.1035 N#CCCNC(=O)c1ccccc1Br 11a_100000720768_100000188424 [0,2,0,0,0,0|2,0,0]=4 10607 B14R1.1035 N#CCCNC(=O)c1ccccc1Br 1626a_100000720768_100000188424 [0,2,0,0,0,0|2,0,0]=4 10608 B14R1.1035 N#CCCNC(=O)c1ccccc1Br 240690a_100000720768_100000188424 [0,2,0,0,0,0|2,0,0]=4 10609 B14R1.1035 N#CCCNC(=O)c1ccccc1Br 527a_100000720768_100000188424 [0,2,0,0,0,0|2,0,0]=4 10610 B14R1.1035 N#CCCNC(=O)c1ccccc1Cl 11a_100000720768_100000185844 [0,2,0,0,0,0|2,0,0]=4 10611 B14R1.1035 N#CCCNC(=O)c1ccccc1Cl 1626a_100000720768_100000185844 [0,2,0,0,0,0|2,0,0]=4 10612 B14R1.1035 N#CCCNC(=O)c1ccccc1Cl 240690a_100000720768_100000185844 [0,2,0,0,0,0|2,0,0]=4 10613 B14R1.1035 N#CCCNC(=O)c1ccccc1Cl 527a_100000720768_100000185844 [0,2,0,0,0,0|2,0,0]=4 10614 B14R1.1035 N#CCCNC(=O)c1ccccc1F 11a_100000720768_100000188656 [0,2,0,0,0,0|2,0,0]=4 10615 B14R1.1035 N#CCCNC(=O)c1ccccc1F 1626a_100000720768_100000188656 [0,2,0,0,0,0|2,0,0]=4 10616 B14R1.1035 N#CCCNC(=O)c1ccccc1F 240690a_100000720768_100000188656 [0,2,0,0,0,0|2,0,0]=4 10617 B14R1.1035 N#CCCNC(=O)c1ccccc1F 527a_100000720768_100000188656 [0,2,0,0,0,0|2,0,0]=4 10618 B14R1.1035 N#CCCNC(=O)c1ccccc1I 11a_100000720768_100000187884 [0,2,0,0,0,0|2,0,0]=4 10619 B14R1.1035 N#CCCNC(=O)c1ccccc1I 1626a_100000720768_100000187884 [0,2,0,0,0,0|2,0,0]=4 10620 B14R1.1035 N#CCCNC(=O)c1ccccc1I 240690a_100000720768_100000187884 [0,2,0,0,0,0|2,0,0]=4 10621 B14R1.1035 N#CCCNC(=O)c1ccccc1I 527a_100000720768_100000187884 [0,2,0,0,0,0|2,0,0]=4 10622 B14R1.1035 N#CCCNC(=O)c1ccccc1O 240690a_100000720768_100015234032 [0,2,0,0,0,0|1,0,0]=3 10623 B14R1.1035 N#CCCNC(=O)c1ccccc1[O-] 1626a_100000720768_100009911694 [0,2,0,0,0,0|1,0,1]=4 10624 B14R1.1035 N#CCCNC(=O)c1ccccc1[O-] 240690a_100000720768_100009911694 [0,2,0,0,0,0|1,0,1]=4 10625 B14R1.1035 N#CCCNC(=O)c1ccccc1[O-] 527a_100000720768_100009911694 [0,2,0,0,0,0|1,0,1]=4 10626 B14R1.1035 N#CCSCC(=O)c1ccccc1O 62a_100000188908_100011215382 [0,2,0,0,0,0|0,1,1]=4 10627 B14R1.1035 N#CCSCC(=O)c1ccccc1O 62a_100011215382_100000188908 [0,2,0,0,0,0|0,1,1]=4 10628 B14R1.1035 NCCOCC(=O)c1ccccc1Br 34a_100000210304_100000199116 [0,2,0,0,0,0|1,0,0]=3 10629 B14R1.1035 NCCOCC(=O)c1ccccc1Cl 34a_100000210304_100000211432 [0,2,0,0,0,0|1,0,0]=3 10630 B14R1.1035 NCCOCC(=O)c1ccccc1F 34a_100000210304_100000204681 [0,2,0,0,0,0|1,0,0]=3 10631 B14R1.1035 O=C(CC#CCO)c1ccccc1O 1458a_100015234032_200000047223 [0,2,0,0,0,0|1,0,1]=4 10632 B14R1.1035 O=C(CCCCF)c1ccccc1Br 1458a_100000188424_100000729493 [0,2,0,0,0,0|2,0,0]=4 10633 B14R1.1035 O=C(CCCCF)c1ccccc1Cl 1458a_100000185844_100000729493 [0,2,0,0,0,0|2,0,0]=4 10634 B14R1.1035 O=C(CCCCF)c1ccccc1F 1458a_100000188656_100000729493 [0,2,0,0,0,0|2,0,0]=4 10635 B14R1.1035 O=C(CCCCF)c1ccccc1I 1458a_100000187884_100000729493 [0,2,0,0,0,0|2,0,0]=4 10636 B14R1.1035 O=C(CCCCF)c1ccccc1O 1458a_100015234032_100000729493 [0,2,0,0,0,0|1,0,0]=3 10637 B14R1.1035 O=C(CCCCF)c1ccccc1[O-] 1458a_100009911694_100000729493 [0,2,0,0,0,0|1,0,1]=4 10638 B14R1.1035 O=C(CCCCO)c1ccccc1Br 1458a_100000188424_100000210776 [0,2,0,0,0,0|2,0,0]=4 10639 B14R1.1035 O=C(CCCCO)c1ccccc1Cl 1458a_100000185844_100000210776 [0,2,0,0,0,0|2,0,0]=4 10640 B14R1.1035 O=C(CCCCO)c1ccccc1F 1458a_100000188656_100000210776 [0,2,0,0,0,0|2,0,0]=4 10641 B14R1.1035 O=C(CCCCO)c1ccccc1I 1458a_100000187884_100000210776 [0,2,0,0,0,0|2,0,0]=4 10642 B14R1.1035 O=C(CCCCO)c1ccccc1O 1458a_100015234032_100000210776 [0,2,0,0,0,0|1,0,0]=3 10643 B14R1.1035 O=C(CCCCO)c1ccccc1[O-] 1458a_100009911694_100000210776 [0,2,0,0,0,0|1,0,1]=4 10644 B14R1.1035 O=C(CCSCF)c1ccccc1F 62a_100000086012_100015361967 [0,2,0,0,0,0|2,0,0]=4 10645 B14R1.1035 O=C(CCSCF)c1ccccc1F 62a_100015361967_100000086012 [0,2,0,0,0,0|2,0,0]=4 10646 B14R1.1035 O=C(CCSCF)c1ccccc1O 62a_100015361967_100009873196 [0,2,0,0,0,0|1,0,0]=3 10647 B14R1.1035 O=C(CNCCF)c1ccccc1Br 34a_100000724931_100000199116 [0,2,0,0,0,0|2,0,0]=4 10648 B14R1.1035 O=C(CNCCF)c1ccccc1Cl 34a_100000724931_100000211432 [0,2,0,0,0,0|2,0,0]=4 10649 B14R1.1035 O=C(CNCCF)c1ccccc1F 34a_100000724931_100000204681 [0,2,0,0,0,0|2,0,0]=4 10650 B14R1.1035 O=C(CNCCO)c1ccccc1Br 34a_100016990907_100000199116 [0,2,0,0,0,0|2,0,0]=4 10651 B14R1.1035 O=C(CNCCO)c1ccccc1Cl 34a_100016990907_100000211432 [0,2,0,0,0,0|2,0,0]=4 10652 B14R1.1035 O=C(CNCCO)c1ccccc1F 34a_100016990907_100000204681 [0,2,0,0,0,0|2,0,0]=4 10653 B14R1.1035 O=C(COCCBr)c1ccccc1Br 34a_100000211926_100000199116 [0,2,0,0,0,0|1,0,0]=3 10654 B14R1.1035 O=C(COCCBr)c1ccccc1Cl 34a_100000211926_100000211432 [0,2,0,0,0,0|1,0,0]=3 10655 B14R1.1035 O=C(COCCBr)c1ccccc1F 34a_100000211926_100000204681 [0,2,0,0,0,0|1,0,0]=3 10656 B14R1.1035 O=C(CSCCF)c1ccccc1Br 62a_100000199116_100011217306 [0,2,0,0,0,0|1,1,0]=4 10657 B14R1.1035 O=C(CSCCF)c1ccccc1Cl 62a_100000211432_100011217306 [0,2,0,0,0,0|1,1,0]=4 10658 B14R1.1035 O=C(CSCCF)c1ccccc1Cl 62a_100011217306_100000211432 [0,2,0,0,0,0|1,1,0]=4 10659 B14R1.1035 O=C(CSCCF)c1ccccc1F 62a_100000204681_100011217306 [0,2,0,0,0,0|1,1,0]=4 10660 B14R1.1035 O=C(CSCCF)c1ccccc1F 62a_100011217306_100000204681 [0,2,0,0,0,0|1,1,0]=4 10661 B14R1.1035 O=C(CSCCF)c1ccccc1O 62a_100000188908_100011217306 [0,2,0,0,0,0|0,1,0]=3 10662 B14R1.1035 O=C(CSCCF)c1ccccc1O 62a_100011217306_100000188908 [0,2,0,0,0,0|0,1,0]=3 10663 B14R1.1035 O=C(CSCCO)c1ccccc1Br 62a_100000199116_100000211926 [0,2,0,0,0,0|1,1,0]=4 10664 B14R1.1035 O=C(CSCCO)c1ccccc1Cl 62a_100000211432_100000211926 [0,2,0,0,0,0|1,1,0]=4 10665 B14R1.1035 O=C(CSCCO)c1ccccc1Cl 62a_100000211926_100000211432 [0,2,0,0,0,0|1,1,0]=4 10666 B14R1.1035 O=C(CSCCO)c1ccccc1F 62a_100000204681_100000211926 [0,2,0,0,0,0|1,1,0]=4 10667 B14R1.1035 O=C(CSCCO)c1ccccc1F 62a_100000211926_100000204681 [0,2,0,0,0,0|1,1,0]=4 10668 B14R1.1035 O=C(CSCCO)c1ccccc1O 62a_100000188908_100000211926 [0,2,0,0,0,0|0,1,0]=3 10669 B14R1.1035 O=C(CSCCO)c1ccccc1O 62a_100000211926_100000188908 [0,2,0,0,0,0|0,1,0]=3 10670 B14R1.1035 O=C(NCCCF)c1ccccc1Br 11a_100015189416_100000188424 [0,2,0,0,0,0|2,0,0]=4 10671 B14R1.1035 O=C(NCCCF)c1ccccc1Br 1626a_100015189416_100000188424 [0,2,0,0,0,0|2,0,0]=4 10672 B14R1.1035 O=C(NCCCF)c1ccccc1Br 240690a_100015189416_100000188424 [0,2,0,0,0,0|2,0,0]=4 10673 B14R1.1035 O=C(NCCCF)c1ccccc1Br 527a_100015189416_100000188424 [0,2,0,0,0,0|2,0,0]=4 10674 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 11a_100015189416_100000185844 [0,2,0,0,0,0|2,0,0]=4 10675 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 1626a_100015189416_100000185844 [0,2,0,0,0,0|2,0,0]=4 10676 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 240690a_100015189416_100000185844 [0,2,0,0,0,0|2,0,0]=4 10677 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 527a_100015189416_100000185844 [0,2,0,0,0,0|2,0,0]=4 10678 B14R1.1035 O=C(NCCCF)c1ccccc1F 11a_100015189416_100000188656 [0,2,0,0,0,0|2,0,0]=4 10679 B14R1.1035 O=C(NCCCF)c1ccccc1F 1626a_100015189416_100000188656 [0,2,0,0,0,0|2,0,0]=4 10680 B14R1.1035 O=C(NCCCF)c1ccccc1F 240690a_100015189416_100000188656 [0,2,0,0,0,0|2,0,0]=4 10681 B14R1.1035 O=C(NCCCF)c1ccccc1F 527a_100015189416_100000188656 [0,2,0,0,0,0|2,0,0]=4 10682 B14R1.1035 O=C(NCCCF)c1ccccc1I 11a_100015189416_100000187884 [0,2,0,0,0,0|2,0,0]=4 10683 B14R1.1035 O=C(NCCCF)c1ccccc1I 1626a_100015189416_100000187884 [0,2,0,0,0,0|2,0,0]=4 10684 B14R1.1035 O=C(NCCCF)c1ccccc1I 240690a_100015189416_100000187884 [0,2,0,0,0,0|2,0,0]=4 10685 B14R1.1035 O=C(NCCCF)c1ccccc1I 527a_100015189416_100000187884 [0,2,0,0,0,0|2,0,0]=4 10686 B14R1.1035 O=C(NCCCF)c1ccccc1O 240690a_100015189416_100015234032 [0,2,0,0,0,0|1,0,0]=3 10687 B14R1.1035 O=C(NCCCF)c1ccccc1[O-] 1626a_100015189416_100009911694 [0,2,0,0,0,0|1,0,1]=4 10688 B14R1.1035 O=C(NCCCF)c1ccccc1[O-] 240690a_100015189416_100009911694 [0,2,0,0,0,0|1,0,1]=4 10689 B14R1.1035 O=C(NCCCF)c1ccccc1[O-] 527a_100015189416_100009911694 [0,2,0,0,0,0|1,0,1]=4 10690 B14R1.1035 O=C(NCCCO)c1ccccc1Br 240690a_100000182051_100000188424 [0,2,0,0,0,0|2,0,0]=4 10691 B14R1.1035 O=C(NCCCO)c1ccccc1Br 527a_100000182051_100000188424 [0,2,0,0,0,0|2,0,0]=4 10692 B14R1.1035 O=C(NCCCO)c1ccccc1Cl 240690a_100000182051_100000185844 [0,2,0,0,0,0|2,0,0]=4 10693 B14R1.1035 O=C(NCCCO)c1ccccc1Cl 527a_100000182051_100000185844 [0,2,0,0,0,0|2,0,0]=4 10694 B14R1.1035 O=C(NCCCO)c1ccccc1F 240690a_100000182051_100000188656 [0,2,0,0,0,0|2,0,0]=4 10695 B14R1.1035 O=C(NCCCO)c1ccccc1F 527a_100000182051_100000188656 [0,2,0,0,0,0|2,0,0]=4 10696 B14R1.1035 O=C(NCCCO)c1ccccc1I 240690a_100000182051_100000187884 [0,2,0,0,0,0|2,0,0]=4 10697 B14R1.1035 O=C(NCCCO)c1ccccc1I 527a_100000182051_100000187884 [0,2,0,0,0,0|2,0,0]=4 10698 B14R1.1035 O=C(NCCCO)c1ccccc1O 240690a_100000182051_100015234032 [0,2,0,0,0,0|1,0,0]=3 10699 B14R1.1035 O=C(NCCCO)c1ccccc1[O-] 240690a_100000182051_100009911694 [0,2,0,0,0,0|1,0,1]=4 10700 B14R1.1035 O=C(NCCCO)c1ccccc1[O-] 527a_100000182051_100009911694 [0,2,0,0,0,0|1,0,1]=4 10701 B14R1.1035 O=C(NNCCO)c1ccccc1Br 22a_100000210001_100000188424 [0,2,0,0,0,0|2,0,0]=4 10702 B14R1.1035 O=C(NNCCO)c1ccccc1Cl 22a_100000210001_100000185844 [0,2,0,0,0,0|2,0,0]=4 10703 B14R1.1035 O=C(NNCCO)c1ccccc1F 22a_100000210001_100000188656 [0,2,0,0,0,0|2,0,0]=4 10704 B14R1.1035 O=C(NNCCO)c1ccccc1I 22a_100000210001_100000187884 [0,2,0,0,0,0|2,0,0]=4 10705 B14R1.1035 O=C(NNCCO)c1ccccc1O 22a_100000210001_100015234032 [0,2,0,0,0,0|1,0,0]=3 10706 B14R1.1035 O=C(NNCCO)c1ccccc1[O-] 22a_100000210001_100009911694 [0,2,0,0,0,0|1,0,1]=4 10707 B14R1.1035 O=CCSCC(=O)c1ccccc1O 62a_100000188908_200015260668 [0,2,0,0,0,0|0,1,1]=4 10708 B14R1.1035 O=CCSCC(=O)c1ccccc1O 62a_200015260668_100000188908 [0,2,0,0,0,0|0,1,1]=4 10709 B14R1.1035 [13CH3]NCCNC(=O)c1ccccc1Cl 2230a_100000737833_200025704644 [0,2,0,0,0,0|2,0,0]=4 10710 B14R1.1035 [13CH3]NCCNC(=O)c1ccccc1Cl 34a_100000737833_200025704644 [0,2,0,0,0,0|2,0,0]=4 10711 B14R1.1035 [13CH3]OCCNC(=O)c1ccccc1Br 34a_200000158863_200025704644 [0,2,0,0,0,0|2,0,0]=4 10712 B14R1.1035 [13CH3]OCCNC(=O)c1ccccc1Br 7a_200000158863_200025704644 [0,2,0,0,0,0|2,0,0]=4 10713 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000753159 [0,2,0,0,0,0|1,0,1]=4 10714 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000753159 [0,2,0,0,0,0|1,0,1]=4 10715 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000753159 [0,2,0,0,0,0|1,0,1]=4 10716 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000753159 [0,2,0,0,0,0|1,0,1]=4 10717 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000753159 [0,2,0,0,0,0|1,0,1]=4 10718 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000753159 [0,2,0,0,0,0|1,0,1]=4 10719 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)Br 240690a_100000212058_100000744433 [0,2,0,0,0,0|1,0,1]=4 10720 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)Br 527a_100000212058_100000744433 [0,2,0,0,0,0|1,0,1]=4 10721 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)C 1626a_100000212058_100000212137 [0,2,0,0,0,0|1,0,1]=4 10722 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)C 240690a_100000212058_100000212137 [0,2,0,0,0,0|1,0,1]=4 10723 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)C 527a_100000212058_100000212137 [0,2,0,0,0,0|1,0,1]=4 10724 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)Cl 11a_100000212058_100000188622 [0,2,0,0,0,0|1,0,1]=4 10725 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)Cl 240690a_100000212058_100000188622 [0,2,0,0,0,0|1,0,1]=4 10726 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)Cl 527a_100000212058_100000188622 [0,2,0,0,0,0|1,0,1]=4 10727 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)F 240690a_100000212058_100000746061 [0,2,0,0,0,0|1,0,1]=4 10728 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)F 527a_100000212058_100000746061 [0,2,0,0,0,0|1,0,1]=4 10729 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)I 240690a_100000212058_100000091984 [0,2,0,0,0,0|1,0,1]=4 10730 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)I 527a_100000212058_100000091984 [0,2,0,0,0,0|1,0,1]=4 10731 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100102629194 [0,2,0,0,0,0|1,0,1]=4 10732 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)C 1458a_100000212137_100102629194 [0,2,0,0,0,0|1,0,1]=4 10733 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100102629194 [0,2,0,0,0,0|1,0,1]=4 10734 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)F 1458a_100000746061_100102629194 [0,2,0,0,0,0|1,0,1]=4 10735 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)I 1458a_100000091984_100102629194 [0,2,0,0,0,0|1,0,1]=4 10736 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)O 1458a_100000212172_100102629194 [0,2,0,0,0,0|1,0,1]=4 10737 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000754431 [0,2,0,0,0,0|1,0,1]=4 10738 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000754431 [0,2,0,0,0,0|1,0,1]=4 10739 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000754431 [0,2,0,0,0,0|1,0,1]=4 10740 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000754431 [0,2,0,0,0,0|1,0,1]=4 10741 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000754431 [0,2,0,0,0,0|1,0,1]=4 10742 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000754431 [0,2,0,0,0,0|1,0,1]=4 10743 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Br 240690a_100020586998_100000744433 [0,2,0,0,0,0|1,0,1]=4 10744 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Br 527a_100020586998_100000744433 [0,2,0,0,0,0|1,0,1]=4 10745 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)C 1626a_100020586998_100000212137 [0,2,0,0,0,0|1,0,1]=4 10746 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)C 240690a_100020586998_100000212137 [0,2,0,0,0,0|1,0,1]=4 10747 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)C 527a_100020586998_100000212137 [0,2,0,0,0,0|1,0,1]=4 10748 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Cl 240690a_100020586998_100000188622 [0,2,0,0,0,0|1,0,1]=4 10749 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Cl 527a_100020586998_100000188622 [0,2,0,0,0,0|1,0,1]=4 10750 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)F 240690a_100020586998_100000746061 [0,2,0,0,0,0|1,0,1]=4 10751 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)F 527a_100020586998_100000746061 [0,2,0,0,0,0|1,0,1]=4 10752 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)I 240690a_100020586998_100000091984 [0,2,0,0,0,0|1,0,1]=4 10753 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)I 527a_100020586998_100000091984 [0,2,0,0,0,0|1,0,1]=4 10754 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000748600 [0,2,0,0,0,0|1,0,1]=4 10755 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000748600 [0,2,0,0,0,0|1,0,1]=4 10756 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000748600 [0,2,0,0,0,0|1,0,1]=4 10757 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000748600 [0,2,0,0,0,0|1,0,1]=4 10758 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000748600 [0,2,0,0,0,0|1,0,1]=4 10759 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000748600 [0,2,0,0,0,0|1,0,1]=4 10760 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000070051 [0,2,0,0,0,0|1,0,1]=4 10761 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000070051 [0,2,0,0,0,0|1,0,1]=4 10762 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000070051 [0,2,0,0,0,0|1,0,1]=4 10763 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000070051 [0,2,0,0,0,0|1,0,1]=4 10764 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000070051 [0,2,0,0,0,0|1,0,1]=4 10765 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000070051 [0,2,0,0,0,0|1,0,1]=4 10766 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210211 [0,2,0,0,0,0|2,0,0]=4 10767 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210211 [0,2,0,0,0,0|2,0,0]=4 10768 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210211 [0,2,0,0,0,0|2,0,0]=4 10769 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210211 [0,2,0,0,0,0|2,0,0]=4 10770 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210211 [0,2,0,0,0,0|2,0,0]=4 10771 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210211 [0,2,0,0,0,0|2,0,0]=4 10772 B14R1.2523 CCCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210211 [0,2,0,0,0,0|2,0,0]=4 10773 B14R1.2523 CCCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210211 [0,2,0,0,0,0|2,0,0]=4 10774 B14R1.2523 CCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210211 [0,2,0,0,0,0|2,0,0]=4 10775 B14R1.2523 CCCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210211 [0,2,0,0,0,0|2,0,0]=4 10776 B14R1.2523 CCCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210211 [0,2,0,0,0,0|2,0,0]=4 10777 B14R1.2523 CCCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210211 [0,2,0,0,0,0|2,0,0]=4 10778 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210211 [0,2,0,0,0,0|2,0,0]=4 10779 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210211 [0,2,0,0,0,0|2,0,0]=4 10780 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210211 [0,2,0,0,0,0|2,0,0]=4 10781 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210211 [0,2,0,0,0,0|2,0,0]=4 10782 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210211 [0,2,0,0,0,0|2,0,0]=4 10783 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210211 [0,2,0,0,0,0|2,0,0]=4 10784 B14R1.2523 CCCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210211 [0,2,0,0,0,0|2,0,0]=4 10785 B14R1.2523 CCCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210211 [0,2,0,0,0,0|2,0,0]=4 10786 B14R1.2523 CCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210211 [0,2,0,0,0,0|2,0,0]=4 10787 B14R1.2523 CCCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210211 [0,2,0,0,0,0|2,0,0]=4 10788 B14R1.2523 CCCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210211 [0,2,0,0,0,0|2,0,0]=4 10789 B14R1.2523 CCCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210211 [0,2,0,0,0,0|2,0,0]=4 10790 B14R1.2523 CCCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210211 [0,2,0,0,0,0|2,0,0]=4 10791 B14R1.2523 CCCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210211 [0,2,0,0,0,0|2,0,0]=4 10792 B14R1.2523 CCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210211 [0,2,0,0,0,0|2,0,0]=4 10793 B14R1.2523 CCCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210211 [0,2,0,0,0,0|2,0,0]=4 10794 B14R1.2523 CCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210211 [0,2,0,0,0,0|1,0,0]=3 10795 B14R1.2523 CCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210211 [0,2,0,0,0,0|1,0,0]=3 10796 B14R1.2523 CCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210211 [0,2,0,0,0,0|1,0,0]=3 10797 B14R1.2523 CCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210211 [0,2,0,0,0,0|1,0,0]=3 10798 B14R1.2523 CCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210211 [0,2,0,0,0,0|1,0,0]=3 10799 B14R1.2523 CCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210211 [0,2,0,0,0,0|1,0,0]=3 10800 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 11a_100020643023_100000762965 [0,2,0,0,0,0|2,0,0]=4 10801 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 1626a_100020643023_100000762965 [0,2,0,0,0,0|2,0,0]=4 10802 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 240690a_100020643023_100000762965 [0,2,0,0,0,0|2,0,0]=4 10803 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 527a_100020643023_100000762965 [0,2,0,0,0,0|2,0,0]=4 10804 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 11a_100020643023_100000685072 [0,2,0,0,0,0|2,0,0]=4 10805 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 1626a_100020643023_100000685072 [0,2,0,0,0,0|2,0,0]=4 10806 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 240690a_100020643023_100000685072 [0,2,0,0,0,0|2,0,0]=4 10807 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 527a_100020643023_100000685072 [0,2,0,0,0,0|2,0,0]=4 10808 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 11a_100020643023_100000766353 [0,2,0,0,0,0|2,0,0]=4 10809 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 1626a_100020643023_100000766353 [0,2,0,0,0,0|2,0,0]=4 10810 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 240690a_100020643023_100000766353 [0,2,0,0,0,0|2,0,0]=4 10811 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 527a_100020643023_100000766353 [0,2,0,0,0,0|2,0,0]=4 10812 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 11a_100020643023_100000212304 [0,2,0,0,0,0|2,0,0]=4 10813 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 1626a_100020643023_100000212304 [0,2,0,0,0,0|2,0,0]=4 10814 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 240690a_100020643023_100000212304 [0,2,0,0,0,0|2,0,0]=4 10815 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 527a_100020643023_100000212304 [0,2,0,0,0,0|2,0,0]=4 10816 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 11a_100020643023_100012360512 [0,2,0,0,0,0|2,0,0]=4 10817 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 1626a_100020643023_100012360512 [0,2,0,0,0,0|2,0,0]=4 10818 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 240690a_100020643023_100012360512 [0,2,0,0,0,0|2,0,0]=4 10819 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 527a_100020643023_100012360512 [0,2,0,0,0,0|2,0,0]=4 10820 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)O 240690a_100020643023_100012344906 [0,2,0,0,0,0|2,0,0]=4 10821 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)O 527a_100020643023_100012344906 [0,2,0,0,0,0|2,0,0]=4 10822 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 11a_100020643023_100000741311 [0,2,0,0,0,0|2,0,0]=4 10823 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 1626a_100020643023_100000741311 [0,2,0,0,0,0|2,0,0]=4 10824 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 240690a_100020643023_100000741311 [0,2,0,0,0,0|2,0,0]=4 10825 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 527a_100020643023_100000741311 [0,2,0,0,0,0|2,0,0]=4 10826 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 11a_100020643023_100000211164 [0,2,0,0,0,0|2,0,0]=4 10827 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 1626a_100020643023_100000211164 [0,2,0,0,0,0|2,0,0]=4 10828 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 240690a_100020643023_100000211164 [0,2,0,0,0,0|2,0,0]=4 10829 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 527a_100020643023_100000211164 [0,2,0,0,0,0|2,0,0]=4 10830 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 11a_100020643023_100000688705 [0,2,0,0,0,0|2,0,0]=4 10831 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 1626a_100020643023_100000688705 [0,2,0,0,0,0|2,0,0]=4 10832 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 240690a_100020643023_100000688705 [0,2,0,0,0,0|2,0,0]=4 10833 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 527a_100020643023_100000688705 [0,2,0,0,0,0|2,0,0]=4 10834 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 11a_100020643023_100000686989 [0,2,0,0,0,0|2,0,0]=4 10835 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 1626a_100020643023_100000686989 [0,2,0,0,0,0|2,0,0]=4 10836 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 240690a_100020643023_100000686989 [0,2,0,0,0,0|2,0,0]=4 10837 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 527a_100020643023_100000686989 [0,2,0,0,0,0|2,0,0]=4 10838 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 11a_100020643023_100010189873 [0,2,0,0,0,0|2,0,0]=4 10839 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 1626a_100020643023_100010189873 [0,2,0,0,0,0|2,0,0]=4 10840 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 240690a_100020643023_100010189873 [0,2,0,0,0,0|2,0,0]=4 10841 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 527a_100020643023_100010189873 [0,2,0,0,0,0|2,0,0]=4 10842 B14R1.2523 CCCNC(=O)c1ccc(cc1C)O 240690a_100020643023_100000692822 [0,2,0,0,0,0|2,0,0]=4 10843 B14R1.2523 CCCNC(=O)c1ccc(cc1C)O 527a_100020643023_100000692822 [0,2,0,0,0,0|2,0,0]=4 10844 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 11a_100020643023_100000741628 [0,2,0,0,0,0|2,0,0]=4 10845 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 1626a_100020643023_100000741628 [0,2,0,0,0,0|2,0,0]=4 10846 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 240690a_100020643023_100000741628 [0,2,0,0,0,0|2,0,0]=4 10847 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 527a_100020643023_100000741628 [0,2,0,0,0,0|2,0,0]=4 10848 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 11a_100020643023_100000766932 [0,2,0,0,0,0|2,0,0]=4 10849 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 1626a_100020643023_100000766932 [0,2,0,0,0,0|2,0,0]=4 10850 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 240690a_100020643023_100000766932 [0,2,0,0,0,0|2,0,0]=4 10851 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 527a_100020643023_100000766932 [0,2,0,0,0,0|2,0,0]=4 10852 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 11a_100020643023_100000185840 [0,2,0,0,0,0|2,0,0]=4 10853 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100020643023_100000185840 [0,2,0,0,0,0|2,0,0]=4 10854 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100020643023_100000185840 [0,2,0,0,0,0|2,0,0]=4 10855 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 527a_100020643023_100000185840 [0,2,0,0,0,0|2,0,0]=4 10856 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 11a_100020643023_100000211397 [0,2,0,0,0,0|2,0,0]=4 10857 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 1626a_100020643023_100000211397 [0,2,0,0,0,0|2,0,0]=4 10858 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 240690a_100020643023_100000211397 [0,2,0,0,0,0|2,0,0]=4 10859 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 527a_100020643023_100000211397 [0,2,0,0,0,0|2,0,0]=4 10860 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 11a_100020643023_100000751301 [0,2,0,0,0,0|2,0,0]=4 10861 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 1626a_100020643023_100000751301 [0,2,0,0,0,0|2,0,0]=4 10862 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 240690a_100020643023_100000751301 [0,2,0,0,0,0|2,0,0]=4 10863 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 527a_100020643023_100000751301 [0,2,0,0,0,0|2,0,0]=4 10864 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)O 240690a_100020643023_100000702456 [0,2,0,0,0,0|2,0,0]=4 10865 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)O 527a_100020643023_100000702456 [0,2,0,0,0,0|2,0,0]=4 10866 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 11a_100020643023_100000214689 [0,2,0,0,0,0|2,0,0]=4 10867 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 1626a_100020643023_100000214689 [0,2,0,0,0,0|2,0,0]=4 10868 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 240690a_100020643023_100000214689 [0,2,0,0,0,0|2,0,0]=4 10869 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 527a_100020643023_100000214689 [0,2,0,0,0,0|2,0,0]=4 10870 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 11a_100020643023_100000766033 [0,2,0,0,0,0|2,0,0]=4 10871 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 1626a_100020643023_100000766033 [0,2,0,0,0,0|2,0,0]=4 10872 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 240690a_100020643023_100000766033 [0,2,0,0,0,0|2,0,0]=4 10873 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 527a_100020643023_100000766033 [0,2,0,0,0,0|2,0,0]=4 10874 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 11a_100020643023_100000212326 [0,2,0,0,0,0|2,0,0]=4 10875 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 1626a_100020643023_100000212326 [0,2,0,0,0,0|2,0,0]=4 10876 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 240690a_100020643023_100000212326 [0,2,0,0,0,0|2,0,0]=4 10877 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 527a_100020643023_100000212326 [0,2,0,0,0,0|2,0,0]=4 10878 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 11a_100020643023_100000211022 [0,2,0,0,0,0|2,0,0]=4 10879 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 1626a_100020643023_100000211022 [0,2,0,0,0,0|2,0,0]=4 10880 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 240690a_100020643023_100000211022 [0,2,0,0,0,0|2,0,0]=4 10881 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 527a_100020643023_100000211022 [0,2,0,0,0,0|2,0,0]=4 10882 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 11a_100020643023_100000037189 [0,2,0,0,0,0|2,0,0]=4 10883 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 1626a_100020643023_100000037189 [0,2,0,0,0,0|2,0,0]=4 10884 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 240690a_100020643023_100000037189 [0,2,0,0,0,0|2,0,0]=4 10885 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 527a_100020643023_100000037189 [0,2,0,0,0,0|2,0,0]=4 10886 B14R1.2523 CCCNC(=O)c1ccc(cc1F)O 240690a_100020643023_100000689029 [0,2,0,0,0,0|2,0,0]=4 10887 B14R1.2523 CCCNC(=O)c1ccc(cc1F)O 271570a_203496583355_200000215516 [0,2,0,0,0,0|2,0,0]=4 10888 B14R1.2523 CCCNC(=O)c1ccc(cc1F)O 527a_100020643023_100000689029 [0,2,0,0,0,0|2,0,0]=4 10889 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 11a_100020643023_100000751167 [0,2,0,0,0,0|2,0,0]=4 10890 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 1626a_100020643023_100000751167 [0,2,0,0,0,0|2,0,0]=4 10891 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 240690a_100020643023_100000751167 [0,2,0,0,0,0|2,0,0]=4 10892 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 527a_100020643023_100000751167 [0,2,0,0,0,0|2,0,0]=4 10893 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 11a_100020643023_100009999607 [0,2,0,0,0,0|2,0,0]=4 10894 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 1626a_100020643023_100009999607 [0,2,0,0,0,0|2,0,0]=4 10895 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 240690a_100020643023_100009999607 [0,2,0,0,0,0|2,0,0]=4 10896 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 527a_100020643023_100009999607 [0,2,0,0,0,0|2,0,0]=4 10897 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 11a_100020643023_100000739380 [0,2,0,0,0,0|2,0,0]=4 10898 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 1626a_100020643023_100000739380 [0,2,0,0,0,0|2,0,0]=4 10899 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 240690a_100020643023_100000739380 [0,2,0,0,0,0|2,0,0]=4 10900 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 527a_100020643023_100000739380 [0,2,0,0,0,0|2,0,0]=4 10901 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 11a_100020643023_100000739341 [0,2,0,0,0,0|2,0,0]=4 10902 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 1626a_100020643023_100000739341 [0,2,0,0,0,0|2,0,0]=4 10903 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 240690a_100020643023_100000739341 [0,2,0,0,0,0|2,0,0]=4 10904 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 527a_100020643023_100000739341 [0,2,0,0,0,0|2,0,0]=4 10905 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Br 240690a_100020643023_100000744433 [0,2,0,0,0,0|1,0,0]=3 10906 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Br 527a_100020643023_100000744433 [0,2,0,0,0,0|1,0,0]=3 10907 B14R1.2523 CCCNC(=O)c1ccc(cc1O)C 1626a_100020643023_100000212137 [0,2,0,0,0,0|1,0,0]=3 10908 B14R1.2523 CCCNC(=O)c1ccc(cc1O)C 240690a_100020643023_100000212137 [0,2,0,0,0,0|1,0,0]=3 10909 B14R1.2523 CCCNC(=O)c1ccc(cc1O)C 527a_100020643023_100000212137 [0,2,0,0,0,0|1,0,0]=3 10910 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Cl 11a_100020643023_100000188622 [0,2,0,0,0,0|1,0,0]=3 10911 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Cl 240690a_100020643023_100000188622 [0,2,0,0,0,0|1,0,0]=3 10912 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Cl 527a_100020643023_100000188622 [0,2,0,0,0,0|1,0,0]=3 10913 B14R1.2523 CCCNC(=O)c1ccc(cc1O)F 240690a_100020643023_100000746061 [0,2,0,0,0,0|1,0,0]=3 10914 B14R1.2523 CCCNC(=O)c1ccc(cc1O)F 527a_100020643023_100000746061 [0,2,0,0,0,0|1,0,0]=3 10915 B14R1.2523 CCCNC(=O)c1ccc(cc1O)I 240690a_100020643023_100000091984 [0,2,0,0,0,0|1,0,0]=3 10916 B14R1.2523 CCCNC(=O)c1ccc(cc1O)I 527a_100020643023_100000091984 [0,2,0,0,0,0|1,0,0]=3 10917 B14R1.2523 CCNCC(=O)c1ccc(cc1C)C 2230a_100015525214_100000229959 [0,2,0,0,0,0|2,0,0]=4 10918 B14R1.2523 CCNCC(=O)c1ccc(cc1Cl)Cl 2230a_100015525214_100011218845 [0,2,0,0,0,0|2,0,0]=4 10919 B14R1.2523 CCNCC(=O)c1ccc(cc1Cl)F 2230a_100015525214_100012056422 [0,2,0,0,0,0|2,0,0]=4 10920 B14R1.2523 CCNN=C(C)c1ccc(cc1O)Br 4a_100000756455_100000188348 [0,2,0,0,0,0|2,0,0]=4 10921 B14R1.2523 CCNN=C(C)c1ccc(cc1O)C 4a_100000756455_100000234885 [0,2,0,0,0,0|2,0,0]=4 10922 B14R1.2523 CCNN=C(C)c1ccc(cc1O)Cl 4a_100000756455_100000061402 [0,2,0,0,0,0|2,0,0]=4 10923 B14R1.2523 CCNN=C(C)c1ccc(cc1O)F 4a_100000756455_100011215782 [0,2,0,0,0,0|2,0,0]=4 10924 B14R1.2523 CCNN=C(C)c1ccc(cc1O)O 4a_100000756455_100000189368 [0,2,0,0,0,0|2,0,0]=4 10925 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)Br 22a_100000756455_100000762965 [0,2,0,0,0,0|2,0,0]=4 10926 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)C 22a_100000756455_100000685072 [0,2,0,0,0,0|2,0,0]=4 10927 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)Cl 22a_100000756455_100000766353 [0,2,0,0,0,0|2,0,0]=4 10928 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)F 22a_100000756455_100000212304 [0,2,0,0,0,0|2,0,0]=4 10929 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)I 22a_100000756455_100012360512 [0,2,0,0,0,0|2,0,0]=4 10930 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)O 22a_100000756455_100012344906 [0,2,0,0,0,0|2,0,0]=4 10931 B14R1.2523 CCNNC(=O)c1ccc(cc1C)Br 22a_100000756455_100000741311 [0,2,0,0,0,0|2,0,0]=4 10932 B14R1.2523 CCNNC(=O)c1ccc(cc1C)C 22a_100000756455_100000211164 [0,2,0,0,0,0|2,0,0]=4 10933 B14R1.2523 CCNNC(=O)c1ccc(cc1C)Cl 22a_100000756455_100000688705 [0,2,0,0,0,0|2,0,0]=4 10934 B14R1.2523 CCNNC(=O)c1ccc(cc1C)F 22a_100000756455_100000686989 [0,2,0,0,0,0|2,0,0]=4 10935 B14R1.2523 CCNNC(=O)c1ccc(cc1C)I 22a_100000756455_100010189873 [0,2,0,0,0,0|2,0,0]=4 10936 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)Br 22a_100000756455_100000741628 [0,2,0,0,0,0|2,0,0]=4 10937 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)C 22a_100000756455_100000766932 [0,2,0,0,0,0|2,0,0]=4 10938 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)Cl 22a_100000756455_100000185840 [0,2,0,0,0,0|2,0,0]=4 10939 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)F 22a_100000756455_100000211397 [0,2,0,0,0,0|2,0,0]=4 10940 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)I 22a_100000756455_100000751301 [0,2,0,0,0,0|2,0,0]=4 10941 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)O 22a_100000756455_100000702456 [0,2,0,0,0,0|2,0,0]=4 10942 B14R1.2523 CCNNC(=O)c1ccc(cc1F)Br 22a_100000756455_100000214689 [0,2,0,0,0,0|2,0,0]=4 10943 B14R1.2523 CCNNC(=O)c1ccc(cc1F)C 22a_100000756455_100000766033 [0,2,0,0,0,0|2,0,0]=4 10944 B14R1.2523 CCNNC(=O)c1ccc(cc1F)Cl 22a_100000756455_100000212326 [0,2,0,0,0,0|2,0,0]=4 10945 B14R1.2523 CCNNC(=O)c1ccc(cc1F)F 22a_100000756455_100000211022 [0,2,0,0,0,0|2,0,0]=4 10946 B14R1.2523 CCNNC(=O)c1ccc(cc1F)I 22a_100000756455_100000037189 [0,2,0,0,0,0|2,0,0]=4 10947 B14R1.2523 CCNNC(=O)c1ccc(cc1F)O 22a_100000756455_100000689029 [0,2,0,0,0,0|2,0,0]=4 10948 B14R1.2523 CCNNC(=O)c1ccc(cc1I)Br 22a_100000756455_100000751167 [0,2,0,0,0,0|2,0,0]=4 10949 B14R1.2523 CCNNC(=O)c1ccc(cc1I)C 22a_100000756455_100009999607 [0,2,0,0,0,0|2,0,0]=4 10950 B14R1.2523 CCNNC(=O)c1ccc(cc1I)Cl 22a_100000756455_100000739380 [0,2,0,0,0,0|2,0,0]=4 10951 B14R1.2523 CCNNC(=O)c1ccc(cc1I)F 22a_100000756455_100000739341 [0,2,0,0,0,0|2,0,0]=4 10952 B14R1.2523 CCNNC(=O)c1ccc(cc1O)Br 22a_100000756455_100000744433 [0,2,0,0,0,0|1,0,0]=3 10953 B14R1.2523 CCNNC(=O)c1ccc(cc1O)C 22a_100000756455_100000212137 [0,2,0,0,0,0|1,0,0]=3 10954 B14R1.2523 CCNNC(=O)c1ccc(cc1O)Cl 22a_100000756455_100000188622 [0,2,0,0,0,0|1,0,0]=3 10955 B14R1.2523 CCNNC(=O)c1ccc(cc1O)F 22a_100000756455_100000746061 [0,2,0,0,0,0|1,0,0]=3 10956 B14R1.2523 CCNNC(=O)c1ccc(cc1O)I 22a_100000756455_100000091984 [0,2,0,0,0,0|1,0,0]=3 10957 B14R1.2523 CCNNC(=O)c1ccc(cc1O)O 22a_100000756455_100000212172 [0,2,0,0,0,0|1,0,0]=3 10958 B14R1.2523 CCOCC(=O)c1ccc(cc1Br)F 34a_100121572206_100012361341 [0,2,0,0,0,0|1,0,0]=3 10959 B14R1.2523 CCOCC(=O)c1ccc(cc1C)C 34a_100121572206_100000229959 [0,2,0,0,0,0|1,0,0]=3 10960 B14R1.2523 CCOCC(=O)c1ccc(cc1Cl)F 34a_100121572206_100012056422 [0,2,0,0,0,0|1,0,0]=3 10961 B14R1.2523 CCOCC(=O)c1ccc(cc1F)Br 34a_100121572206_200012361339 [0,2,0,0,0,0|1,0,0]=3 10962 B14R1.2523 CCOCC(=O)c1ccc(cc1F)Cl 34a_100121572206_100012351891 [0,2,0,0,0,0|1,0,0]=3 10963 B14R1.2523 CCOCC(=O)c1ccc(cc1F)F 34a_100121572206_100000229962 [0,2,0,0,0,0|1,0,0]=3 10964 B14R1.2523 CCOCC(=O)c1ccc(cc1O)F 34a_100121572206_100009817053 [0,2,0,0,0,0|0,0,0]=2 10965 B14R1.2523 CCOCC(=O)c1ccc(cc1O)O 34a_100121572206_100009814262 [0,2,0,0,0,0|0,0,0]=2 10966 B14R1.2523 CCSCC(=O)c1ccc(cc1Br)F 62a_100012361341_100000210202 [0,2,0,0,0,0|1,1,0]=4 10967 B14R1.2523 CCSCC(=O)c1ccc(cc1C)C 62a_100000210202_100000229959 [0,2,0,0,0,0|1,1,0]=4 10968 B14R1.2523 CCSCC(=O)c1ccc(cc1C)C 62a_100000229959_100000210202 [0,2,0,0,0,0|1,1,0]=4 10969 B14R1.2523 CCSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_100000210202 [0,2,0,0,0,0|1,1,0]=4 10970 B14R1.2523 CCSCC(=O)c1ccc(cc1Cl)F 62a_100000210202_100012056422 [0,2,0,0,0,0|1,1,0]=4 10971 B14R1.2523 CCSCC(=O)c1ccc(cc1Cl)F 62a_100012056422_100000210202 [0,2,0,0,0,0|1,1,0]=4 10972 B14R1.2523 CCSCC(=O)c1ccc(cc1F)Br 62a_200012361339_100000210202 [0,2,0,0,0,0|1,1,0]=4 10973 B14R1.2523 CCSCC(=O)c1ccc(cc1F)Cl 62a_100000210202_100012351891 [0,2,0,0,0,0|1,1,0]=4 10974 B14R1.2523 CCSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_100000210202 [0,2,0,0,0,0|1,1,0]=4 10975 B14R1.2523 CCSCC(=O)c1ccc(cc1F)F 62a_100000210202_100000229962 [0,2,0,0,0,0|1,1,0]=4 10976 B14R1.2523 CCSCC(=O)c1ccc(cc1F)F 62a_100000229962_100000210202 [0,2,0,0,0,0|1,1,0]=4 10977 B14R1.2523 CCSCC(=O)c1ccc(cc1O)F 62a_100000210202_100009817053 [0,2,0,0,0,0|0,1,0]=3 10978 B14R1.2523 CCSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000210202 [0,2,0,0,0,0|0,1,0]=3 10979 B14R1.2523 CCSCC(=O)c1ccc(cc1O)O 62a_100000210202_100009814262 [0,2,0,0,0,0|0,1,0]=3 10980 B14R1.2523 CCSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000210202 [0,2,0,0,0,0|0,1,0]=3 10981 B14R1.2523 CNCCC(=O)c1ccc(cc1F)Br 2230a_106832991635_100010339771 [0,2,0,0,0,0|2,0,0]=4 10982 B14R1.2523 CNCCC(=O)c1ccc(cc1F)Br 34a_100102657272_100010339771 [0,2,0,0,0,0|2,0,0]=4 10983 B14R1.2523 CNCCC(=O)c1ccc(cc1F)Br 7a_106832991635_100010339771 [0,2,0,0,0,0|2,0,0]=4 10984 B14R1.2523 CNCOC(=O)c1ccc(cc1Cl)Cl 2230a_106832991635_100010978946 [0,2,0,0,0,0|1,0,0]=3 10985 B14R1.2523 COCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000233755 [0,2,0,0,0,0|2,0,0]=4 10986 B14R1.2523 COCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000233755 [0,2,0,0,0,0|2,0,0]=4 10987 B14R1.2523 COCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000233755 [0,2,0,0,0,0|2,0,0]=4 10988 B14R1.2523 COCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000233755 [0,2,0,0,0,0|2,0,0]=4 10989 B14R1.2523 COCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000233755 [0,2,0,0,0,0|2,0,0]=4 10990 B14R1.2523 COCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000233755 [0,2,0,0,0,0|2,0,0]=4 10991 B14R1.2523 COCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000233755 [0,2,0,0,0,0|2,0,0]=4 10992 B14R1.2523 COCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000233755 [0,2,0,0,0,0|2,0,0]=4 10993 B14R1.2523 COCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000233755 [0,2,0,0,0,0|2,0,0]=4 10994 B14R1.2523 COCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000233755 [0,2,0,0,0,0|2,0,0]=4 10995 B14R1.2523 COCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000233755 [0,2,0,0,0,0|2,0,0]=4 10996 B14R1.2523 COCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000233755 [0,2,0,0,0,0|2,0,0]=4 10997 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000233755 [0,2,0,0,0,0|2,0,0]=4 10998 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000233755 [0,2,0,0,0,0|2,0,0]=4 10999 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000233755 [0,2,0,0,0,0|2,0,0]=4 11000 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000233755 [0,2,0,0,0,0|2,0,0]=4 11001 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000233755 [0,2,0,0,0,0|2,0,0]=4 11002 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000233755 [0,2,0,0,0,0|2,0,0]=4 11003 B14R1.2523 COCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000233755 [0,2,0,0,0,0|2,0,0]=4 11004 B14R1.2523 COCCC(=O)c1ccc(cc1F)Br 34a_100138415774_100010339771 [0,2,0,0,0,0|2,0,0]=4 11005 B14R1.2523 COCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000233755 [0,2,0,0,0,0|2,0,0]=4 11006 B14R1.2523 COCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000233755 [0,2,0,0,0,0|2,0,0]=4 11007 B14R1.2523 COCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000233755 [0,2,0,0,0,0|2,0,0]=4 11008 B14R1.2523 COCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000233755 [0,2,0,0,0,0|2,0,0]=4 11009 B14R1.2523 COCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000233755 [0,2,0,0,0,0|2,0,0]=4 11010 B14R1.2523 COCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000233755 [0,2,0,0,0,0|2,0,0]=4 11011 B14R1.2523 COCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000233755 [0,2,0,0,0,0|2,0,0]=4 11012 B14R1.2523 COCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000233755 [0,2,0,0,0,0|2,0,0]=4 11013 B14R1.2523 COCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000233755 [0,2,0,0,0,0|2,0,0]=4 11014 B14R1.2523 COCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000233755 [0,2,0,0,0,0|1,0,0]=3 11015 B14R1.2523 COCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000233755 [0,2,0,0,0,0|1,0,0]=3 11016 B14R1.2523 COCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000233755 [0,2,0,0,0,0|1,0,0]=3 11017 B14R1.2523 COCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000233755 [0,2,0,0,0,0|1,0,0]=3 11018 B14R1.2523 COCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000233755 [0,2,0,0,0,0|1,0,0]=3 11019 B14R1.2523 COCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000233755 [0,2,0,0,0,0|1,0,0]=3 11020 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000751147 [0,2,0,0,0,0|2,0,0]=4 11021 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000751147 [0,2,0,0,0,0|2,0,0]=4 11022 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000751147 [0,2,0,0,0,0|2,0,0]=4 11023 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000751147 [0,2,0,0,0,0|2,0,0]=4 11024 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000751147 [0,2,0,0,0,0|2,0,0]=4 11025 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000751147 [0,2,0,0,0,0|2,0,0]=4 11026 B14R1.2523 CSCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000751147 [0,2,0,0,0,0|2,0,0]=4 11027 B14R1.2523 CSCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000751147 [0,2,0,0,0,0|2,0,0]=4 11028 B14R1.2523 CSCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000751147 [0,2,0,0,0,0|2,0,0]=4 11029 B14R1.2523 CSCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000751147 [0,2,0,0,0,0|2,0,0]=4 11030 B14R1.2523 CSCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000751147 [0,2,0,0,0,0|2,0,0]=4 11031 B14R1.2523 CSCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000751147 [0,2,0,0,0,0|2,0,0]=4 11032 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000751147 [0,2,0,0,0,0|2,0,0]=4 11033 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000751147 [0,2,0,0,0,0|2,0,0]=4 11034 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000751147 [0,2,0,0,0,0|2,0,0]=4 11035 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000751147 [0,2,0,0,0,0|2,0,0]=4 11036 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000751147 [0,2,0,0,0,0|2,0,0]=4 11037 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000751147 [0,2,0,0,0,0|2,0,0]=4 11038 B14R1.2523 CSCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000751147 [0,2,0,0,0,0|2,0,0]=4 11039 B14R1.2523 CSCCC(=O)c1ccc(cc1F)Br 62a_100010339771_200000210301 [0,2,0,0,0,0|2,0,0]=4 11040 B14R1.2523 CSCCC(=O)c1ccc(cc1F)Br 62a_200000210301_100010339771 [0,2,0,0,0,0|2,0,0]=4 11041 B14R1.2523 CSCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000751147 [0,2,0,0,0,0|2,0,0]=4 11042 B14R1.2523 CSCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000751147 [0,2,0,0,0,0|2,0,0]=4 11043 B14R1.2523 CSCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000751147 [0,2,0,0,0,0|2,0,0]=4 11044 B14R1.2523 CSCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000751147 [0,2,0,0,0,0|2,0,0]=4 11045 B14R1.2523 CSCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000751147 [0,2,0,0,0,0|2,0,0]=4 11046 B14R1.2523 CSCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000751147 [0,2,0,0,0,0|2,0,0]=4 11047 B14R1.2523 CSCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000751147 [0,2,0,0,0,0|2,0,0]=4 11048 B14R1.2523 CSCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000751147 [0,2,0,0,0,0|2,0,0]=4 11049 B14R1.2523 CSCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000751147 [0,2,0,0,0,0|2,0,0]=4 11050 B14R1.2523 CSCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000751147 [0,2,0,0,0,0|1,0,0]=3 11051 B14R1.2523 CSCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000751147 [0,2,0,0,0,0|1,0,0]=3 11052 B14R1.2523 CSCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000751147 [0,2,0,0,0,0|1,0,0]=3 11053 B14R1.2523 CSCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000751147 [0,2,0,0,0,0|1,0,0]=3 11054 B14R1.2523 CSCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000751147 [0,2,0,0,0,0|1,0,0]=3 11055 B14R1.2523 CSCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000751147 [0,2,0,0,0,0|1,0,0]=3 11056 B14R1.2523 CSCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_200000210301 [0,2,0,0,0,0|1,0,0]=3 11057 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)Br 1458a_100000741311_100011934791 [0,2,0,0,0,0|2,0,0]=4 11058 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)Cl 1458a_100000688705_100011934791 [0,2,0,0,0,0|2,0,0]=4 11059 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)F 1458a_100000686989_100011934791 [0,2,0,0,0,0|2,0,0]=4 11060 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)I 1458a_100010189873_100011934791 [0,2,0,0,0,0|2,0,0]=4 11061 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)O 1458a_100000692822_100011934791 [0,2,0,0,0,0|2,0,0]=4 11062 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)Br 1458a_100000741311_100011215043 [0,2,0,0,0,0|2,0,0]=4 11063 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)Cl 1458a_100000688705_100011215043 [0,2,0,0,0,0|2,0,0]=4 11064 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)F 1458a_100000686989_100011215043 [0,2,0,0,0,0|2,0,0]=4 11065 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)I 1458a_100010189873_100011215043 [0,2,0,0,0,0|2,0,0]=4 11066 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)O 1458a_100000692822_100011215043 [0,2,0,0,0,0|2,0,0]=4 11067 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Br 11a_100000724931_100000741311 [0,2,0,0,0,0|2,0,0]=4 11068 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Br 1626a_100000724931_100000741311 [0,2,0,0,0,0|2,0,0]=4 11069 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Br 240690a_100000724931_100000741311 [0,2,0,0,0,0|2,0,0]=4 11070 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Br 527a_100000724931_100000741311 [0,2,0,0,0,0|2,0,0]=4 11071 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Cl 11a_100000724931_100000688705 [0,2,0,0,0,0|2,0,0]=4 11072 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Cl 1626a_100000724931_100000688705 [0,2,0,0,0,0|2,0,0]=4 11073 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Cl 240690a_100000724931_100000688705 [0,2,0,0,0,0|2,0,0]=4 11074 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Cl 527a_100000724931_100000688705 [0,2,0,0,0,0|2,0,0]=4 11075 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)F 11a_100000724931_100000686989 [0,2,0,0,0,0|2,0,0]=4 11076 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)F 1626a_100000724931_100000686989 [0,2,0,0,0,0|2,0,0]=4 11077 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)F 240690a_100000724931_100000686989 [0,2,0,0,0,0|2,0,0]=4 11078 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)F 527a_100000724931_100000686989 [0,2,0,0,0,0|2,0,0]=4 11079 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)I 11a_100000724931_100010189873 [0,2,0,0,0,0|2,0,0]=4 11080 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)I 1626a_100000724931_100010189873 [0,2,0,0,0,0|2,0,0]=4 11081 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)I 240690a_100000724931_100010189873 [0,2,0,0,0,0|2,0,0]=4 11082 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)I 527a_100000724931_100010189873 [0,2,0,0,0,0|2,0,0]=4 11083 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)O 240690a_100000724931_100000692822 [0,2,0,0,0,0|2,0,0]=4 11084 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)O 527a_100000724931_100000692822 [0,2,0,0,0,0|2,0,0]=4 11085 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)Br 240690a_100000210304_100000741311 [0,2,0,0,0,0|2,0,0]=4 11086 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)Br 527a_100000210304_100000741311 [0,2,0,0,0,0|2,0,0]=4 11087 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)Cl 240690a_100000210304_100000688705 [0,2,0,0,0,0|2,0,0]=4 11088 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)Cl 527a_100000210304_100000688705 [0,2,0,0,0,0|2,0,0]=4 11089 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)F 240690a_100000210304_100000686989 [0,2,0,0,0,0|2,0,0]=4 11090 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)F 527a_100000210304_100000686989 [0,2,0,0,0,0|2,0,0]=4 11091 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)I 240690a_100000210304_100010189873 [0,2,0,0,0,0|2,0,0]=4 11092 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)I 527a_100000210304_100010189873 [0,2,0,0,0,0|2,0,0]=4 11093 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)O 240690a_100000210304_100000692822 [0,2,0,0,0,0|2,0,0]=4 11094 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)O 527a_100000210304_100000692822 [0,2,0,0,0,0|2,0,0]=4 11095 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)CCCF 1458a_100000685072_100011934791 [0,2,0,0,0,0|2,0,0]=4 11096 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)CCCO 1458a_100000685072_100011215043 [0,2,0,0,0,0|2,0,0]=4 11097 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCF 11a_100000724931_100000685072 [0,2,0,0,0,0|2,0,0]=4 11098 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCF 1626a_100000724931_100000685072 [0,2,0,0,0,0|2,0,0]=4 11099 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCF 240690a_100000724931_100000685072 [0,2,0,0,0,0|2,0,0]=4 11100 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCF 527a_100000724931_100000685072 [0,2,0,0,0,0|2,0,0]=4 11101 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCO 240690a_100000210304_100000685072 [0,2,0,0,0,0|2,0,0]=4 11102 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCO 527a_100000210304_100000685072 [0,2,0,0,0,0|2,0,0]=4 11103 B14R1.2523 Cc1ccc(c(c1)C)C(=O)CCCF 1458a_100000211164_100011934791 [0,2,0,0,0,0|2,0,0]=4 11104 B14R1.2523 Cc1ccc(c(c1)C)C(=O)CCCO 1458a_100000211164_100011215043 [0,2,0,0,0,0|2,0,0]=4 11105 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCF 11a_100000724931_100000211164 [0,2,0,0,0,0|2,0,0]=4 11106 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCF 1626a_100000724931_100000211164 [0,2,0,0,0,0|2,0,0]=4 11107 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCF 240690a_100000724931_100000211164 [0,2,0,0,0,0|2,0,0]=4 11108 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCF 527a_100000724931_100000211164 [0,2,0,0,0,0|2,0,0]=4 11109 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCO 240690a_100000210304_100000211164 [0,2,0,0,0,0|2,0,0]=4 11110 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCO 527a_100000210304_100000211164 [0,2,0,0,0,0|2,0,0]=4 11111 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)CCCF 1458a_100000766932_100011934791 [0,2,0,0,0,0|2,0,0]=4 11112 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)CCCO 1458a_100000766932_100011215043 [0,2,0,0,0,0|2,0,0]=4 11113 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCF 11a_100000724931_100000766932 [0,2,0,0,0,0|2,0,0]=4 11114 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCF 1626a_100000724931_100000766932 [0,2,0,0,0,0|2,0,0]=4 11115 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCF 240690a_100000724931_100000766932 [0,2,0,0,0,0|2,0,0]=4 11116 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCF 527a_100000724931_100000766932 [0,2,0,0,0,0|2,0,0]=4 11117 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCO 240690a_100000210304_100000766932 [0,2,0,0,0,0|2,0,0]=4 11118 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCO 527a_100000210304_100000766932 [0,2,0,0,0,0|2,0,0]=4 11119 B14R1.2523 Cc1ccc(c(c1)F)C(=O)CCCF 1458a_100000766033_100011934791 [0,2,0,0,0,0|2,0,0]=4 11120 B14R1.2523 Cc1ccc(c(c1)F)C(=O)CCCO 1458a_100000766033_100011215043 [0,2,0,0,0,0|2,0,0]=4 11121 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCF 11a_100000724931_100000766033 [0,2,0,0,0,0|2,0,0]=4 11122 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCF 1626a_100000724931_100000766033 [0,2,0,0,0,0|2,0,0]=4 11123 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCF 240690a_100000724931_100000766033 [0,2,0,0,0,0|2,0,0]=4 11124 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCF 527a_100000724931_100000766033 [0,2,0,0,0,0|2,0,0]=4 11125 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCO 240690a_100000210304_100000766033 [0,2,0,0,0,0|2,0,0]=4 11126 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCO 527a_100000210304_100000766033 [0,2,0,0,0,0|2,0,0]=4 11127 B14R1.2523 Cc1ccc(c(c1)I)C(=O)CCCF 1458a_100009999607_100011934791 [0,2,0,0,0,0|2,0,0]=4 11128 B14R1.2523 Cc1ccc(c(c1)I)C(=O)CCCO 1458a_100009999607_100011215043 [0,2,0,0,0,0|2,0,0]=4 11129 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCF 11a_100000724931_100009999607 [0,2,0,0,0,0|2,0,0]=4 11130 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCF 1626a_100000724931_100009999607 [0,2,0,0,0,0|2,0,0]=4 11131 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCF 240690a_100000724931_100009999607 [0,2,0,0,0,0|2,0,0]=4 11132 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCF 527a_100000724931_100009999607 [0,2,0,0,0,0|2,0,0]=4 11133 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCO 240690a_100000210304_100009999607 [0,2,0,0,0,0|2,0,0]=4 11134 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCO 527a_100000210304_100009999607 [0,2,0,0,0,0|2,0,0]=4 11135 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCC#N 1458a_100000212137_100011215226 [0,2,0,0,0,0|1,0,1]=4 11136 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCCF 1458a_100000212137_100011934791 [0,2,0,0,0,0|1,0,0]=3 11137 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCCO 1458a_100000212137_100011215043 [0,2,0,0,0,0|1,0,0]=3 11138 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCC#N 1626a_100000734998_100000212137 [0,2,0,0,0,0|1,0,1]=4 11139 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCC#N 527a_100000734998_100000212137 [0,2,0,0,0,0|1,0,1]=4 11140 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCF 1626a_100000724931_100000212137 [0,2,0,0,0,0|1,0,0]=3 11141 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCF 240690a_100000724931_100000212137 [0,2,0,0,0,0|1,0,0]=3 11142 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCF 527a_100000724931_100000212137 [0,2,0,0,0,0|1,0,0]=3 11143 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCO 240690a_100000210304_100000212137 [0,2,0,0,0,0|1,0,0]=3 11144 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCO 527a_100000210304_100000212137 [0,2,0,0,0,0|1,0,0]=3 11145 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011215226 [0,2,0,0,0,0|1,0,1]=4 11146 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011215226 [0,2,0,0,0,0|1,0,1]=4 11147 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011215226 [0,2,0,0,0,0|1,0,1]=4 11148 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011215226 [0,2,0,0,0,0|1,0,1]=4 11149 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011215226 [0,2,0,0,0,0|1,0,1]=4 11150 B14R1.2523 N#CCNC(=O)c1ccc(cc1O)Br 527a_100000734998_100000744433 [0,2,0,0,0,0|1,0,1]=4 11151 B14R1.2523 N#CCNC(=O)c1ccc(cc1O)Cl 527a_100000734998_100000188622 [0,2,0,0,0,0|1,0,1]=4 11152 B14R1.2523 N#CCNC(=O)c1ccc(cc1O)F 527a_100000734998_100000746061 [0,2,0,0,0,0|1,0,1]=4 11153 B14R1.2523 N#CCNC(=O)c1ccc(cc1O)I 527a_100000734998_100000091984 [0,2,0,0,0,0|1,0,1]=4 11154 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)Br 1458a_100000762965_100011934791 [0,2,0,0,0,0|2,0,0]=4 11155 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)Cl 1458a_100000766353_100011934791 [0,2,0,0,0,0|2,0,0]=4 11156 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)F 1458a_100000212304_100011934791 [0,2,0,0,0,0|2,0,0]=4 11157 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)I 1458a_100012360512_100011934791 [0,2,0,0,0,0|2,0,0]=4 11158 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)O 1458a_100012344906_100011934791 [0,2,0,0,0,0|2,0,0]=4 11159 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)Br 1458a_100000741628_100011934791 [0,2,0,0,0,0|2,0,0]=4 11160 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)Cl 1458a_100000185840_100011934791 [0,2,0,0,0,0|2,0,0]=4 11161 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)F 1458a_100000211397_100011934791 [0,2,0,0,0,0|2,0,0]=4 11162 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)I 1458a_100000751301_100011934791 [0,2,0,0,0,0|2,0,0]=4 11163 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)O 1458a_100000702456_100011934791 [0,2,0,0,0,0|2,0,0]=4 11164 B14R1.2523 O=C(CCCF)c1ccc(cc1F)Br 1458a_100000214689_100011934791 [0,2,0,0,0,0|2,0,0]=4 11165 B14R1.2523 O=C(CCCF)c1ccc(cc1F)Cl 1458a_100000212326_100011934791 [0,2,0,0,0,0|2,0,0]=4 11166 B14R1.2523 O=C(CCCF)c1ccc(cc1F)F 1458a_100000211022_100011934791 [0,2,0,0,0,0|2,0,0]=4 11167 B14R1.2523 O=C(CCCF)c1ccc(cc1F)I 1458a_100000037189_100011934791 [0,2,0,0,0,0|2,0,0]=4 11168 B14R1.2523 O=C(CCCF)c1ccc(cc1F)O 1458a_100000689029_100011934791 [0,2,0,0,0,0|2,0,0]=4 11169 B14R1.2523 O=C(CCCF)c1ccc(cc1I)Br 1458a_100000751167_100011934791 [0,2,0,0,0,0|2,0,0]=4 11170 B14R1.2523 O=C(CCCF)c1ccc(cc1I)Cl 1458a_100000739380_100011934791 [0,2,0,0,0,0|2,0,0]=4 11171 B14R1.2523 O=C(CCCF)c1ccc(cc1I)F 1458a_100000739341_100011934791 [0,2,0,0,0,0|2,0,0]=4 11172 B14R1.2523 O=C(CCCF)c1ccc(cc1O)Br 1458a_100000744433_100011934791 [0,2,0,0,0,0|1,0,0]=3 11173 B14R1.2523 O=C(CCCF)c1ccc(cc1O)Cl 1458a_100000188622_100011934791 [0,2,0,0,0,0|1,0,0]=3 11174 B14R1.2523 O=C(CCCF)c1ccc(cc1O)F 1458a_100000746061_100011934791 [0,2,0,0,0,0|1,0,0]=3 11175 B14R1.2523 O=C(CCCF)c1ccc(cc1O)I 1458a_100000091984_100011934791 [0,2,0,0,0,0|1,0,0]=3 11176 B14R1.2523 O=C(CCCF)c1ccc(cc1O)O 1458a_100000212172_100011934791 [0,2,0,0,0,0|1,0,0]=3 11177 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)Br 1458a_100000762965_100011215043 [0,2,0,0,0,0|2,0,0]=4 11178 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)Cl 1458a_100000766353_100011215043 [0,2,0,0,0,0|2,0,0]=4 11179 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)F 1458a_100000212304_100011215043 [0,2,0,0,0,0|2,0,0]=4 11180 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)I 1458a_100012360512_100011215043 [0,2,0,0,0,0|2,0,0]=4 11181 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)O 1458a_100012344906_100011215043 [0,2,0,0,0,0|2,0,0]=4 11182 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)Br 1458a_100000741628_100011215043 [0,2,0,0,0,0|2,0,0]=4 11183 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100011215043 [0,2,0,0,0,0|2,0,0]=4 11184 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)F 1458a_100000211397_100011215043 [0,2,0,0,0,0|2,0,0]=4 11185 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)I 1458a_100000751301_100011215043 [0,2,0,0,0,0|2,0,0]=4 11186 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)O 1458a_100000702456_100011215043 [0,2,0,0,0,0|2,0,0]=4 11187 B14R1.2523 O=C(CCCO)c1ccc(cc1F)Br 1458a_100000214689_100011215043 [0,2,0,0,0,0|2,0,0]=4 11188 B14R1.2523 O=C(CCCO)c1ccc(cc1F)Cl 1458a_100000212326_100011215043 [0,2,0,0,0,0|2,0,0]=4 11189 B14R1.2523 O=C(CCCO)c1ccc(cc1F)F 1458a_100000211022_100011215043 [0,2,0,0,0,0|2,0,0]=4 11190 B14R1.2523 O=C(CCCO)c1ccc(cc1F)I 1458a_100000037189_100011215043 [0,2,0,0,0,0|2,0,0]=4 11191 B14R1.2523 O=C(CCCO)c1ccc(cc1F)O 1458a_100000689029_100011215043 [0,2,0,0,0,0|2,0,0]=4 11192 B14R1.2523 O=C(CCCO)c1ccc(cc1I)Br 1458a_100000751167_100011215043 [0,2,0,0,0,0|2,0,0]=4 11193 B14R1.2523 O=C(CCCO)c1ccc(cc1I)Cl 1458a_100000739380_100011215043 [0,2,0,0,0,0|2,0,0]=4 11194 B14R1.2523 O=C(CCCO)c1ccc(cc1I)F 1458a_100000739341_100011215043 [0,2,0,0,0,0|2,0,0]=4 11195 B14R1.2523 O=C(CCCO)c1ccc(cc1O)Br 1458a_100000744433_100011215043 [0,2,0,0,0,0|1,0,0]=3 11196 B14R1.2523 O=C(CCCO)c1ccc(cc1O)Cl 1458a_100000188622_100011215043 [0,2,0,0,0,0|1,0,0]=3 11197 B14R1.2523 O=C(CCCO)c1ccc(cc1O)F 1458a_100000746061_100011215043 [0,2,0,0,0,0|1,0,0]=3 11198 B14R1.2523 O=C(CCCO)c1ccc(cc1O)I 1458a_100000091984_100011215043 [0,2,0,0,0,0|1,0,0]=3 11199 B14R1.2523 O=C(CCCO)c1ccc(cc1O)O 1458a_100000212172_100011215043 [0,2,0,0,0,0|1,0,0]=3 11200 B14R1.2523 O=C(CSCF)c1ccc(cc1O)F 62a_100009817053_100015361967 [0,2,0,0,0,0|1,1,0]=4 11201 B14R1.2523 O=C(CSCF)c1ccc(cc1O)F 62a_100015361967_100009817053 [0,2,0,0,0,0|1,1,0]=4 11202 B14R1.2523 O=C(CSCF)c1ccc(cc1O)O 62a_100009814262_100015361967 [0,2,0,0,0,0|1,1,0]=4 11203 B14R1.2523 O=C(CSCF)c1ccc(cc1O)O 62a_100015361967_100009814262 [0,2,0,0,0,0|1,1,0]=4 11204 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Br 11a_100000724931_100000762965 [0,2,0,0,0,0|2,0,0]=4 11205 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Br 1626a_100000724931_100000762965 [0,2,0,0,0,0|2,0,0]=4 11206 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Br 240690a_100000724931_100000762965 [0,2,0,0,0,0|2,0,0]=4 11207 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Br 527a_100000724931_100000762965 [0,2,0,0,0,0|2,0,0]=4 11208 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Cl 11a_100000724931_100000766353 [0,2,0,0,0,0|2,0,0]=4 11209 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Cl 1626a_100000724931_100000766353 [0,2,0,0,0,0|2,0,0]=4 11210 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Cl 240690a_100000724931_100000766353 [0,2,0,0,0,0|2,0,0]=4 11211 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Cl 527a_100000724931_100000766353 [0,2,0,0,0,0|2,0,0]=4 11212 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)F 11a_100000724931_100000212304 [0,2,0,0,0,0|2,0,0]=4 11213 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)F 1626a_100000724931_100000212304 [0,2,0,0,0,0|2,0,0]=4 11214 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)F 240690a_100000724931_100000212304 [0,2,0,0,0,0|2,0,0]=4 11215 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)F 527a_100000724931_100000212304 [0,2,0,0,0,0|2,0,0]=4 11216 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)I 11a_100000724931_100012360512 [0,2,0,0,0,0|2,0,0]=4 11217 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)I 1626a_100000724931_100012360512 [0,2,0,0,0,0|2,0,0]=4 11218 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)I 240690a_100000724931_100012360512 [0,2,0,0,0,0|2,0,0]=4 11219 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)I 527a_100000724931_100012360512 [0,2,0,0,0,0|2,0,0]=4 11220 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)O 240690a_100000724931_100012344906 [0,2,0,0,0,0|2,0,0]=4 11221 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)O 527a_100000724931_100012344906 [0,2,0,0,0,0|2,0,0]=4 11222 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Br 11a_100000724931_100000741628 [0,2,0,0,0,0|2,0,0]=4 11223 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Br 1626a_100000724931_100000741628 [0,2,0,0,0,0|2,0,0]=4 11224 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Br 240690a_100000724931_100000741628 [0,2,0,0,0,0|2,0,0]=4 11225 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Br 527a_100000724931_100000741628 [0,2,0,0,0,0|2,0,0]=4 11226 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Cl 11a_100000724931_100000185840 [0,2,0,0,0,0|2,0,0]=4 11227 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Cl 1626a_100000724931_100000185840 [0,2,0,0,0,0|2,0,0]=4 11228 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Cl 240690a_100000724931_100000185840 [0,2,0,0,0,0|2,0,0]=4 11229 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Cl 527a_100000724931_100000185840 [0,2,0,0,0,0|2,0,0]=4 11230 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)F 11a_100000724931_100000211397 [0,2,0,0,0,0|2,0,0]=4 11231 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)F 1626a_100000724931_100000211397 [0,2,0,0,0,0|2,0,0]=4 11232 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)F 240690a_100000724931_100000211397 [0,2,0,0,0,0|2,0,0]=4 11233 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)F 527a_100000724931_100000211397 [0,2,0,0,0,0|2,0,0]=4 11234 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)I 11a_100000724931_100000751301 [0,2,0,0,0,0|2,0,0]=4 11235 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)I 1626a_100000724931_100000751301 [0,2,0,0,0,0|2,0,0]=4 11236 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)I 240690a_100000724931_100000751301 [0,2,0,0,0,0|2,0,0]=4 11237 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)I 527a_100000724931_100000751301 [0,2,0,0,0,0|2,0,0]=4 11238 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)O 240690a_100000724931_100000702456 [0,2,0,0,0,0|2,0,0]=4 11239 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)O 527a_100000724931_100000702456 [0,2,0,0,0,0|2,0,0]=4 11240 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Br 11a_100000724931_100000214689 [0,2,0,0,0,0|2,0,0]=4 11241 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Br 1626a_100000724931_100000214689 [0,2,0,0,0,0|2,0,0]=4 11242 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Br 240690a_100000724931_100000214689 [0,2,0,0,0,0|2,0,0]=4 11243 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Br 527a_100000724931_100000214689 [0,2,0,0,0,0|2,0,0]=4 11244 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Cl 11a_100000724931_100000212326 [0,2,0,0,0,0|2,0,0]=4 11245 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Cl 1626a_100000724931_100000212326 [0,2,0,0,0,0|2,0,0]=4 11246 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Cl 240690a_100000724931_100000212326 [0,2,0,0,0,0|2,0,0]=4 11247 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Cl 527a_100000724931_100000212326 [0,2,0,0,0,0|2,0,0]=4 11248 B14R1.2523 O=C(NCCF)c1ccc(cc1F)F 11a_100000724931_100000211022 [0,2,0,0,0,0|2,0,0]=4 11249 B14R1.2523 O=C(NCCF)c1ccc(cc1F)F 1626a_100000724931_100000211022 [0,2,0,0,0,0|2,0,0]=4 11250 B14R1.2523 O=C(NCCF)c1ccc(cc1F)F 240690a_100000724931_100000211022 [0,2,0,0,0,0|2,0,0]=4 11251 B14R1.2523 O=C(NCCF)c1ccc(cc1F)F 527a_100000724931_100000211022 [0,2,0,0,0,0|2,0,0]=4 11252 B14R1.2523 O=C(NCCF)c1ccc(cc1F)I 11a_100000724931_100000037189 [0,2,0,0,0,0|2,0,0]=4 11253 B14R1.2523 O=C(NCCF)c1ccc(cc1F)I 1626a_100000724931_100000037189 [0,2,0,0,0,0|2,0,0]=4 11254 B14R1.2523 O=C(NCCF)c1ccc(cc1F)I 240690a_100000724931_100000037189 [0,2,0,0,0,0|2,0,0]=4 11255 B14R1.2523 O=C(NCCF)c1ccc(cc1F)I 527a_100000724931_100000037189 [0,2,0,0,0,0|2,0,0]=4 11256 B14R1.2523 O=C(NCCF)c1ccc(cc1F)O 240690a_100000724931_100000689029 [0,2,0,0,0,0|2,0,0]=4 11257 B14R1.2523 O=C(NCCF)c1ccc(cc1F)O 527a_100000724931_100000689029 [0,2,0,0,0,0|2,0,0]=4 11258 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Br 11a_100000724931_100000751167 [0,2,0,0,0,0|2,0,0]=4 11259 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Br 1626a_100000724931_100000751167 [0,2,0,0,0,0|2,0,0]=4 11260 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Br 240690a_100000724931_100000751167 [0,2,0,0,0,0|2,0,0]=4 11261 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Br 527a_100000724931_100000751167 [0,2,0,0,0,0|2,0,0]=4 11262 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Cl 11a_100000724931_100000739380 [0,2,0,0,0,0|2,0,0]=4 11263 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Cl 1626a_100000724931_100000739380 [0,2,0,0,0,0|2,0,0]=4 11264 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Cl 240690a_100000724931_100000739380 [0,2,0,0,0,0|2,0,0]=4 11265 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Cl 527a_100000724931_100000739380 [0,2,0,0,0,0|2,0,0]=4 11266 B14R1.2523 O=C(NCCF)c1ccc(cc1I)F 11a_100000724931_100000739341 [0,2,0,0,0,0|2,0,0]=4 11267 B14R1.2523 O=C(NCCF)c1ccc(cc1I)F 1626a_100000724931_100000739341 [0,2,0,0,0,0|2,0,0]=4 11268 B14R1.2523 O=C(NCCF)c1ccc(cc1I)F 240690a_100000724931_100000739341 [0,2,0,0,0,0|2,0,0]=4 11269 B14R1.2523 O=C(NCCF)c1ccc(cc1I)F 527a_100000724931_100000739341 [0,2,0,0,0,0|2,0,0]=4 11270 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Br 240690a_100000724931_100000744433 [0,2,0,0,0,0|1,0,0]=3 11271 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Br 527a_100000724931_100000744433 [0,2,0,0,0,0|1,0,0]=3 11272 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Cl 11a_100000724931_100000188622 [0,2,0,0,0,0|1,0,0]=3 11273 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Cl 240690a_100000724931_100000188622 [0,2,0,0,0,0|1,0,0]=3 11274 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Cl 527a_100000724931_100000188622 [0,2,0,0,0,0|1,0,0]=3 11275 B14R1.2523 O=C(NCCF)c1ccc(cc1O)F 240690a_100000724931_100000746061 [0,2,0,0,0,0|1,0,0]=3 11276 B14R1.2523 O=C(NCCF)c1ccc(cc1O)F 527a_100000724931_100000746061 [0,2,0,0,0,0|1,0,0]=3 11277 B14R1.2523 O=C(NCCF)c1ccc(cc1O)I 240690a_100000724931_100000091984 [0,2,0,0,0,0|1,0,0]=3 11278 B14R1.2523 O=C(NCCF)c1ccc(cc1O)I 527a_100000724931_100000091984 [0,2,0,0,0,0|1,0,0]=3 11279 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)Br 240690a_100000210304_100000762965 [0,2,0,0,0,0|2,0,0]=4 11280 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)Br 527a_100000210304_100000762965 [0,2,0,0,0,0|2,0,0]=4 11281 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)Cl 240690a_100000210304_100000766353 [0,2,0,0,0,0|2,0,0]=4 11282 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)Cl 527a_100000210304_100000766353 [0,2,0,0,0,0|2,0,0]=4 11283 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)F 240690a_100000210304_100000212304 [0,2,0,0,0,0|2,0,0]=4 11284 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)F 527a_100000210304_100000212304 [0,2,0,0,0,0|2,0,0]=4 11285 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)I 240690a_100000210304_100012360512 [0,2,0,0,0,0|2,0,0]=4 11286 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)I 527a_100000210304_100012360512 [0,2,0,0,0,0|2,0,0]=4 11287 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)O 240690a_100000210304_100012344906 [0,2,0,0,0,0|2,0,0]=4 11288 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)O 527a_100000210304_100012344906 [0,2,0,0,0,0|2,0,0]=4 11289 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)Br 240690a_100000210304_100000741628 [0,2,0,0,0,0|2,0,0]=4 11290 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)Br 527a_100000210304_100000741628 [0,2,0,0,0,0|2,0,0]=4 11291 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)Cl 240690a_100000210304_100000185840 [0,2,0,0,0,0|2,0,0]=4 11292 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)Cl 527a_100000210304_100000185840 [0,2,0,0,0,0|2,0,0]=4 11293 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)F 240690a_100000210304_100000211397 [0,2,0,0,0,0|2,0,0]=4 11294 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)F 527a_100000210304_100000211397 [0,2,0,0,0,0|2,0,0]=4 11295 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)I 240690a_100000210304_100000751301 [0,2,0,0,0,0|2,0,0]=4 11296 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)I 527a_100000210304_100000751301 [0,2,0,0,0,0|2,0,0]=4 11297 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)O 240690a_100000210304_100000702456 [0,2,0,0,0,0|2,0,0]=4 11298 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)O 527a_100000210304_100000702456 [0,2,0,0,0,0|2,0,0]=4 11299 B14R1.2523 O=C(NCCO)c1ccc(cc1F)Br 240690a_100000210304_100000214689 [0,2,0,0,0,0|2,0,0]=4 11300 B14R1.2523 O=C(NCCO)c1ccc(cc1F)Br 527a_100000210304_100000214689 [0,2,0,0,0,0|2,0,0]=4 11301 B14R1.2523 O=C(NCCO)c1ccc(cc1F)Cl 240690a_100000210304_100000212326 [0,2,0,0,0,0|2,0,0]=4 11302 B14R1.2523 O=C(NCCO)c1ccc(cc1F)Cl 527a_100000210304_100000212326 [0,2,0,0,0,0|2,0,0]=4 11303 B14R1.2523 O=C(NCCO)c1ccc(cc1F)F 240690a_100000210304_100000211022 [0,2,0,0,0,0|2,0,0]=4 11304 B14R1.2523 O=C(NCCO)c1ccc(cc1F)F 527a_100000210304_100000211022 [0,2,0,0,0,0|2,0,0]=4 11305 B14R1.2523 O=C(NCCO)c1ccc(cc1F)I 240690a_100000210304_100000037189 [0,2,0,0,0,0|2,0,0]=4 11306 B14R1.2523 O=C(NCCO)c1ccc(cc1F)I 527a_100000210304_100000037189 [0,2,0,0,0,0|2,0,0]=4 11307 B14R1.2523 O=C(NCCO)c1ccc(cc1F)O 240690a_100000210304_100000689029 [0,2,0,0,0,0|2,0,0]=4 11308 B14R1.2523 O=C(NCCO)c1ccc(cc1F)O 527a_100000210304_100000689029 [0,2,0,0,0,0|2,0,0]=4 11309 B14R1.2523 O=C(NCCO)c1ccc(cc1I)Br 240690a_100000210304_100000751167 [0,2,0,0,0,0|2,0,0]=4 11310 B14R1.2523 O=C(NCCO)c1ccc(cc1I)Br 527a_100000210304_100000751167 [0,2,0,0,0,0|2,0,0]=4 11311 B14R1.2523 O=C(NCCO)c1ccc(cc1I)Cl 240690a_100000210304_100000739380 [0,2,0,0,0,0|2,0,0]=4 11312 B14R1.2523 O=C(NCCO)c1ccc(cc1I)Cl 527a_100000210304_100000739380 [0,2,0,0,0,0|2,0,0]=4 11313 B14R1.2523 O=C(NCCO)c1ccc(cc1I)F 240690a_100000210304_100000739341 [0,2,0,0,0,0|2,0,0]=4 11314 B14R1.2523 O=C(NCCO)c1ccc(cc1I)F 527a_100000210304_100000739341 [0,2,0,0,0,0|2,0,0]=4 11315 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Br 240690a_100000210304_100000744433 [0,2,0,0,0,0|1,0,0]=3 11316 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Br 527a_100000210304_100000744433 [0,2,0,0,0,0|1,0,0]=3 11317 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Cl 240690a_100000210304_100000188622 [0,2,0,0,0,0|1,0,0]=3 11318 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Cl 527a_100000210304_100000188622 [0,2,0,0,0,0|1,0,0]=3 11319 B14R1.2523 O=C(NCCO)c1ccc(cc1O)F 240690a_100000210304_100000746061 [0,2,0,0,0,0|1,0,0]=3 11320 B14R1.2523 O=C(NCCO)c1ccc(cc1O)F 527a_100000210304_100000746061 [0,2,0,0,0,0|1,0,0]=3 11321 B14R1.2523 O=C(NCCO)c1ccc(cc1O)I 240690a_100000210304_100000091984 [0,2,0,0,0,0|1,0,0]=3 11322 B14R1.2523 O=C(NCCO)c1ccc(cc1O)I 527a_100000210304_100000091984 [0,2,0,0,0,0|1,0,0]=3 11323 B14R1.2523 [13CH3]SCCC(=O)c1ccc(cc1F)Br 62a_100010339771_200025704644 [0,2,0,0,0,0|2,0,0]=4 11324 B14R1.2523 [13CH3]SCCC(=O)c1ccc(cc1F)Br 62a_200025704644_100010339771 [0,2,0,0,0,0|2,0,0]=4 11325 B14R1.2523 [13CH3]SCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_200025704644 [0,2,0,0,0,0|1,0,0]=3 11326 B14R1.4230 CCCNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000165487 [0,2,0,0,0,0|2,0,0]=4 11327 B14R1.8282 C#CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000753159 [0,2,0,0,0,0|1,0,1]=4 11328 B14R1.8282 C#CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000753159 [0,2,0,0,0,0|1,0,1]=4 11329 B14R1.8282 C#CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000753159 [0,2,0,0,0,0|1,0,1]=4 11330 B14R1.8282 C#CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000753159 [0,2,0,0,0,0|1,0,1]=4 11331 B14R1.8282 C#CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000753159 [0,2,0,0,0,0|1,0,1]=4 11332 B14R1.8282 C#CCNC(=O)c1c(cccc1Br)O 240690a_100000212058_100011935254 [0,2,0,0,0,0|1,0,1]=4 11333 B14R1.8282 C#CCNC(=O)c1c(cccc1Br)O 527a_100000212058_100011935254 [0,2,0,0,0,0|1,0,1]=4 11334 B14R1.8282 C#CCNC(=O)c1c(cccc1Cl)O 240690a_100000212058_100000745519 [0,2,0,0,0,0|1,0,1]=4 11335 B14R1.8282 C#CCNC(=O)c1c(cccc1Cl)O 527a_100000212058_100000745519 [0,2,0,0,0,0|1,0,1]=4 11336 B14R1.8282 C#CCNC(=O)c1c(cccc1F)O 527a_100000212058_100000763259 [0,2,0,0,0,0|1,0,1]=4 11337 B14R1.8282 C#CCNC(=O)c1c(cccc1O)O 527a_100000212058_100000755285 [0,2,0,0,0,0|1,0,1]=4 11338 B14R1.8282 C/C=C/CC(=O)c1c(cccc1Br)O 1458a_100011935254_100102629194 [0,2,0,0,0,0|1,0,1]=4 11339 B14R1.8282 C/C=C/CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100102629194 [0,2,0,0,0,0|1,0,1]=4 11340 B14R1.8282 C/C=C/CC(=O)c1c(cccc1F)O 1458a_100000763259_100102629194 [0,2,0,0,0,0|1,0,1]=4 11341 B14R1.8282 C/C=C/CC(=O)c1c(cccc1O)C 1458a_100011934116_100102629194 [0,2,0,0,0,0|1,0,1]=4 11342 B14R1.8282 C/C=C/CC(=O)c1c(cccc1O)O 1458a_100000755285_100102629194 [0,2,0,0,0,0|1,0,1]=4 11343 B14R1.8282 C=CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000754431 [0,2,0,0,0,0|1,0,1]=4 11344 B14R1.8282 C=CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000754431 [0,2,0,0,0,0|1,0,1]=4 11345 B14R1.8282 C=CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000754431 [0,2,0,0,0,0|1,0,1]=4 11346 B14R1.8282 C=CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000754431 [0,2,0,0,0,0|1,0,1]=4 11347 B14R1.8282 C=CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000754431 [0,2,0,0,0,0|1,0,1]=4 11348 B14R1.8282 C=CCNC(=O)c1c(cccc1Br)O 240690a_100020586998_100011935254 [0,2,0,0,0,0|1,0,1]=4 11349 B14R1.8282 C=CCNC(=O)c1c(cccc1Br)O 527a_100020586998_100011935254 [0,2,0,0,0,0|1,0,1]=4 11350 B14R1.8282 C=CCNC(=O)c1c(cccc1Cl)O 240690a_100020586998_100000745519 [0,2,0,0,0,0|1,0,1]=4 11351 B14R1.8282 C=CCNC(=O)c1c(cccc1Cl)O 527a_100020586998_100000745519 [0,2,0,0,0,0|1,0,1]=4 11352 B14R1.8282 C=CCNC(=O)c1c(cccc1F)O 527a_100020586998_100000763259 [0,2,0,0,0,0|1,0,1]=4 11353 B14R1.8282 C=CCNC(=O)c1c(cccc1O)O 527a_100020586998_100000755285 [0,2,0,0,0,0|1,0,1]=4 11354 B14R1.8282 CC#CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000748600 [0,2,0,0,0,0|1,0,1]=4 11355 B14R1.8282 CC#CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000748600 [0,2,0,0,0,0|1,0,1]=4 11356 B14R1.8282 CC#CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000748600 [0,2,0,0,0,0|1,0,1]=4 11357 B14R1.8282 CC#CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000748600 [0,2,0,0,0,0|1,0,1]=4 11358 B14R1.8282 CC#CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000748600 [0,2,0,0,0,0|1,0,1]=4 11359 B14R1.8282 CC=CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000070051 [0,2,0,0,0,0|1,0,1]=4 11360 B14R1.8282 CC=CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000070051 [0,2,0,0,0,0|1,0,1]=4 11361 B14R1.8282 CC=CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000070051 [0,2,0,0,0,0|1,0,1]=4 11362 B14R1.8282 CC=CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000070051 [0,2,0,0,0,0|1,0,1]=4 11363 B14R1.8282 CC=CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000070051 [0,2,0,0,0,0|1,0,1]=4 11364 B14R1.8282 CCCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210211 [0,2,0,0,0,0|2,0,0]=4 11365 B14R1.8282 CCCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000210211 [0,2,0,0,0,0|2,0,0]=4 11366 B14R1.8282 CCCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210211 [0,2,0,0,0,0|2,0,0]=4 11367 B14R1.8282 CCCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210211 [0,2,0,0,0,0|2,0,0]=4 11368 B14R1.8282 CCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210211 [0,2,0,0,0,0|1,0,0]=3 11369 B14R1.8282 CCCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000210211 [0,2,0,0,0,0|2,0,0]=4 11370 B14R1.8282 CCCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000210211 [0,2,0,0,0,0|2,0,0]=4 11371 B14R1.8282 CCCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210211 [0,2,0,0,0,0|2,0,0]=4 11372 B14R1.8282 CCCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210211 [0,2,0,0,0,0|2,0,0]=4 11373 B14R1.8282 CCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210211 [0,2,0,0,0,0|1,0,0]=3 11374 B14R1.8282 CCCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000210211 [0,2,0,0,0,0|2,0,0]=4 11375 B14R1.8282 CCCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210211 [0,2,0,0,0,0|2,0,0]=4 11376 B14R1.8282 CCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210211 [0,2,0,0,0,0|1,0,0]=3 11377 B14R1.8282 CCCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210211 [0,2,0,0,0,0|2,0,0]=4 11378 B14R1.8282 CCCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000210211 [0,2,0,0,0,0|2,0,0]=4 11379 B14R1.8282 CCCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210211 [0,2,0,0,0,0|2,0,0]=4 11380 B14R1.8282 CCCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210211 [0,2,0,0,0,0|2,0,0]=4 11381 B14R1.8282 CCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210211 [0,2,0,0,0,0|1,0,0]=3 11382 B14R1.8282 CCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210211 [0,2,0,0,0,0|1,0,0]=3 11383 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Br 11a_100020643023_100000690891 [0,2,0,0,0,0|2,0,0]=4 11384 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Br 1626a_100020643023_100000690891 [0,2,0,0,0,0|2,0,0]=4 11385 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Br 240690a_100020643023_100000690891 [0,2,0,0,0,0|2,0,0]=4 11386 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Br 527a_100020643023_100000690891 [0,2,0,0,0,0|2,0,0]=4 11387 B14R1.8282 CCCNC(=O)c1c(cccc1Br)C 11a_100020643023_100000701904 [0,2,0,0,0,0|2,0,0]=4 11388 B14R1.8282 CCCNC(=O)c1c(cccc1Br)C 1626a_100020643023_100000701904 [0,2,0,0,0,0|2,0,0]=4 11389 B14R1.8282 CCCNC(=O)c1c(cccc1Br)C 240690a_100020643023_100000701904 [0,2,0,0,0,0|2,0,0]=4 11390 B14R1.8282 CCCNC(=O)c1c(cccc1Br)C 527a_100020643023_100000701904 [0,2,0,0,0,0|2,0,0]=4 11391 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Cl 11a_100020643023_100011253703 [0,2,0,0,0,0|2,0,0]=4 11392 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Cl 1626a_100020643023_100011253703 [0,2,0,0,0,0|2,0,0]=4 11393 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Cl 240690a_100020643023_100011253703 [0,2,0,0,0,0|2,0,0]=4 11394 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Cl 527a_100020643023_100011253703 [0,2,0,0,0,0|2,0,0]=4 11395 B14R1.8282 CCCNC(=O)c1c(cccc1Br)F 11a_100020643023_100000752694 [0,2,0,0,0,0|2,0,0]=4 11396 B14R1.8282 CCCNC(=O)c1c(cccc1Br)F 1626a_100020643023_100000752694 [0,2,0,0,0,0|2,0,0]=4 11397 B14R1.8282 CCCNC(=O)c1c(cccc1Br)F 240690a_100020643023_100000752694 [0,2,0,0,0,0|2,0,0]=4 11398 B14R1.8282 CCCNC(=O)c1c(cccc1Br)F 527a_100020643023_100000752694 [0,2,0,0,0,0|2,0,0]=4 11399 B14R1.8282 CCCNC(=O)c1c(cccc1Br)O 240690a_100020643023_100011935254 [0,2,0,0,0,0|1,0,0]=3 11400 B14R1.8282 CCCNC(=O)c1c(cccc1Br)O 527a_100020643023_100011935254 [0,2,0,0,0,0|1,0,0]=3 11401 B14R1.8282 CCCNC(=O)c1c(cccc1C)C 11a_100020643023_100000758298 [0,2,0,0,0,0|2,0,0]=4 11402 B14R1.8282 CCCNC(=O)c1c(cccc1C)C 1626a_100020643023_100000758298 [0,2,0,0,0,0|2,0,0]=4 11403 B14R1.8282 CCCNC(=O)c1c(cccc1C)C 240690a_100020643023_100000758298 [0,2,0,0,0,0|2,0,0]=4 11404 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)C 11a_100020643023_100000692601 [0,2,0,0,0,0|2,0,0]=4 11405 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)C 1626a_100020643023_100000692601 [0,2,0,0,0,0|2,0,0]=4 11406 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)C 240690a_100020643023_100000692601 [0,2,0,0,0,0|2,0,0]=4 11407 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)Cl 11a_100020643023_100000210656 [0,2,0,0,0,0|2,0,0]=4 11408 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)Cl 1626a_100020643023_100000210656 [0,2,0,0,0,0|2,0,0]=4 11409 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)Cl 240690a_100020643023_100000210656 [0,2,0,0,0,0|2,0,0]=4 11410 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)F 11a_100020643023_100000210369 [0,2,0,0,0,0|2,0,0]=4 11411 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)F 1626a_100020643023_100000210369 [0,2,0,0,0,0|2,0,0]=4 11412 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)F 240690a_100020643023_100000210369 [0,2,0,0,0,0|2,0,0]=4 11413 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)F 527a_100020643023_100000210369 [0,2,0,0,0,0|2,0,0]=4 11414 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)O 240690a_100020643023_100000745519 [0,2,0,0,0,0|1,0,0]=3 11415 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)O 527a_100020643023_100000745519 [0,2,0,0,0,0|1,0,0]=3 11416 B14R1.8282 CCCNC(=O)c1c(cccc1F)C 11a_100020643023_100000762013 [0,2,0,0,0,0|2,0,0]=4 11417 B14R1.8282 CCCNC(=O)c1c(cccc1F)C 1626a_100020643023_100000762013 [0,2,0,0,0,0|2,0,0]=4 11418 B14R1.8282 CCCNC(=O)c1c(cccc1F)C 240690a_100020643023_100000762013 [0,2,0,0,0,0|2,0,0]=4 11419 B14R1.8282 CCCNC(=O)c1c(cccc1F)C 527a_100020643023_100000762013 [0,2,0,0,0,0|2,0,0]=4 11420 B14R1.8282 CCCNC(=O)c1c(cccc1F)F 11a_100020643023_100000210804 [0,2,0,0,0,0|2,0,0]=4 11421 B14R1.8282 CCCNC(=O)c1c(cccc1F)F 1626a_100020643023_100000210804 [0,2,0,0,0,0|2,0,0]=4 11422 B14R1.8282 CCCNC(=O)c1c(cccc1F)F 240690a_100020643023_100000210804 [0,2,0,0,0,0|2,0,0]=4 11423 B14R1.8282 CCCNC(=O)c1c(cccc1F)F 527a_100020643023_100000210804 [0,2,0,0,0,0|2,0,0]=4 11424 B14R1.8282 CCCNC(=O)c1c(cccc1F)O 527a_100020643023_100000763259 [0,2,0,0,0,0|1,0,0]=3 11425 B14R1.8282 CCCNC(=O)c1c(cccc1I)Br 11a_100020643023_100010232521 [0,2,0,0,0,0|2,0,0]=4 11426 B14R1.8282 CCCNC(=O)c1c(cccc1I)Br 1626a_100020643023_100010232521 [0,2,0,0,0,0|2,0,0]=4 11427 B14R1.8282 CCCNC(=O)c1c(cccc1I)Br 240690a_100020643023_100010232521 [0,2,0,0,0,0|2,0,0]=4 11428 B14R1.8282 CCCNC(=O)c1c(cccc1I)Br 527a_100020643023_100010232521 [0,2,0,0,0,0|2,0,0]=4 11429 B14R1.8282 CCCNC(=O)c1c(cccc1I)C 11a_100020643023_100000688020 [0,2,0,0,0,0|2,0,0]=4 11430 B14R1.8282 CCCNC(=O)c1c(cccc1I)C 1626a_100020643023_100000688020 [0,2,0,0,0,0|2,0,0]=4 11431 B14R1.8282 CCCNC(=O)c1c(cccc1I)C 240690a_100020643023_100000688020 [0,2,0,0,0,0|2,0,0]=4 11432 B14R1.8282 CCCNC(=O)c1c(cccc1I)Cl 11a_100020643023_100000702859 [0,2,0,0,0,0|2,0,0]=4 11433 B14R1.8282 CCCNC(=O)c1c(cccc1I)Cl 1626a_100020643023_100000702859 [0,2,0,0,0,0|2,0,0]=4 11434 B14R1.8282 CCCNC(=O)c1c(cccc1I)Cl 240690a_100020643023_100000702859 [0,2,0,0,0,0|2,0,0]=4 11435 B14R1.8282 CCCNC(=O)c1c(cccc1I)Cl 527a_100020643023_100000702859 [0,2,0,0,0,0|2,0,0]=4 11436 B14R1.8282 CCCNC(=O)c1c(cccc1I)F 11a_100020643023_100000023732 [0,2,0,0,0,0|2,0,0]=4 11437 B14R1.8282 CCCNC(=O)c1c(cccc1I)F 1626a_100020643023_100000023732 [0,2,0,0,0,0|2,0,0]=4 11438 B14R1.8282 CCCNC(=O)c1c(cccc1I)F 240690a_100020643023_100000023732 [0,2,0,0,0,0|2,0,0]=4 11439 B14R1.8282 CCCNC(=O)c1c(cccc1O)O 527a_100020643023_100000755285 [0,2,0,0,0,0|1,0,0]=3 11440 B14R1.8282 CCNCC(=O)c1c(cccc1Cl)Cl 2230a_100015525214_100012340516 [0,2,0,0,0,0|2,0,0]=4 11441 B14R1.8282 CCNCC(=O)c1c(cccc1Cl)F 2230a_100015525214_100011219195 [0,2,0,0,0,0|2,0,0]=4 11442 B14R1.8282 CCNN=C(C)c1c(cccc1Br)O 4a_100000756455_100010174959 [0,2,0,0,0,0|2,0,0]=4 11443 B14R1.8282 CCNN=C(C)c1c(cccc1Cl)O 4a_100000756455_100000730630 [0,2,0,0,0,0|2,0,0]=4 11444 B14R1.8282 CCNN=C(C)c1c(cccc1F)O 4a_100000756455_100011216272 [0,2,0,0,0,0|2,0,0]=4 11445 B14R1.8282 CCNN=C(C)c1c(cccc1O)C 4a_100000756455_100009860897 [0,2,0,0,0,0|2,0,0]=4 11446 B14R1.8282 CCNN=C(C)c1c(cccc1O)O 4a_100000756455_100000691522 [0,2,0,0,0,0|2,0,0]=4 11447 B14R1.8282 CCNNC(=O)c1c(cccc1Br)Br 22a_100000756455_100000690891 [0,2,0,0,0,0|2,0,0]=4 11448 B14R1.8282 CCNNC(=O)c1c(cccc1Br)C 22a_100000756455_100000701904 [0,2,0,0,0,0|2,0,0]=4 11449 B14R1.8282 CCNNC(=O)c1c(cccc1Br)Cl 22a_100000756455_100011253703 [0,2,0,0,0,0|2,0,0]=4 11450 B14R1.8282 CCNNC(=O)c1c(cccc1Br)F 22a_100000756455_100000752694 [0,2,0,0,0,0|2,0,0]=4 11451 B14R1.8282 CCNNC(=O)c1c(cccc1Br)O 22a_100000756455_100011935254 [0,2,0,0,0,0|1,0,0]=3 11452 B14R1.8282 CCNNC(=O)c1c(cccc1C)C 22a_100000756455_100000758298 [0,2,0,0,0,0|2,0,0]=4 11453 B14R1.8282 CCNNC(=O)c1c(cccc1Cl)C 22a_100000756455_100000692601 [0,2,0,0,0,0|2,0,0]=4 11454 B14R1.8282 CCNNC(=O)c1c(cccc1Cl)Cl 22a_100000756455_100000210656 [0,2,0,0,0,0|2,0,0]=4 11455 B14R1.8282 CCNNC(=O)c1c(cccc1Cl)F 22a_100000756455_100000210369 [0,2,0,0,0,0|2,0,0]=4 11456 B14R1.8282 CCNNC(=O)c1c(cccc1Cl)O 22a_100000756455_100000745519 [0,2,0,0,0,0|1,0,0]=3 11457 B14R1.8282 CCNNC(=O)c1c(cccc1F)C 22a_100000756455_100000762013 [0,2,0,0,0,0|2,0,0]=4 11458 B14R1.8282 CCNNC(=O)c1c(cccc1F)F 22a_100000756455_100000210804 [0,2,0,0,0,0|2,0,0]=4 11459 B14R1.8282 CCNNC(=O)c1c(cccc1F)O 22a_100000756455_100000763259 [0,2,0,0,0,0|1,0,0]=3 11460 B14R1.8282 CCNNC(=O)c1c(cccc1I)Br 22a_100000756455_100010232521 [0,2,0,0,0,0|2,0,0]=4 11461 B14R1.8282 CCNNC(=O)c1c(cccc1I)C 22a_100000756455_100000688020 [0,2,0,0,0,0|2,0,0]=4 11462 B14R1.8282 CCNNC(=O)c1c(cccc1I)Cl 22a_100000756455_100000702859 [0,2,0,0,0,0|2,0,0]=4 11463 B14R1.8282 CCNNC(=O)c1c(cccc1I)F 22a_100000756455_100000023732 [0,2,0,0,0,0|2,0,0]=4 11464 B14R1.8282 CCNNC(=O)c1c(cccc1O)C 22a_100000756455_100011934116 [0,2,0,0,0,0|1,0,0]=3 11465 B14R1.8282 CCOCC(=O)c1c(cccc1Cl)Cl 34a_100121572206_100012340516 [0,2,0,0,0,0|1,0,0]=3 11466 B14R1.8282 CCOCC(=O)c1c(cccc1Cl)F 34a_100121572206_100011219195 [0,2,0,0,0,0|1,0,0]=3 11467 B14R1.8282 CCOCC(=O)c1c(cccc1F)F 34a_100121572206_100000199083 [0,2,0,0,0,0|1,0,0]=3 11468 B14R1.8282 CCSCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_100000210202 [0,2,0,0,0,0|1,1,0]=4 11469 B14R1.8282 CCSCC(=O)c1c(cccc1Cl)F 62a_100000210202_100011219195 [0,2,0,0,0,0|1,1,0]=4 11470 B14R1.8282 CCSCC(=O)c1c(cccc1Cl)F 62a_100011219195_100000210202 [0,2,0,0,0,0|1,1,0]=4 11471 B14R1.8282 CCSCC(=O)c1c(cccc1F)F 62a_100000199083_100000210202 [0,2,0,0,0,0|1,1,0]=4 11472 B14R1.8282 CCSCC(=O)c1c(cccc1F)F 62a_100000210202_100000199083 [0,2,0,0,0,0|1,1,0]=4 11473 B14R1.8282 COCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000233755 [0,2,0,0,0,0|2,0,0]=4 11474 B14R1.8282 COCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000233755 [0,2,0,0,0,0|2,0,0]=4 11475 B14R1.8282 COCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000233755 [0,2,0,0,0,0|2,0,0]=4 11476 B14R1.8282 COCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000233755 [0,2,0,0,0,0|2,0,0]=4 11477 B14R1.8282 COCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000233755 [0,2,0,0,0,0|1,0,0]=3 11478 B14R1.8282 COCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000233755 [0,2,0,0,0,0|2,0,0]=4 11479 B14R1.8282 COCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000233755 [0,2,0,0,0,0|2,0,0]=4 11480 B14R1.8282 COCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000233755 [0,2,0,0,0,0|2,0,0]=4 11481 B14R1.8282 COCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000233755 [0,2,0,0,0,0|2,0,0]=4 11482 B14R1.8282 COCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000233755 [0,2,0,0,0,0|1,0,0]=3 11483 B14R1.8282 COCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000233755 [0,2,0,0,0,0|2,0,0]=4 11484 B14R1.8282 COCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000233755 [0,2,0,0,0,0|2,0,0]=4 11485 B14R1.8282 COCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000233755 [0,2,0,0,0,0|1,0,0]=3 11486 B14R1.8282 COCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000233755 [0,2,0,0,0,0|2,0,0]=4 11487 B14R1.8282 COCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000233755 [0,2,0,0,0,0|2,0,0]=4 11488 B14R1.8282 COCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000233755 [0,2,0,0,0,0|2,0,0]=4 11489 B14R1.8282 COCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000233755 [0,2,0,0,0,0|2,0,0]=4 11490 B14R1.8282 COCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000233755 [0,2,0,0,0,0|1,0,0]=3 11491 B14R1.8282 COCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000233755 [0,2,0,0,0,0|1,0,0]=3 11492 B14R1.8282 CSCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000751147 [0,2,0,0,0,0|2,0,0]=4 11493 B14R1.8282 CSCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000751147 [0,2,0,0,0,0|2,0,0]=4 11494 B14R1.8282 CSCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000751147 [0,2,0,0,0,0|2,0,0]=4 11495 B14R1.8282 CSCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000751147 [0,2,0,0,0,0|2,0,0]=4 11496 B14R1.8282 CSCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000751147 [0,2,0,0,0,0|1,0,0]=3 11497 B14R1.8282 CSCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000751147 [0,2,0,0,0,0|2,0,0]=4 11498 B14R1.8282 CSCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000751147 [0,2,0,0,0,0|2,0,0]=4 11499 B14R1.8282 CSCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000751147 [0,2,0,0,0,0|2,0,0]=4 11500 B14R1.8282 CSCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000751147 [0,2,0,0,0,0|2,0,0]=4 11501 B14R1.8282 CSCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000751147 [0,2,0,0,0,0|1,0,0]=3 11502 B14R1.8282 CSCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000751147 [0,2,0,0,0,0|2,0,0]=4 11503 B14R1.8282 CSCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000751147 [0,2,0,0,0,0|2,0,0]=4 11504 B14R1.8282 CSCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000751147 [0,2,0,0,0,0|1,0,0]=3 11505 B14R1.8282 CSCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000751147 [0,2,0,0,0,0|2,0,0]=4 11506 B14R1.8282 CSCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000751147 [0,2,0,0,0,0|2,0,0]=4 11507 B14R1.8282 CSCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000751147 [0,2,0,0,0,0|2,0,0]=4 11508 B14R1.8282 CSCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000751147 [0,2,0,0,0,0|2,0,0]=4 11509 B14R1.8282 CSCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000751147 [0,2,0,0,0,0|1,0,0]=3 11510 B14R1.8282 CSCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000751147 [0,2,0,0,0,0|1,0,0]=3 11511 B14R1.8282 Cc1cccc(c1C(=O)CCC#N)O 1458a_100011934116_100011215226 [0,2,0,0,0,0|1,0,1]=4 11512 B14R1.8282 Cc1cccc(c1C(=O)CCCF)Br 1458a_100000701904_100011934791 [0,2,0,0,0,0|2,0,0]=4 11513 B14R1.8282 Cc1cccc(c1C(=O)CCCF)C 1458a_100000758298_100011934791 [0,2,0,0,0,0|2,0,0]=4 11514 B14R1.8282 Cc1cccc(c1C(=O)CCCF)Cl 1458a_100000692601_100011934791 [0,2,0,0,0,0|2,0,0]=4 11515 B14R1.8282 Cc1cccc(c1C(=O)CCCF)F 1458a_100000762013_100011934791 [0,2,0,0,0,0|2,0,0]=4 11516 B14R1.8282 Cc1cccc(c1C(=O)CCCF)I 1458a_100000688020_100011934791 [0,2,0,0,0,0|2,0,0]=4 11517 B14R1.8282 Cc1cccc(c1C(=O)CCCF)O 1458a_100011934116_100011934791 [0,2,0,0,0,0|1,0,0]=3 11518 B14R1.8282 Cc1cccc(c1C(=O)CCCO)Br 1458a_100000701904_100011215043 [0,2,0,0,0,0|2,0,0]=4 11519 B14R1.8282 Cc1cccc(c1C(=O)CCCO)C 1458a_100000758298_100011215043 [0,2,0,0,0,0|2,0,0]=4 11520 B14R1.8282 Cc1cccc(c1C(=O)CCCO)Cl 1458a_100000692601_100011215043 [0,2,0,0,0,0|2,0,0]=4 11521 B14R1.8282 Cc1cccc(c1C(=O)CCCO)F 1458a_100000762013_100011215043 [0,2,0,0,0,0|2,0,0]=4 11522 B14R1.8282 Cc1cccc(c1C(=O)CCCO)I 1458a_100000688020_100011215043 [0,2,0,0,0,0|2,0,0]=4 11523 B14R1.8282 Cc1cccc(c1C(=O)CCCO)O 1458a_100011934116_100011215043 [0,2,0,0,0,0|1,0,0]=3 11524 B14R1.8282 Cc1cccc(c1C(=O)NCCF)Br 11a_100000724931_100000701904 [0,2,0,0,0,0|2,0,0]=4 11525 B14R1.8282 Cc1cccc(c1C(=O)NCCF)Br 1626a_100000724931_100000701904 [0,2,0,0,0,0|2,0,0]=4 11526 B14R1.8282 Cc1cccc(c1C(=O)NCCF)Br 240690a_100000724931_100000701904 [0,2,0,0,0,0|2,0,0]=4 11527 B14R1.8282 Cc1cccc(c1C(=O)NCCF)Br 527a_100000724931_100000701904 [0,2,0,0,0,0|2,0,0]=4 11528 B14R1.8282 Cc1cccc(c1C(=O)NCCF)C 11a_100000724931_100000758298 [0,2,0,0,0,0|2,0,0]=4 11529 B14R1.8282 Cc1cccc(c1C(=O)NCCF)C 1626a_100000724931_100000758298 [0,2,0,0,0,0|2,0,0]=4 11530 B14R1.8282 Cc1cccc(c1C(=O)NCCF)C 240690a_100000724931_100000758298 [0,2,0,0,0,0|2,0,0]=4 11531 B14R1.8282 Cc1cccc(c1C(=O)NCCF)Cl 11a_100000724931_100000692601 [0,2,0,0,0,0|2,0,0]=4 11532 B14R1.8282 Cc1cccc(c1C(=O)NCCF)Cl 1626a_100000724931_100000692601 [0,2,0,0,0,0|2,0,0]=4 11533 B14R1.8282 Cc1cccc(c1C(=O)NCCF)Cl 240690a_100000724931_100000692601 [0,2,0,0,0,0|2,0,0]=4 11534 B14R1.8282 Cc1cccc(c1C(=O)NCCF)F 11a_100000724931_100000762013 [0,2,0,0,0,0|2,0,0]=4 11535 B14R1.8282 Cc1cccc(c1C(=O)NCCF)F 1626a_100000724931_100000762013 [0,2,0,0,0,0|2,0,0]=4 11536 B14R1.8282 Cc1cccc(c1C(=O)NCCF)F 240690a_100000724931_100000762013 [0,2,0,0,0,0|2,0,0]=4 11537 B14R1.8282 Cc1cccc(c1C(=O)NCCF)F 527a_100000724931_100000762013 [0,2,0,0,0,0|2,0,0]=4 11538 B14R1.8282 Cc1cccc(c1C(=O)NCCF)I 11a_100000724931_100000688020 [0,2,0,0,0,0|2,0,0]=4 11539 B14R1.8282 Cc1cccc(c1C(=O)NCCF)I 1626a_100000724931_100000688020 [0,2,0,0,0,0|2,0,0]=4 11540 B14R1.8282 Cc1cccc(c1C(=O)NCCF)I 240690a_100000724931_100000688020 [0,2,0,0,0,0|2,0,0]=4 11541 B14R1.8282 Cc1cccc(c1C(=O)NCCO)Br 240690a_100000210304_100000701904 [0,2,0,0,0,0|2,0,0]=4 11542 B14R1.8282 Cc1cccc(c1C(=O)NCCO)Br 527a_100000210304_100000701904 [0,2,0,0,0,0|2,0,0]=4 11543 B14R1.8282 Cc1cccc(c1C(=O)NCCO)C 240690a_100000210304_100000758298 [0,2,0,0,0,0|2,0,0]=4 11544 B14R1.8282 Cc1cccc(c1C(=O)NCCO)Cl 240690a_100000210304_100000692601 [0,2,0,0,0,0|2,0,0]=4 11545 B14R1.8282 Cc1cccc(c1C(=O)NCCO)F 240690a_100000210304_100000762013 [0,2,0,0,0,0|2,0,0]=4 11546 B14R1.8282 Cc1cccc(c1C(=O)NCCO)F 527a_100000210304_100000762013 [0,2,0,0,0,0|2,0,0]=4 11547 B14R1.8282 Cc1cccc(c1C(=O)NCCO)I 240690a_100000210304_100000688020 [0,2,0,0,0,0|2,0,0]=4 11548 B14R1.8282 N#CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011215226 [0,2,0,0,0,0|1,0,1]=4 11549 B14R1.8282 N#CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011215226 [0,2,0,0,0,0|1,0,1]=4 11550 B14R1.8282 N#CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100011215226 [0,2,0,0,0,0|1,0,1]=4 11551 B14R1.8282 N#CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100011215226 [0,2,0,0,0,0|1,0,1]=4 11552 B14R1.8282 N#CCNC(=O)c1c(cccc1Br)O 527a_100000734998_100011935254 [0,2,0,0,0,0|1,0,1]=4 11553 B14R1.8282 N#CCNC(=O)c1c(cccc1Cl)O 527a_100000734998_100000745519 [0,2,0,0,0,0|1,0,1]=4 11554 B14R1.8282 N#CCNC(=O)c1c(cccc1F)O 527a_100000734998_100000763259 [0,2,0,0,0,0|1,0,1]=4 11555 B14R1.8282 N#CCNC(=O)c1c(cccc1O)O 527a_100000734998_100000755285 [0,2,0,0,0,0|1,0,1]=4 11556 B14R1.8282 O=C(CCCF)c1c(cccc1Br)Br 1458a_100000690891_100011934791 [0,2,0,0,0,0|2,0,0]=4 11557 B14R1.8282 O=C(CCCF)c1c(cccc1Br)Cl 1458a_100011253703_100011934791 [0,2,0,0,0,0|2,0,0]=4 11558 B14R1.8282 O=C(CCCF)c1c(cccc1Br)F 1458a_100000752694_100011934791 [0,2,0,0,0,0|2,0,0]=4 11559 B14R1.8282 O=C(CCCF)c1c(cccc1Br)O 1458a_100011935254_100011934791 [0,2,0,0,0,0|1,0,0]=3 11560 B14R1.8282 O=C(CCCF)c1c(cccc1Cl)Cl 1458a_100000210656_100011934791 [0,2,0,0,0,0|2,0,0]=4 11561 B14R1.8282 O=C(CCCF)c1c(cccc1Cl)F 1458a_100000210369_100011934791 [0,2,0,0,0,0|2,0,0]=4 11562 B14R1.8282 O=C(CCCF)c1c(cccc1Cl)O 1458a_100000745519_100011934791 [0,2,0,0,0,0|1,0,0]=3 11563 B14R1.8282 O=C(CCCF)c1c(cccc1F)F 1458a_100000210804_100011934791 [0,2,0,0,0,0|2,0,0]=4 11564 B14R1.8282 O=C(CCCF)c1c(cccc1F)O 1458a_100000763259_100011934791 [0,2,0,0,0,0|1,0,0]=3 11565 B14R1.8282 O=C(CCCF)c1c(cccc1I)Br 1458a_100010232521_100011934791 [0,2,0,0,0,0|2,0,0]=4 11566 B14R1.8282 O=C(CCCF)c1c(cccc1I)Cl 1458a_100000702859_100011934791 [0,2,0,0,0,0|2,0,0]=4 11567 B14R1.8282 O=C(CCCF)c1c(cccc1I)F 1458a_100000023732_100011934791 [0,2,0,0,0,0|2,0,0]=4 11568 B14R1.8282 O=C(CCCF)c1c(cccc1O)O 1458a_100000755285_100011934791 [0,2,0,0,0,0|1,0,0]=3 11569 B14R1.8282 O=C(CCCO)c1c(cccc1Br)Br 1458a_100000690891_100011215043 [0,2,0,0,0,0|2,0,0]=4 11570 B14R1.8282 O=C(CCCO)c1c(cccc1Br)Cl 1458a_100011253703_100011215043 [0,2,0,0,0,0|2,0,0]=4 11571 B14R1.8282 O=C(CCCO)c1c(cccc1Br)F 1458a_100000752694_100011215043 [0,2,0,0,0,0|2,0,0]=4 11572 B14R1.8282 O=C(CCCO)c1c(cccc1Br)O 1458a_100011935254_100011215043 [0,2,0,0,0,0|1,0,0]=3 11573 B14R1.8282 O=C(CCCO)c1c(cccc1Cl)Cl 1458a_100000210656_100011215043 [0,2,0,0,0,0|2,0,0]=4 11574 B14R1.8282 O=C(CCCO)c1c(cccc1Cl)F 1458a_100000210369_100011215043 [0,2,0,0,0,0|2,0,0]=4 11575 B14R1.8282 O=C(CCCO)c1c(cccc1Cl)O 1458a_100000745519_100011215043 [0,2,0,0,0,0|1,0,0]=3 11576 B14R1.8282 O=C(CCCO)c1c(cccc1F)F 1458a_100000210804_100011215043 [0,2,0,0,0,0|2,0,0]=4 11577 B14R1.8282 O=C(CCCO)c1c(cccc1F)O 1458a_100000763259_100011215043 [0,2,0,0,0,0|1,0,0]=3 11578 B14R1.8282 O=C(CCCO)c1c(cccc1I)Br 1458a_100010232521_100011215043 [0,2,0,0,0,0|2,0,0]=4 11579 B14R1.8282 O=C(CCCO)c1c(cccc1I)Cl 1458a_100000702859_100011215043 [0,2,0,0,0,0|2,0,0]=4 11580 B14R1.8282 O=C(CCCO)c1c(cccc1I)F 1458a_100000023732_100011215043 [0,2,0,0,0,0|2,0,0]=4 11581 B14R1.8282 O=C(CCCO)c1c(cccc1O)O 1458a_100000755285_100011215043 [0,2,0,0,0,0|1,0,0]=3 11582 B14R1.8282 O=C(NCCF)c1c(cccc1Br)Br 11a_100000724931_100000690891 [0,2,0,0,0,0|2,0,0]=4 11583 B14R1.8282 O=C(NCCF)c1c(cccc1Br)Br 1626a_100000724931_100000690891 [0,2,0,0,0,0|2,0,0]=4 11584 B14R1.8282 O=C(NCCF)c1c(cccc1Br)Br 240690a_100000724931_100000690891 [0,2,0,0,0,0|2,0,0]=4 11585 B14R1.8282 O=C(NCCF)c1c(cccc1Br)Br 527a_100000724931_100000690891 [0,2,0,0,0,0|2,0,0]=4 11586 B14R1.8282 O=C(NCCF)c1c(cccc1Br)Cl 11a_100000724931_100011253703 [0,2,0,0,0,0|2,0,0]=4 11587 B14R1.8282 O=C(NCCF)c1c(cccc1Br)Cl 1626a_100000724931_100011253703 [0,2,0,0,0,0|2,0,0]=4 11588 B14R1.8282 O=C(NCCF)c1c(cccc1Br)Cl 240690a_100000724931_100011253703 [0,2,0,0,0,0|2,0,0]=4 11589 B14R1.8282 O=C(NCCF)c1c(cccc1Br)Cl 527a_100000724931_100011253703 [0,2,0,0,0,0|2,0,0]=4 11590 B14R1.8282 O=C(NCCF)c1c(cccc1Br)F 11a_100000724931_100000752694 [0,2,0,0,0,0|2,0,0]=4 11591 B14R1.8282 O=C(NCCF)c1c(cccc1Br)F 1626a_100000724931_100000752694 [0,2,0,0,0,0|2,0,0]=4 11592 B14R1.8282 O=C(NCCF)c1c(cccc1Br)F 240690a_100000724931_100000752694 [0,2,0,0,0,0|2,0,0]=4 11593 B14R1.8282 O=C(NCCF)c1c(cccc1Br)F 527a_100000724931_100000752694 [0,2,0,0,0,0|2,0,0]=4 11594 B14R1.8282 O=C(NCCF)c1c(cccc1Br)O 240690a_100000724931_100011935254 [0,2,0,0,0,0|1,0,0]=3 11595 B14R1.8282 O=C(NCCF)c1c(cccc1Br)O 527a_100000724931_100011935254 [0,2,0,0,0,0|1,0,0]=3 11596 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)Cl 11a_100000724931_100000210656 [0,2,0,0,0,0|2,0,0]=4 11597 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)Cl 1626a_100000724931_100000210656 [0,2,0,0,0,0|2,0,0]=4 11598 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)Cl 240690a_100000724931_100000210656 [0,2,0,0,0,0|2,0,0]=4 11599 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)F 11a_100000724931_100000210369 [0,2,0,0,0,0|2,0,0]=4 11600 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)F 1626a_100000724931_100000210369 [0,2,0,0,0,0|2,0,0]=4 11601 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)F 240690a_100000724931_100000210369 [0,2,0,0,0,0|2,0,0]=4 11602 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)F 527a_100000724931_100000210369 [0,2,0,0,0,0|2,0,0]=4 11603 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)O 240690a_100000724931_100000745519 [0,2,0,0,0,0|1,0,0]=3 11604 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)O 527a_100000724931_100000745519 [0,2,0,0,0,0|1,0,0]=3 11605 B14R1.8282 O=C(NCCF)c1c(cccc1F)F 11a_100000724931_100000210804 [0,2,0,0,0,0|2,0,0]=4 11606 B14R1.8282 O=C(NCCF)c1c(cccc1F)F 1626a_100000724931_100000210804 [0,2,0,0,0,0|2,0,0]=4 11607 B14R1.8282 O=C(NCCF)c1c(cccc1F)F 240690a_100000724931_100000210804 [0,2,0,0,0,0|2,0,0]=4 11608 B14R1.8282 O=C(NCCF)c1c(cccc1F)F 527a_100000724931_100000210804 [0,2,0,0,0,0|2,0,0]=4 11609 B14R1.8282 O=C(NCCF)c1c(cccc1F)O 527a_100000724931_100000763259 [0,2,0,0,0,0|1,0,0]=3 11610 B14R1.8282 O=C(NCCF)c1c(cccc1I)Br 11a_100000724931_100010232521 [0,2,0,0,0,0|2,0,0]=4 11611 B14R1.8282 O=C(NCCF)c1c(cccc1I)Br 1626a_100000724931_100010232521 [0,2,0,0,0,0|2,0,0]=4 11612 B14R1.8282 O=C(NCCF)c1c(cccc1I)Br 240690a_100000724931_100010232521 [0,2,0,0,0,0|2,0,0]=4 11613 B14R1.8282 O=C(NCCF)c1c(cccc1I)Br 527a_100000724931_100010232521 [0,2,0,0,0,0|2,0,0]=4 11614 B14R1.8282 O=C(NCCF)c1c(cccc1I)Cl 11a_100000724931_100000702859 [0,2,0,0,0,0|2,0,0]=4 11615 B14R1.8282 O=C(NCCF)c1c(cccc1I)Cl 1626a_100000724931_100000702859 [0,2,0,0,0,0|2,0,0]=4 11616 B14R1.8282 O=C(NCCF)c1c(cccc1I)Cl 240690a_100000724931_100000702859 [0,2,0,0,0,0|2,0,0]=4 11617 B14R1.8282 O=C(NCCF)c1c(cccc1I)Cl 527a_100000724931_100000702859 [0,2,0,0,0,0|2,0,0]=4 11618 B14R1.8282 O=C(NCCF)c1c(cccc1I)F 11a_100000724931_100000023732 [0,2,0,0,0,0|2,0,0]=4 11619 B14R1.8282 O=C(NCCF)c1c(cccc1I)F 1626a_100000724931_100000023732 [0,2,0,0,0,0|2,0,0]=4 11620 B14R1.8282 O=C(NCCF)c1c(cccc1I)F 240690a_100000724931_100000023732 [0,2,0,0,0,0|2,0,0]=4 11621 B14R1.8282 O=C(NCCF)c1c(cccc1O)O 527a_100000724931_100000755285 [0,2,0,0,0,0|1,0,0]=3 11622 B14R1.8282 O=C(NCCO)c1c(cccc1Br)Br 240690a_100000210304_100000690891 [0,2,0,0,0,0|2,0,0]=4 11623 B14R1.8282 O=C(NCCO)c1c(cccc1Br)Br 527a_100000210304_100000690891 [0,2,0,0,0,0|2,0,0]=4 11624 B14R1.8282 O=C(NCCO)c1c(cccc1Br)Cl 240690a_100000210304_100011253703 [0,2,0,0,0,0|2,0,0]=4 11625 B14R1.8282 O=C(NCCO)c1c(cccc1Br)Cl 527a_100000210304_100011253703 [0,2,0,0,0,0|2,0,0]=4 11626 B14R1.8282 O=C(NCCO)c1c(cccc1Br)F 240690a_100000210304_100000752694 [0,2,0,0,0,0|2,0,0]=4 11627 B14R1.8282 O=C(NCCO)c1c(cccc1Br)F 527a_100000210304_100000752694 [0,2,0,0,0,0|2,0,0]=4 11628 B14R1.8282 O=C(NCCO)c1c(cccc1Br)O 240690a_100000210304_100011935254 [0,2,0,0,0,0|1,0,0]=3 11629 B14R1.8282 O=C(NCCO)c1c(cccc1Br)O 527a_100000210304_100011935254 [0,2,0,0,0,0|1,0,0]=3 11630 B14R1.8282 O=C(NCCO)c1c(cccc1Cl)Cl 240690a_100000210304_100000210656 [0,2,0,0,0,0|2,0,0]=4 11631 B14R1.8282 O=C(NCCO)c1c(cccc1Cl)F 240690a_100000210304_100000210369 [0,2,0,0,0,0|2,0,0]=4 11632 B14R1.8282 O=C(NCCO)c1c(cccc1Cl)F 527a_100000210304_100000210369 [0,2,0,0,0,0|2,0,0]=4 11633 B14R1.8282 O=C(NCCO)c1c(cccc1Cl)O 240690a_100000210304_100000745519 [0,2,0,0,0,0|1,0,0]=3 11634 B14R1.8282 O=C(NCCO)c1c(cccc1Cl)O 527a_100000210304_100000745519 [0,2,0,0,0,0|1,0,0]=3 11635 B14R1.8282 O=C(NCCO)c1c(cccc1F)F 240690a_100000210304_100000210804 [0,2,0,0,0,0|2,0,0]=4 11636 B14R1.8282 O=C(NCCO)c1c(cccc1F)F 527a_100000210304_100000210804 [0,2,0,0,0,0|2,0,0]=4 11637 B14R1.8282 O=C(NCCO)c1c(cccc1F)O 527a_100000210304_100000763259 [0,2,0,0,0,0|1,0,0]=3 11638 B14R1.8282 O=C(NCCO)c1c(cccc1I)Br 240690a_100000210304_100010232521 [0,2,0,0,0,0|2,0,0]=4 11639 B14R1.8282 O=C(NCCO)c1c(cccc1I)Br 527a_100000210304_100010232521 [0,2,0,0,0,0|2,0,0]=4 11640 B14R1.8282 O=C(NCCO)c1c(cccc1I)Cl 240690a_100000210304_100000702859 [0,2,0,0,0,0|2,0,0]=4 11641 B14R1.8282 O=C(NCCO)c1c(cccc1I)Cl 527a_100000210304_100000702859 [0,2,0,0,0,0|2,0,0]=4 11642 B14R1.8282 O=C(NCCO)c1c(cccc1I)F 240690a_100000210304_100000023732 [0,2,0,0,0,0|2,0,0]=4 11643 B14R1.8282 O=C(NCCO)c1c(cccc1O)O 527a_100000210304_100000755285 [0,2,0,0,0,0|1,0,0]=3 11644 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000758301 [0,2,0,0,0,0|2,0,0]=4 11645 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Br)C 1458a_100000685072_100000758301 [0,2,0,0,0,0|2,0,0]=4 11646 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000758301 [0,2,0,0,0,0|2,0,0]=4 11647 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Br)F 1458a_100000212304_100000758301 [0,2,0,0,0,0|2,0,0]=4 11648 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Br)I 1458a_100012360512_100000758301 [0,2,0,0,0,0|2,0,0]=4 11649 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Br)O 1458a_100012344906_100000758301 [0,2,0,0,0,0|2,0,0]=4 11650 B14R1.2819 CCC(C)C(=O)c1ccc(cc1C)Br 1458a_100000741311_100000758301 [0,2,0,0,0,0|2,0,0]=4 11651 B14R1.2819 CCC(C)C(=O)c1ccc(cc1C)C 1458a_100000211164_100000758301 [0,2,0,0,0,0|2,0,0]=4 11652 B14R1.2819 CCC(C)C(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000758301 [0,2,0,0,0,0|2,0,0]=4 11653 B14R1.2819 CCC(C)C(=O)c1ccc(cc1C)F 1458a_100000686989_100000758301 [0,2,0,0,0,0|2,0,0]=4 11654 B14R1.2819 CCC(C)C(=O)c1ccc(cc1C)I 1458a_100010189873_100000758301 [0,2,0,0,0,0|2,0,0]=4 11655 B14R1.2819 CCC(C)C(=O)c1ccc(cc1C)O 1458a_100000692822_100000758301 [0,2,0,0,0,0|2,0,0]=4 11656 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000758301 [0,2,0,0,0,0|2,0,0]=4 11657 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000758301 [0,2,0,0,0,0|2,0,0]=4 11658 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000758301 [0,2,0,0,0,0|2,0,0]=4 11659 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000758301 [0,2,0,0,0,0|2,0,0]=4 11660 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000758301 [0,2,0,0,0,0|2,0,0]=4 11661 B14R1.2819 CCC(C)C(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000758301 [0,2,0,0,0,0|2,0,0]=4 11662 B14R1.2819 CCC(C)C(=O)c1ccc(cc1F)Br 1458a_100000214689_100000758301 [0,2,0,0,0,0|2,0,0]=4 11663 B14R1.2819 CCC(C)C(=O)c1ccc(cc1F)C 1458a_100000766033_100000758301 [0,2,0,0,0,0|2,0,0]=4 11664 B14R1.2819 CCC(C)C(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000758301 [0,2,0,0,0,0|2,0,0]=4 11665 B14R1.2819 CCC(C)C(=O)c1ccc(cc1F)F 1458a_100000211022_100000758301 [0,2,0,0,0,0|2,0,0]=4 11666 B14R1.2819 CCC(C)C(=O)c1ccc(cc1F)I 1458a_100000037189_100000758301 [0,2,0,0,0,0|2,0,0]=4 11667 B14R1.2819 CCC(C)C(=O)c1ccc(cc1F)O 1458a_100000689029_100000758301 [0,2,0,0,0,0|2,0,0]=4 11668 B14R1.2819 CCC(C)C(=O)c1ccc(cc1I)Br 1458a_100000751167_100000758301 [0,2,0,0,0,0|2,0,0]=4 11669 B14R1.2819 CCC(C)C(=O)c1ccc(cc1I)C 1458a_100009999607_100000758301 [0,2,0,0,0,0|2,0,0]=4 11670 B14R1.2819 CCC(C)C(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000758301 [0,2,0,0,0,0|2,0,0]=4 11671 B14R1.2819 CCC(C)C(=O)c1ccc(cc1I)F 1458a_100000739341_100000758301 [0,2,0,0,0,0|2,0,0]=4 11672 B14R1.2819 CCC(C)C(=O)c1ccc(cc1O)Br 1458a_100000744433_100000758301 [0,2,0,0,0,0|1,0,0]=3 11673 B14R1.2819 CCC(C)C(=O)c1ccc(cc1O)C 1458a_100000212137_100000758301 [0,2,0,0,0,0|1,0,0]=3 11674 B14R1.2819 CCC(C)C(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000758301 [0,2,0,0,0,0|1,0,0]=3 11675 B14R1.2819 CCC(C)C(=O)c1ccc(cc1O)F 1458a_100000746061_100000758301 [0,2,0,0,0,0|1,0,0]=3 11676 B14R1.2819 CCC(C)C(=O)c1ccc(cc1O)I 1458a_100000091984_100000758301 [0,2,0,0,0,0|1,0,0]=3 11677 B14R1.2819 CCC(C)C(=O)c1ccc(cc1O)O 1458a_100000212172_100000758301 [0,2,0,0,0,0|1,0,0]=3 11678 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)Br 11a_100000225621_100000762965 [0,2,0,0,0,0|2,0,0]=4 11679 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)Br 1626a_100000225621_100000762965 [0,2,0,0,0,0|2,0,0]=4 11680 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)Br 240690a_100000225621_100000762965 [0,2,0,0,0,0|2,0,0]=4 11681 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)Br 527a_100000225621_100000762965 [0,2,0,0,0,0|2,0,0]=4 11682 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)C 11a_100000225621_100000685072 [0,2,0,0,0,0|2,0,0]=4 11683 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)C 1626a_100000225621_100000685072 [0,2,0,0,0,0|2,0,0]=4 11684 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)C 240690a_100000225621_100000685072 [0,2,0,0,0,0|2,0,0]=4 11685 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)C 527a_100000225621_100000685072 [0,2,0,0,0,0|2,0,0]=4 11686 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)Cl 11a_100000225621_100000766353 [0,2,0,0,0,0|2,0,0]=4 11687 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)Cl 1626a_100000225621_100000766353 [0,2,0,0,0,0|2,0,0]=4 11688 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)Cl 240690a_100000225621_100000766353 [0,2,0,0,0,0|2,0,0]=4 11689 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)Cl 527a_100000225621_100000766353 [0,2,0,0,0,0|2,0,0]=4 11690 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)F 11a_100000225621_100000212304 [0,2,0,0,0,0|2,0,0]=4 11691 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)F 1626a_100000225621_100000212304 [0,2,0,0,0,0|2,0,0]=4 11692 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)F 240690a_100000225621_100000212304 [0,2,0,0,0,0|2,0,0]=4 11693 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)F 527a_100000225621_100000212304 [0,2,0,0,0,0|2,0,0]=4 11694 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)I 11a_100000225621_100012360512 [0,2,0,0,0,0|2,0,0]=4 11695 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)I 1626a_100000225621_100012360512 [0,2,0,0,0,0|2,0,0]=4 11696 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)I 240690a_100000225621_100012360512 [0,2,0,0,0,0|2,0,0]=4 11697 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)I 527a_100000225621_100012360512 [0,2,0,0,0,0|2,0,0]=4 11698 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)O 240690a_100000225621_100012344906 [0,2,0,0,0,0|2,0,0]=4 11699 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Br)O 527a_100000225621_100012344906 [0,2,0,0,0,0|2,0,0]=4 11700 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)Br 11a_100000225621_100000741311 [0,2,0,0,0,0|2,0,0]=4 11701 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)Br 1626a_100000225621_100000741311 [0,2,0,0,0,0|2,0,0]=4 11702 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)Br 240690a_100000225621_100000741311 [0,2,0,0,0,0|2,0,0]=4 11703 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)Br 527a_100000225621_100000741311 [0,2,0,0,0,0|2,0,0]=4 11704 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)C 11a_100000225621_100000211164 [0,2,0,0,0,0|2,0,0]=4 11705 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)C 1626a_100000225621_100000211164 [0,2,0,0,0,0|2,0,0]=4 11706 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)C 240690a_100000225621_100000211164 [0,2,0,0,0,0|2,0,0]=4 11707 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)C 527a_100000225621_100000211164 [0,2,0,0,0,0|2,0,0]=4 11708 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)Cl 11a_100000225621_100000688705 [0,2,0,0,0,0|2,0,0]=4 11709 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)Cl 1626a_100000225621_100000688705 [0,2,0,0,0,0|2,0,0]=4 11710 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)Cl 240690a_100000225621_100000688705 [0,2,0,0,0,0|2,0,0]=4 11711 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)Cl 527a_100000225621_100000688705 [0,2,0,0,0,0|2,0,0]=4 11712 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)F 11a_100000225621_100000686989 [0,2,0,0,0,0|2,0,0]=4 11713 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)F 1626a_100000225621_100000686989 [0,2,0,0,0,0|2,0,0]=4 11714 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)F 240690a_100000225621_100000686989 [0,2,0,0,0,0|2,0,0]=4 11715 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)F 527a_100000225621_100000686989 [0,2,0,0,0,0|2,0,0]=4 11716 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)I 11a_100000225621_100010189873 [0,2,0,0,0,0|2,0,0]=4 11717 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)I 1626a_100000225621_100010189873 [0,2,0,0,0,0|2,0,0]=4 11718 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)I 240690a_100000225621_100010189873 [0,2,0,0,0,0|2,0,0]=4 11719 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)I 527a_100000225621_100010189873 [0,2,0,0,0,0|2,0,0]=4 11720 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)O 240690a_100000225621_100000692822 [0,2,0,0,0,0|2,0,0]=4 11721 B14R1.2819 CCN(C)C(=O)c1ccc(cc1C)O 527a_100000225621_100000692822 [0,2,0,0,0,0|2,0,0]=4 11722 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)Br 11a_100000225621_100000741628 [0,2,0,0,0,0|2,0,0]=4 11723 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)Br 1626a_100000225621_100000741628 [0,2,0,0,0,0|2,0,0]=4 11724 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)Br 240690a_100000225621_100000741628 [0,2,0,0,0,0|2,0,0]=4 11725 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)Br 527a_100000225621_100000741628 [0,2,0,0,0,0|2,0,0]=4 11726 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)C 11a_100000225621_100000766932 [0,2,0,0,0,0|2,0,0]=4 11727 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)C 1626a_100000225621_100000766932 [0,2,0,0,0,0|2,0,0]=4 11728 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)C 240690a_100000225621_100000766932 [0,2,0,0,0,0|2,0,0]=4 11729 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)C 527a_100000225621_100000766932 [0,2,0,0,0,0|2,0,0]=4 11730 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)Cl 11a_100000225621_100000185840 [0,2,0,0,0,0|2,0,0]=4 11731 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)Cl 1626a_100000225621_100000185840 [0,2,0,0,0,0|2,0,0]=4 11732 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)Cl 240690a_100000225621_100000185840 [0,2,0,0,0,0|2,0,0]=4 11733 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)Cl 527a_100000225621_100000185840 [0,2,0,0,0,0|2,0,0]=4 11734 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)F 11a_100000225621_100000211397 [0,2,0,0,0,0|2,0,0]=4 11735 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)F 1626a_100000225621_100000211397 [0,2,0,0,0,0|2,0,0]=4 11736 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)F 240690a_100000225621_100000211397 [0,2,0,0,0,0|2,0,0]=4 11737 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)F 527a_100000225621_100000211397 [0,2,0,0,0,0|2,0,0]=4 11738 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)I 11a_100000225621_100000751301 [0,2,0,0,0,0|2,0,0]=4 11739 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)I 1626a_100000225621_100000751301 [0,2,0,0,0,0|2,0,0]=4 11740 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)I 240690a_100000225621_100000751301 [0,2,0,0,0,0|2,0,0]=4 11741 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)I 527a_100000225621_100000751301 [0,2,0,0,0,0|2,0,0]=4 11742 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)O 240690a_100000225621_100000702456 [0,2,0,0,0,0|2,0,0]=4 11743 B14R1.2819 CCN(C)C(=O)c1ccc(cc1Cl)O 527a_100000225621_100000702456 [0,2,0,0,0,0|2,0,0]=4 11744 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)Br 11a_100000225621_100000214689 [0,2,0,0,0,0|2,0,0]=4 11745 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)Br 1626a_100000225621_100000214689 [0,2,0,0,0,0|2,0,0]=4 11746 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)Br 240690a_100000225621_100000214689 [0,2,0,0,0,0|2,0,0]=4 11747 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)Br 527a_100000225621_100000214689 [0,2,0,0,0,0|2,0,0]=4 11748 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)C 11a_100000225621_100000766033 [0,2,0,0,0,0|2,0,0]=4 11749 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)C 1626a_100000225621_100000766033 [0,2,0,0,0,0|2,0,0]=4 11750 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)C 240690a_100000225621_100000766033 [0,2,0,0,0,0|2,0,0]=4 11751 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)C 527a_100000225621_100000766033 [0,2,0,0,0,0|2,0,0]=4 11752 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)Cl 11a_100000225621_100000212326 [0,2,0,0,0,0|2,0,0]=4 11753 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)Cl 1626a_100000225621_100000212326 [0,2,0,0,0,0|2,0,0]=4 11754 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)Cl 240690a_100000225621_100000212326 [0,2,0,0,0,0|2,0,0]=4 11755 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)Cl 527a_100000225621_100000212326 [0,2,0,0,0,0|2,0,0]=4 11756 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)F 11a_100000225621_100000211022 [0,2,0,0,0,0|2,0,0]=4 11757 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)F 1626a_100000225621_100000211022 [0,2,0,0,0,0|2,0,0]=4 11758 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)F 240690a_100000225621_100000211022 [0,2,0,0,0,0|2,0,0]=4 11759 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)F 527a_100000225621_100000211022 [0,2,0,0,0,0|2,0,0]=4 11760 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)I 11a_100000225621_100000037189 [0,2,0,0,0,0|2,0,0]=4 11761 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)I 1626a_100000225621_100000037189 [0,2,0,0,0,0|2,0,0]=4 11762 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)I 240690a_100000225621_100000037189 [0,2,0,0,0,0|2,0,0]=4 11763 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)I 527a_100000225621_100000037189 [0,2,0,0,0,0|2,0,0]=4 11764 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)O 240690a_100000225621_100000689029 [0,2,0,0,0,0|2,0,0]=4 11765 B14R1.2819 CCN(C)C(=O)c1ccc(cc1F)O 527a_100000225621_100000689029 [0,2,0,0,0,0|2,0,0]=4 11766 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)Br 11a_100000225621_100000751167 [0,2,0,0,0,0|2,0,0]=4 11767 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)Br 1626a_100000225621_100000751167 [0,2,0,0,0,0|2,0,0]=4 11768 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)Br 240690a_100000225621_100000751167 [0,2,0,0,0,0|2,0,0]=4 11769 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)Br 527a_100000225621_100000751167 [0,2,0,0,0,0|2,0,0]=4 11770 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)C 11a_100000225621_100009999607 [0,2,0,0,0,0|2,0,0]=4 11771 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)C 1626a_100000225621_100009999607 [0,2,0,0,0,0|2,0,0]=4 11772 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)C 240690a_100000225621_100009999607 [0,2,0,0,0,0|2,0,0]=4 11773 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)C 527a_100000225621_100009999607 [0,2,0,0,0,0|2,0,0]=4 11774 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)Cl 11a_100000225621_100000739380 [0,2,0,0,0,0|2,0,0]=4 11775 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)Cl 1626a_100000225621_100000739380 [0,2,0,0,0,0|2,0,0]=4 11776 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)Cl 240690a_100000225621_100000739380 [0,2,0,0,0,0|2,0,0]=4 11777 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)Cl 527a_100000225621_100000739380 [0,2,0,0,0,0|2,0,0]=4 11778 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)F 11a_100000225621_100000739341 [0,2,0,0,0,0|2,0,0]=4 11779 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)F 1626a_100000225621_100000739341 [0,2,0,0,0,0|2,0,0]=4 11780 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)F 240690a_100000225621_100000739341 [0,2,0,0,0,0|2,0,0]=4 11781 B14R1.2819 CCN(C)C(=O)c1ccc(cc1I)F 527a_100000225621_100000739341 [0,2,0,0,0,0|2,0,0]=4 11782 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)Br 240690a_100000225621_100000744433 [0,2,0,0,0,0|1,0,0]=3 11783 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)Br 527a_100000225621_100000744433 [0,2,0,0,0,0|1,0,0]=3 11784 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)C 1626a_100000225621_100000212137 [0,2,0,0,0,0|1,0,0]=3 11785 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)C 240690a_100000225621_100000212137 [0,2,0,0,0,0|1,0,0]=3 11786 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)C 527a_100000225621_100000212137 [0,2,0,0,0,0|1,0,0]=3 11787 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)Cl 11a_100000225621_100000188622 [0,2,0,0,0,0|1,0,0]=3 11788 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)Cl 240690a_100000225621_100000188622 [0,2,0,0,0,0|1,0,0]=3 11789 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)Cl 527a_100000225621_100000188622 [0,2,0,0,0,0|1,0,0]=3 11790 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)F 240690a_100000225621_100000746061 [0,2,0,0,0,0|1,0,0]=3 11791 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)F 527a_100000225621_100000746061 [0,2,0,0,0,0|1,0,0]=3 11792 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)I 240690a_100000225621_100000091984 [0,2,0,0,0,0|1,0,0]=3 11793 B14R1.2819 CCN(C)C(=O)c1ccc(cc1O)I 527a_100000225621_100000091984 [0,2,0,0,0,0|1,0,0]=3 11794 B14R1.3624 CCC(CC)C(=O)c1ccccc1Br 1458a_100000188424_100000210505 [0,2,0,0,0,0|2,0,0]=4 11795 B14R1.3624 CCC(CC)C(=O)c1ccccc1C 1458a_100000212026_100000210505 [0,2,0,0,0,0|2,0,0]=4 11796 B14R1.3624 CCC(CC)C(=O)c1ccccc1Cl 1458a_100000185844_100000210505 [0,2,0,0,0,0|2,0,0]=4 11797 B14R1.3624 CCC(CC)C(=O)c1ccccc1F 1458a_100000188656_100000210505 [0,2,0,0,0,0|2,0,0]=4 11798 B14R1.3624 CCC(CC)C(=O)c1ccccc1I 1458a_100000187884_100000210505 [0,2,0,0,0,0|2,0,0]=4 11799 B14R1.3624 CCC(CC)C(=O)c1ccccc1O 1458a_100015234032_100000210505 [0,2,0,0,0,0|1,0,0]=3 11800 B14R1.3624 CCC(CC)C(=O)c1ccccc1[O-] 1458a_100009911694_100000210505 [0,2,0,0,0,0|1,0,1]=4 11801 B14R1.3624 CCN(CC)C(=O)c1ccccc1Br 11a_100000724800_100000188424 [0,2,0,0,0,0|2,0,0]=4 11802 B14R1.3624 CCN(CC)C(=O)c1ccccc1Br 1626a_100000724800_100000188424 [0,2,0,0,0,0|2,0,0]=4 11803 B14R1.3624 CCN(CC)C(=O)c1ccccc1Br 240690a_100000724800_100000188424 [0,2,0,0,0,0|2,0,0]=4 11804 B14R1.3624 CCN(CC)C(=O)c1ccccc1Br 527a_100000724800_100000188424 [0,2,0,0,0,0|2,0,0]=4 11805 B14R1.3624 CCN(CC)C(=O)c1ccccc1C 11a_100000724800_100000212026 [0,2,0,0,0,0|2,0,0]=4 11806 B14R1.3624 CCN(CC)C(=O)c1ccccc1C 1626a_100000724800_100000212026 [0,2,0,0,0,0|2,0,0]=4 11807 B14R1.3624 CCN(CC)C(=O)c1ccccc1C 240690a_100000724800_100000212026 [0,2,0,0,0,0|2,0,0]=4 11808 B14R1.3624 CCN(CC)C(=O)c1ccccc1C 527a_100000724800_100000212026 [0,2,0,0,0,0|2,0,0]=4 11809 B14R1.3624 CCN(CC)C(=O)c1ccccc1Cl 11a_100000724800_100000185844 [0,2,0,0,0,0|2,0,0]=4 11810 B14R1.3624 CCN(CC)C(=O)c1ccccc1Cl 1626a_100000724800_100000185844 [0,2,0,0,0,0|2,0,0]=4 11811 B14R1.3624 CCN(CC)C(=O)c1ccccc1Cl 240690a_100000724800_100000185844 [0,2,0,0,0,0|2,0,0]=4 11812 B14R1.3624 CCN(CC)C(=O)c1ccccc1Cl 527a_100000724800_100000185844 [0,2,0,0,0,0|2,0,0]=4 11813 B14R1.3624 CCN(CC)C(=O)c1ccccc1F 11a_100000724800_100000188656 [0,2,0,0,0,0|2,0,0]=4 11814 B14R1.3624 CCN(CC)C(=O)c1ccccc1F 1626a_100000724800_100000188656 [0,2,0,0,0,0|2,0,0]=4 11815 B14R1.3624 CCN(CC)C(=O)c1ccccc1F 240690a_100000724800_100000188656 [0,2,0,0,0,0|2,0,0]=4 11816 B14R1.3624 CCN(CC)C(=O)c1ccccc1F 527a_100000724800_100000188656 [0,2,0,0,0,0|2,0,0]=4 11817 B14R1.3624 CCN(CC)C(=O)c1ccccc1I 11a_100000724800_100000187884 [0,2,0,0,0,0|2,0,0]=4 11818 B14R1.3624 CCN(CC)C(=O)c1ccccc1I 1626a_100000724800_100000187884 [0,2,0,0,0,0|2,0,0]=4 11819 B14R1.3624 CCN(CC)C(=O)c1ccccc1I 240690a_100000724800_100000187884 [0,2,0,0,0,0|2,0,0]=4 11820 B14R1.3624 CCN(CC)C(=O)c1ccccc1I 527a_100000724800_100000187884 [0,2,0,0,0,0|2,0,0]=4 11821 B14R1.3624 CCN(CC)C(=O)c1ccccc1O 240690a_100000724800_100015234032 [0,2,0,0,0,0|1,0,0]=3 11822 B14R1.3624 CCN(CC)C(=O)c1ccccc1O 271570a_203496583355_200000154170 [0,2,0,0,0,0|1,0,0]=3 11823 B14R1.3624 CCN(CC)C(=O)c1ccccc1[O-] 1626a_100000724800_100009911694 [0,2,0,0,0,0|1,0,1]=4 11824 B14R1.3624 CCN(CC)C(=O)c1ccccc1[O-] 240690a_100000724800_100009911694 [0,2,0,0,0,0|1,0,1]=4 11825 B14R1.3624 CCN(CC)C(=O)c1ccccc1[O-] 527a_100000724800_100009911694 [0,2,0,0,0,0|1,0,1]=4 11826 B14R1.8657 CCC(C)C(=O)c1c(cccc1Br)Br 1458a_100000690891_100000758301 [0,2,0,0,0,0|2,0,0]=4 11827 B14R1.8657 CCC(C)C(=O)c1c(cccc1Br)C 1458a_100000701904_100000758301 [0,2,0,0,0,0|2,0,0]=4 11828 B14R1.8657 CCC(C)C(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000758301 [0,2,0,0,0,0|2,0,0]=4 11829 B14R1.8657 CCC(C)C(=O)c1c(cccc1Br)F 1458a_100000752694_100000758301 [0,2,0,0,0,0|2,0,0]=4 11830 B14R1.8657 CCC(C)C(=O)c1c(cccc1Br)O 1458a_100011935254_100000758301 [0,2,0,0,0,0|1,0,0]=3 11831 B14R1.8657 CCC(C)C(=O)c1c(cccc1C)C 1458a_100000758298_100000758301 [0,2,0,0,0,0|2,0,0]=4 11832 B14R1.8657 CCC(C)C(=O)c1c(cccc1Cl)C 1458a_100000692601_100000758301 [0,2,0,0,0,0|2,0,0]=4 11833 B14R1.8657 CCC(C)C(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000758301 [0,2,0,0,0,0|2,0,0]=4 11834 B14R1.8657 CCC(C)C(=O)c1c(cccc1Cl)F 1458a_100000210369_100000758301 [0,2,0,0,0,0|2,0,0]=4 11835 B14R1.8657 CCC(C)C(=O)c1c(cccc1Cl)O 1458a_100000745519_100000758301 [0,2,0,0,0,0|1,0,0]=3 11836 B14R1.8657 CCC(C)C(=O)c1c(cccc1F)C 1458a_100000762013_100000758301 [0,2,0,0,0,0|2,0,0]=4 11837 B14R1.8657 CCC(C)C(=O)c1c(cccc1F)F 1458a_100000210804_100000758301 [0,2,0,0,0,0|2,0,0]=4 11838 B14R1.8657 CCC(C)C(=O)c1c(cccc1F)O 1458a_100000763259_100000758301 [0,2,0,0,0,0|1,0,0]=3 11839 B14R1.8657 CCC(C)C(=O)c1c(cccc1I)Br 1458a_100010232521_100000758301 [0,2,0,0,0,0|2,0,0]=4 11840 B14R1.8657 CCC(C)C(=O)c1c(cccc1I)C 1458a_100000688020_100000758301 [0,2,0,0,0,0|2,0,0]=4 11841 B14R1.8657 CCC(C)C(=O)c1c(cccc1I)Cl 1458a_100000702859_100000758301 [0,2,0,0,0,0|2,0,0]=4 11842 B14R1.8657 CCC(C)C(=O)c1c(cccc1I)F 1458a_100000023732_100000758301 [0,2,0,0,0,0|2,0,0]=4 11843 B14R1.8657 CCC(C)C(=O)c1c(cccc1O)C 1458a_100011934116_100000758301 [0,2,0,0,0,0|1,0,0]=3 11844 B14R1.8657 CCC(C)C(=O)c1c(cccc1O)O 1458a_100000755285_100000758301 [0,2,0,0,0,0|1,0,0]=3 11845 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)Br 11a_100000225621_100000690891 [0,2,0,0,0,0|2,0,0]=4 11846 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)Br 1626a_100000225621_100000690891 [0,2,0,0,0,0|2,0,0]=4 11847 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)Br 240690a_100000225621_100000690891 [0,2,0,0,0,0|2,0,0]=4 11848 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)Br 527a_100000225621_100000690891 [0,2,0,0,0,0|2,0,0]=4 11849 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)C 11a_100000225621_100000701904 [0,2,0,0,0,0|2,0,0]=4 11850 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)C 1626a_100000225621_100000701904 [0,2,0,0,0,0|2,0,0]=4 11851 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)C 240690a_100000225621_100000701904 [0,2,0,0,0,0|2,0,0]=4 11852 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)C 527a_100000225621_100000701904 [0,2,0,0,0,0|2,0,0]=4 11853 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)Cl 11a_100000225621_100011253703 [0,2,0,0,0,0|2,0,0]=4 11854 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)Cl 1626a_100000225621_100011253703 [0,2,0,0,0,0|2,0,0]=4 11855 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)Cl 240690a_100000225621_100011253703 [0,2,0,0,0,0|2,0,0]=4 11856 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)Cl 527a_100000225621_100011253703 [0,2,0,0,0,0|2,0,0]=4 11857 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)F 11a_100000225621_100000752694 [0,2,0,0,0,0|2,0,0]=4 11858 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)F 1626a_100000225621_100000752694 [0,2,0,0,0,0|2,0,0]=4 11859 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)F 240690a_100000225621_100000752694 [0,2,0,0,0,0|2,0,0]=4 11860 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)F 527a_100000225621_100000752694 [0,2,0,0,0,0|2,0,0]=4 11861 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)O 240690a_100000225621_100011935254 [0,2,0,0,0,0|1,0,0]=3 11862 B14R1.8657 CCN(C)C(=O)c1c(cccc1Br)O 527a_100000225621_100011935254 [0,2,0,0,0,0|1,0,0]=3 11863 B14R1.8657 CCN(C)C(=O)c1c(cccc1C)C 11a_100000225621_100000758298 [0,2,0,0,0,0|2,0,0]=4 11864 B14R1.8657 CCN(C)C(=O)c1c(cccc1C)C 1626a_100000225621_100000758298 [0,2,0,0,0,0|2,0,0]=4 11865 B14R1.8657 CCN(C)C(=O)c1c(cccc1C)C 240690a_100000225621_100000758298 [0,2,0,0,0,0|2,0,0]=4 11866 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)C 11a_100000225621_100000692601 [0,2,0,0,0,0|2,0,0]=4 11867 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)C 1626a_100000225621_100000692601 [0,2,0,0,0,0|2,0,0]=4 11868 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)C 240690a_100000225621_100000692601 [0,2,0,0,0,0|2,0,0]=4 11869 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)Cl 11a_100000225621_100000210656 [0,2,0,0,0,0|2,0,0]=4 11870 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)Cl 1626a_100000225621_100000210656 [0,2,0,0,0,0|2,0,0]=4 11871 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)Cl 240690a_100000225621_100000210656 [0,2,0,0,0,0|2,0,0]=4 11872 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)F 11a_100000225621_100000210369 [0,2,0,0,0,0|2,0,0]=4 11873 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)F 1626a_100000225621_100000210369 [0,2,0,0,0,0|2,0,0]=4 11874 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)F 240690a_100000225621_100000210369 [0,2,0,0,0,0|2,0,0]=4 11875 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)F 527a_100000225621_100000210369 [0,2,0,0,0,0|2,0,0]=4 11876 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)O 240690a_100000225621_100000745519 [0,2,0,0,0,0|1,0,0]=3 11877 B14R1.8657 CCN(C)C(=O)c1c(cccc1Cl)O 527a_100000225621_100000745519 [0,2,0,0,0,0|1,0,0]=3 11878 B14R1.8657 CCN(C)C(=O)c1c(cccc1F)C 11a_100000225621_100000762013 [0,2,0,0,0,0|2,0,0]=4 11879 B14R1.8657 CCN(C)C(=O)c1c(cccc1F)C 1626a_100000225621_100000762013 [0,2,0,0,0,0|2,0,0]=4 11880 B14R1.8657 CCN(C)C(=O)c1c(cccc1F)C 240690a_100000225621_100000762013 [0,2,0,0,0,0|2,0,0]=4 11881 B14R1.8657 CCN(C)C(=O)c1c(cccc1F)C 527a_100000225621_100000762013 [0,2,0,0,0,0|2,0,0]=4 11882 B14R1.8657 CCN(C)C(=O)c1c(cccc1F)F 11a_100000225621_100000210804 [0,2,0,0,0,0|2,0,0]=4 11883 B14R1.8657 CCN(C)C(=O)c1c(cccc1F)F 1626a_100000225621_100000210804 [0,2,0,0,0,0|2,0,0]=4 11884 B14R1.8657 CCN(C)C(=O)c1c(cccc1F)F 240690a_100000225621_100000210804 [0,2,0,0,0,0|2,0,0]=4 11885 B14R1.8657 CCN(C)C(=O)c1c(cccc1F)F 527a_100000225621_100000210804 [0,2,0,0,0,0|2,0,0]=4 11886 B14R1.8657 CCN(C)C(=O)c1c(cccc1F)O 527a_100000225621_100000763259 [0,2,0,0,0,0|1,0,0]=3 11887 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)Br 11a_100000225621_100010232521 [0,2,0,0,0,0|2,0,0]=4 11888 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)Br 1626a_100000225621_100010232521 [0,2,0,0,0,0|2,0,0]=4 11889 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)Br 240690a_100000225621_100010232521 [0,2,0,0,0,0|2,0,0]=4 11890 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)Br 527a_100000225621_100010232521 [0,2,0,0,0,0|2,0,0]=4 11891 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)C 11a_100000225621_100000688020 [0,2,0,0,0,0|2,0,0]=4 11892 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)C 1626a_100000225621_100000688020 [0,2,0,0,0,0|2,0,0]=4 11893 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)C 240690a_100000225621_100000688020 [0,2,0,0,0,0|2,0,0]=4 11894 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)Cl 11a_100000225621_100000702859 [0,2,0,0,0,0|2,0,0]=4 11895 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)Cl 1626a_100000225621_100000702859 [0,2,0,0,0,0|2,0,0]=4 11896 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)Cl 240690a_100000225621_100000702859 [0,2,0,0,0,0|2,0,0]=4 11897 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)Cl 527a_100000225621_100000702859 [0,2,0,0,0,0|2,0,0]=4 11898 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)F 11a_100000225621_100000023732 [0,2,0,0,0,0|2,0,0]=4 11899 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)F 1626a_100000225621_100000023732 [0,2,0,0,0,0|2,0,0]=4 11900 B14R1.8657 CCN(C)C(=O)c1c(cccc1I)F 240690a_100000225621_100000023732 [0,2,0,0,0,0|2,0,0]=4 11901 B14R1.8657 CCN(C)C(=O)c1c(cccc1O)O 527a_100000225621_100000755285 [0,2,0,0,0,0|1,0,0]=3 11902 B14R1.8657 CON(C)C(=O)c1c(cccc1F)O 271570a_203496583355_200012642770 [0,2,0,0,0,0|2,0,0]=4 11903 B14R1.7234 C#Cc1ccc(c(c1)Cl)C(=O)CCC 1458a_100103168756_100000210303 [0,2,0,0,0,0|2,0,0]=4 11904 B14R1.7234 C#Cc1ccc(c(c1)Cl)C(=O)NCC 11a_100015525214_100103168756 [0,2,0,0,0,0|2,0,0]=4 11905 B14R1.7234 C#Cc1ccc(c(c1)Cl)C(=O)NCC 240690a_100015525214_100103168756 [0,2,0,0,0,0|2,0,0]=4 11906 B14R1.7234 C#Cc1ccc(c(c1)Cl)C(=O)NCC 527a_100015525214_100103168756 [0,2,0,0,0,0|2,0,0]=4 11907 B14R1.7234 C=Cc1ccc(c(c1)C)C(=O)OCC 271570a_100011290941_100011327926 [0,2,0,0,0,0|1,0,0]=3 11908 B14R1.7234 C=Cc1ccc(c(c1)Cl)C(=O)OCC 271570a_100011290941_100000060723 [0,2,0,0,0,0|1,0,0]=3 11909 B14R1.7234 C=Cc1ccc(c(c1)F)C(=O)CCC 271570a_100011290941_100012345046 [0,2,0,0,0,0|2,0,0]=4 11910 B14R1.7234 C=Cc1ccc(c(c1)F)C(=O)NCC 271570a_100011290941_200000215476 [0,2,0,0,0,0|2,0,0]=4 11911 B14R1.7234 C=Cc1ccc(c(c1)F)C(=O)OCC 271570a_100011290941_100010244673 [0,2,0,0,0,0|1,0,0]=3 11912 B14R1.7234 C=Cc1ccc(c(n1)C)C(=O)OCC 271570a_100011290941_100000106303 [0,2,0,0,0,0|2,0,0]=4 11913 B14R1.7234 C=Cc1cnc(c(c1)C)C(=O)OCC 271570a_100011290941_100010201522 [0,2,0,0,0,0|2,0,0]=4 11914 B14R1.7234 C=Cc1cnc(c(c1)N)C(=O)OCC 271570a_100011290941_100010230144 [0,2,0,0,0,0|2,0,0]=4 11915 B14R1.7234 C=Cc1cnc(c(c1)O)C(=O)OCC 271570a_100011290941_100016103240 [0,2,0,0,0,0|1,0,0]=3 11916 B14R1.7234 CCCC(=O)c1ccc(cc1Br)C#N 1458a_100010244945_100000210303 [0,2,0,0,0,0|2,0,0]=4 11917 B14R1.7234 CCCC(=O)c1ccc(cc1Br)OC 1458a_100000748873_100000210303 [0,2,0,0,0,0|2,0,0]=4 11918 B14R1.7234 CCCC(=O)c1ccc(cc1C)C#N 1458a_100000691869_100000210303 [0,2,0,0,0,0|2,0,0]=4 11919 B14R1.7234 CCCC(=O)c1ccc(cc1C)OC 1458a_100000763155_100000210303 [0,2,0,0,0,0|2,0,0]=4 11920 B14R1.7234 CCCC(=O)c1ccc(cc1C)SC 1458a_100012278374_100000210303 [0,2,0,0,0,0|2,0,0]=4 11921 B14R1.7234 CCCC(=O)c1ccc(cc1Cl)C#N 1458a_100000100588_100000210303 [0,2,0,0,0,0|2,0,0]=4 11922 B14R1.7234 CCCC(=O)c1ccc(cc1Cl)CO 1458a_100015659073_100000210303 [0,2,0,0,0,0|2,0,0]=4 11923 B14R1.7234 CCCC(=O)c1ccc(cc1Cl)OC 1458a_100000753557_100000210303 [0,2,0,0,0,0|2,0,0]=4 11924 B14R1.7234 CCCC(=O)c1ccc(cc1F)C#N 1458a_100000238375_100000210303 [0,2,0,0,0,0|2,0,0]=4 11925 B14R1.7234 CCCC(=O)c1ccc(cc1F)CC 1458a_200009867912_100000210303 [0,2,0,0,0,0|2,0,0]=4 11926 B14R1.7234 CCCC(=O)c1ccc(cc1F)CO 1458a_100011934814_100000210303 [0,2,0,0,0,0|2,0,0]=4 11927 B14R1.7234 CCCC(=O)c1ccc(cc1F)NC 27a_100102657272_100012345046 [0,2,0,0,0,0|2,0,0]=4 11928 B14R1.7234 CCCC(=O)c1ccc(cc1F)OC 1458a_100000198494_100000210303 [0,2,0,0,0,0|2,0,0]=4 11929 B14R1.7234 CCCC(=O)c1ccc(cc1F)SC 62a_100012345046_200000210301 [0,2,0,0,0,0|2,0,0]=4 11930 B14R1.7234 CCCC(=O)c1ccc(cc1F)SC 62a_200000210301_100012345046 [0,2,0,0,0,0|2,0,0]=4 11931 B14R1.7234 CCCC(=O)c1ccc(cc1F)S[13CH3] 62a_100012345046_200025704644 [0,2,0,0,0,0|2,0,0]=4 11932 B14R1.7234 CCCC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_100012345046 [0,2,0,0,0,0|2,0,0]=4 11933 B14R1.7234 CCCC(=O)c1ccc(cc1I)OC 1458a_100000688016_100000210303 [0,2,0,0,0,0|2,0,0]=4 11934 B14R1.7234 CCCC(=O)c1ccc(cc1O)OC 1458a_100000212123_100000210303 [0,2,0,0,0,0|1,0,0]=3 11935 B14R1.7234 CCNC(=O)c1ccc(cc1Br)C#N 11a_100015525214_100010244945 [0,2,0,0,0,0|2,0,0]=4 11936 B14R1.7234 CCNC(=O)c1ccc(cc1Br)C#N 240690a_100015525214_100010244945 [0,2,0,0,0,0|2,0,0]=4 11937 B14R1.7234 CCNC(=O)c1ccc(cc1Br)C#N 527a_100015525214_100010244945 [0,2,0,0,0,0|2,0,0]=4 11938 B14R1.7234 CCNC(=O)c1ccc(cc1Br)OC 11a_100015525214_100000748873 [0,2,0,0,0,0|2,0,0]=4 11939 B14R1.7234 CCNC(=O)c1ccc(cc1Br)OC 240690a_100015525214_100000748873 [0,2,0,0,0,0|2,0,0]=4 11940 B14R1.7234 CCNC(=O)c1ccc(cc1Br)OC 527a_100015525214_100000748873 [0,2,0,0,0,0|2,0,0]=4 11941 B14R1.7234 CCNC(=O)c1ccc(cc1C)C#N 11a_100015525214_100000691869 [0,2,0,0,0,0|2,0,0]=4 11942 B14R1.7234 CCNC(=O)c1ccc(cc1C)C#N 240690a_100015525214_100000691869 [0,2,0,0,0,0|2,0,0]=4 11943 B14R1.7234 CCNC(=O)c1ccc(cc1C)C#N 527a_100015525214_100000691869 [0,2,0,0,0,0|2,0,0]=4 11944 B14R1.7234 CCNC(=O)c1ccc(cc1C)OC 11a_100015525214_100000763155 [0,2,0,0,0,0|2,0,0]=4 11945 B14R1.7234 CCNC(=O)c1ccc(cc1C)OC 240690a_100015525214_100000763155 [0,2,0,0,0,0|2,0,0]=4 11946 B14R1.7234 CCNC(=O)c1ccc(cc1C)OC 527a_100015525214_100000763155 [0,2,0,0,0,0|2,0,0]=4 11947 B14R1.7234 CCNC(=O)c1ccc(cc1C)SC 11a_100015525214_100012278374 [0,2,0,0,0,0|2,0,0]=4 11948 B14R1.7234 CCNC(=O)c1ccc(cc1C)SC 240690a_100015525214_100012278374 [0,2,0,0,0,0|2,0,0]=4 11949 B14R1.7234 CCNC(=O)c1ccc(cc1C)SC 527a_100015525214_100012278374 [0,2,0,0,0,0|2,0,0]=4 11950 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)C#N 11a_100015525214_100000100588 [0,2,0,0,0,0|2,0,0]=4 11951 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)C#N 240690a_100015525214_100000100588 [0,2,0,0,0,0|2,0,0]=4 11952 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)C#N 527a_100015525214_100000100588 [0,2,0,0,0,0|2,0,0]=4 11953 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)CO 240690a_100015525214_100015659073 [0,2,0,0,0,0|2,0,0]=4 11954 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)NC 34a_200015185234_200000210301 [0,2,0,0,0,0|2,0,0]=4 11955 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)NC 7a_200015185234_200000210301 [0,2,0,0,0,0|2,0,0]=4 11956 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)N[13CH3] 34a_200015185234_200025704644 [0,2,0,0,0,0|2,0,0]=4 11957 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)N[13CH3] 7a_200015185234_200025704644 [0,2,0,0,0,0|2,0,0]=4 11958 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)OC 11a_100015525214_100000753557 [0,2,0,0,0,0|2,0,0]=4 11959 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)OC 240690a_100015525214_100000753557 [0,2,0,0,0,0|2,0,0]=4 11960 B14R1.7234 CCNC(=O)c1ccc(cc1Cl)OC 527a_100015525214_100000753557 [0,2,0,0,0,0|2,0,0]=4 11961 B14R1.7234 CCNC(=O)c1ccc(cc1F)C#N 11a_100015525214_100000238375 [0,2,0,0,0,0|2,0,0]=4 11962 B14R1.7234 CCNC(=O)c1ccc(cc1F)C#N 240690a_100015525214_100000238375 [0,2,0,0,0,0|2,0,0]=4 11963 B14R1.7234 CCNC(=O)c1ccc(cc1F)C#N 527a_100015525214_100000238375 [0,2,0,0,0,0|2,0,0]=4 11964 B14R1.7234 CCNC(=O)c1ccc(cc1F)CC 11a_100015525214_200009867912 [0,2,0,0,0,0|2,0,0]=4 11965 B14R1.7234 CCNC(=O)c1ccc(cc1F)CC 240690a_100015525214_200009867912 [0,2,0,0,0,0|2,0,0]=4 11966 B14R1.7234 CCNC(=O)c1ccc(cc1F)CC 527a_100015525214_200009867912 [0,2,0,0,0,0|2,0,0]=4 11967 B14R1.7234 CCNC(=O)c1ccc(cc1F)CO 240690a_100015525214_100011934814 [0,2,0,0,0,0|2,0,0]=4 11968 B14R1.7234 CCNC(=O)c1ccc(cc1F)NC 27a_100102657272_200000215476 [0,2,0,0,0,0|2,0,0]=4 11969 B14R1.7234 CCNC(=O)c1ccc(cc1F)OC 11a_100015525214_100000198494 [0,2,0,0,0,0|2,0,0]=4 11970 B14R1.7234 CCNC(=O)c1ccc(cc1F)OC 240690a_100015525214_100000198494 [0,2,0,0,0,0|2,0,0]=4 11971 B14R1.7234 CCNC(=O)c1ccc(cc1F)OC 527a_100015525214_100000198494 [0,2,0,0,0,0|2,0,0]=4 11972 B14R1.7234 CCNC(=O)c1ccc(cc1F)SC 62a_200000210301_200000215476 [0,2,0,0,0,0|2,0,0]=4 11973 B14R1.7234 CCNC(=O)c1ccc(cc1F)SC 62a_200000215476_200000210301 [0,2,0,0,0,0|2,0,0]=4 11974 B14R1.7234 CCNC(=O)c1ccc(cc1F)S[13CH3] 62a_200000215476_200025704644 [0,2,0,0,0,0|2,0,0]=4 11975 B14R1.7234 CCNC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_200000215476 [0,2,0,0,0,0|2,0,0]=4 11976 B14R1.7234 CCNC(=O)c1ccc(cc1I)OC 11a_100015525214_100000688016 [0,2,0,0,0,0|2,0,0]=4 11977 B14R1.7234 CCNC(=O)c1ccc(cc1I)OC 240690a_100015525214_100000688016 [0,2,0,0,0,0|2,0,0]=4 11978 B14R1.7234 CCNC(=O)c1ccc(cc1I)OC 527a_100015525214_100000688016 [0,2,0,0,0,0|2,0,0]=4 11979 B14R1.7234 CCNC(=O)c1ccc(cc1O)OC 11a_100015525214_100000212123 [0,2,0,0,0,0|1,0,0]=3 11980 B14R1.7234 CCNC(=O)c1ccc(cc1O)OC 240690a_100015525214_100000212123 [0,2,0,0,0,0|1,0,0]=3 11981 B14R1.7234 CCNC(=O)c1ccc(cc1O)OC 527a_100015525214_100000212123 [0,2,0,0,0,0|1,0,0]=3 11982 B14R1.7234 CCOC(=O)c1ccc(cc1C)OC 7a_100012184494_200000210301 [0,2,0,0,0,0|1,0,0]=3 11983 B14R1.7234 CCOC(=O)c1ccc(cc1C)O[13CH3] 7a_100012184494_200025704644 [0,2,0,0,0,0|1,0,0]=3 11984 B14R1.7234 CCOC(=O)c1ccc(cc1C)SC 62a_100011327926_200000210301 [0,2,0,0,0,0|1,0,0]=3 11985 B14R1.7234 CCOC(=O)c1ccc(cc1C)SC 62a_200000210301_100011327926 [0,2,0,0,0,0|1,0,0]=3 11986 B14R1.7234 CCOC(=O)c1ccc(cc1C)S[13CH3] 62a_100011327926_200025704644 [0,2,0,0,0,0|1,0,0]=3 11987 B14R1.7234 CCOC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_100011327926 [0,2,0,0,0,0|1,0,0]=3 11988 B14R1.7234 CCOC(=O)c1ccc(cc1Cl)SC 62a_100000060723_200000210301 [0,2,0,0,0,0|1,0,0]=3 11989 B14R1.7234 CCOC(=O)c1ccc(cc1Cl)SC 62a_200000210301_100000060723 [0,2,0,0,0,0|1,0,0]=3 11990 B14R1.7234 CCOC(=O)c1ccc(cc1Cl)S[13CH3] 62a_100000060723_200025704644 [0,2,0,0,0,0|1,0,0]=3 11991 B14R1.7234 CCOC(=O)c1ccc(cc1Cl)S[13CH3] 62a_200025704644_100000060723 [0,2,0,0,0,0|1,0,0]=3 11992 B14R1.7234 CCOC(=O)c1ccc(cc1F)NC 27a_100102657272_100010244673 [0,2,0,0,0,0|1,0,0]=3 11993 B14R1.7234 CCOC(=O)c1ccc(cc1F)SC 62a_100010244673_200000210301 [0,2,0,0,0,0|1,0,0]=3 11994 B14R1.7234 CCOC(=O)c1ccc(cc1F)SC 62a_200000210301_100010244673 [0,2,0,0,0,0|1,0,0]=3 11995 B14R1.7234 CCOC(=O)c1ccc(cc1F)S[13CH3] 62a_100010244673_200025704644 [0,2,0,0,0,0|1,0,0]=3 11996 B14R1.7234 CCOC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_100010244673 [0,2,0,0,0,0|1,0,0]=3 11997 B14R1.7234 CCOC(=O)c1ccc(nc1C)NC 27a_100102657272_100000106303 [0,2,0,0,0,0|2,0,0]=4 11998 B14R1.7234 CCOC(=O)c1ccc(nc1C)SC 62a_100000106303_200000210301 [0,2,0,0,0,0|2,0,0]=4 11999 B14R1.7234 CCOC(=O)c1ccc(nc1C)SC 62a_200000210301_100000106303 [0,2,0,0,0,0|2,0,0]=4 12000 B14R1.7234 CCOC(=O)c1ccc(nc1C)S[13CH3] 62a_100000106303_200025704644 [0,2,0,0,0,0|2,0,0]=4 12001 B14R1.7234 CCOC(=O)c1ccc(nc1C)S[13CH3] 62a_200025704644_100000106303 [0,2,0,0,0,0|2,0,0]=4 12002 B14R1.7234 CCOC(=O)c1cnc(cc1N)NC 27a_100102657272_100009998224 [0,2,0,0,0,0|2,0,0]=4 12003 B14R1.7234 CCOC(=O)c1cnc(cc1N)SC 62a_100009998224_200000210301 [0,2,0,0,0,0|2,0,0]=4 12004 B14R1.7234 CCOC(=O)c1cnc(cc1N)SC 62a_200000210301_100009998224 [0,2,0,0,0,0|2,0,0]=4 12005 B14R1.7234 CCOC(=O)c1cnc(cc1N)S[13CH3] 62a_100009998224_200025704644 [0,2,0,0,0,0|2,0,0]=4 12006 B14R1.7234 CCOC(=O)c1cnc(cc1N)S[13CH3] 62a_200025704644_100009998224 [0,2,0,0,0,0|2,0,0]=4 12007 B14R1.7234 CCOC(=O)c1cnc(nc1O)OC 271570a_203496583355_200010168087 [0,2,0,0,0,0|2,0,0]=4 12008 B14R1.7234 CCOC(=O)c1cnc(nc1O)SC 271570a_203496583355_100011215212 [0,2,0,0,0,0|2,0,0]=4 12009 B14R1.7234 CCOC(=O)c1ncc(cc1C)SC 62a_100010201522_200000210301 [0,2,0,0,0,0|2,0,0]=4 12010 B14R1.7234 CCOC(=O)c1ncc(cc1C)SC 62a_200000210301_100010201522 [0,2,0,0,0,0|2,0,0]=4 12011 B14R1.7234 CCOC(=O)c1ncc(cc1C)S[13CH3] 62a_100010201522_200025704644 [0,2,0,0,0,0|2,0,0]=4 12012 B14R1.7234 CCOC(=O)c1ncc(cc1C)S[13CH3] 62a_200025704644_100010201522 [0,2,0,0,0,0|2,0,0]=4 12013 B14R1.7234 CCOC(=O)c1ncc(cc1N)SC 62a_100010230144_200000210301 [0,2,0,0,0,0|2,0,0]=4 12014 B14R1.7234 CCOC(=O)c1ncc(cc1N)SC 62a_200000210301_100010230144 [0,2,0,0,0,0|2,0,0]=4 12015 B14R1.7234 CCOC(=O)c1ncc(cc1N)S[13CH3] 62a_100010230144_200025704644 [0,2,0,0,0,0|2,0,0]=4 12016 B14R1.7234 CCOC(=O)c1ncc(cc1N)S[13CH3] 62a_200025704644_100010230144 [0,2,0,0,0,0|2,0,0]=4 12017 B14R1.7234 CCOC(=O)c1ncc(cc1O)SC 62a_200000210301_100016103240 [0,2,0,0,0,0|1,0,0]=3 12018 B14R1.7234 CCOC(=O)c1ncc(cc1O)S[13CH3] 62a_200025704644_100016103240 [0,2,0,0,0,0|1,0,0]=3 12019 B14R1.7234 CNNC(=O)c1ccc(cc1O)OC 22a_100016993582_100000212123 [0,2,0,0,0,0|2,0,0]=4 12020 B14R1.7234 COc1ccc(c(c1)O)C(=O)CCF 1458a_100000212123_100011217306 [0,2,0,0,0,0|2,0,0]=4 12021 B14R1.7234 COc1ccc(c(c1)O)C(=O)CCO 1458a_100000212123_100000211926 [0,2,0,0,0,0|2,0,0]=4 12022 B14R1.18811 CCCC(=O)c1c(cc(cc1Br)Br)Br 1458a_100011217931_100000210303 [0,2,0,0,0,0|2,0,0]=4 12023 B14R1.18811 CCCC(=O)c1c(cc(cc1Br)Br)F 1458a_100009813784_100000210303 [0,2,0,0,0,0|2,0,0]=4 12024 B14R1.18811 CCCC(=O)c1c(cc(cc1Br)C)F 1458a_100010768510_100000210303 [0,2,0,0,0,0|2,0,0]=4 12025 B14R1.18811 CCCC(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_100000210303 [0,2,0,0,0,0|2,0,0]=4 12026 B14R1.18811 CCCC(=O)c1c(cc(cc1Br)F)Br 1458a_200015320377_100000210303 [0,2,0,0,0,0|2,0,0]=4 12027 B14R1.18811 CCCC(=O)c1c(cc(cc1Br)F)C 1458a_100010204434_100000210303 [0,2,0,0,0,0|2,0,0]=4 12028 B14R1.18811 CCCC(=O)c1c(cc(cc1Br)F)F 1458a_100013316034_100000210303 [0,2,0,0,0,0|2,0,0]=4 12029 B14R1.18811 CCCC(=O)c1c(cc(cc1C)Br)C 1458a_100000739581_100000210303 [0,2,0,0,0,0|2,0,0]=4 12030 B14R1.18811 CCCC(=O)c1c(cc(cc1C)C)C 1458a_100000211658_100000210303 [0,2,0,0,0,0|2,0,0]=4 12031 B14R1.18811 CCCC(=O)c1c(cc(cc1C)Cl)C 1458a_100000088873_100000210303 [0,2,0,0,0,0|2,0,0]=4 12032 B14R1.18811 CCCC(=O)c1c(cc(cc1C)F)C 1458a_100012017201_100000210303 [0,2,0,0,0,0|2,0,0]=4 12033 B14R1.18811 CCCC(=O)c1c(cc(cc1C)O)C 1458a_100000066486_100000210303 [0,2,0,0,0,0|2,0,0]=4 12034 B14R1.18811 CCCC(=O)c1c(cc(cc1Cl)Br)C 1458a_100000698028_100000210303 [0,2,0,0,0,0|2,0,0]=4 12035 B14R1.18811 CCCC(=O)c1c(cc(cc1Cl)Br)Cl 1458a_100012360385_100000210303 [0,2,0,0,0,0|2,0,0]=4 12036 B14R1.18811 CCCC(=O)c1c(cc(cc1Cl)Br)F 1458a_100010078411_100000210303 [0,2,0,0,0,0|2,0,0]=4 12037 B14R1.18811 CCCC(=O)c1c(cc(cc1Cl)C)Cl 1458a_100009989429_100000210303 [0,2,0,0,0,0|2,0,0]=4 12038 B14R1.18811 CCCC(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_100000210303 [0,2,0,0,0,0|2,0,0]=4 12039 B14R1.18811 CCCC(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_100000210303 [0,2,0,0,0,0|2,0,0]=4 12040 B14R1.18811 CCCC(=O)c1c(cc(cc1Cl)F)Cl 1458a_100000703918_100000210303 [0,2,0,0,0,0|2,0,0]=4 12041 B14R1.18811 CCCC(=O)c1c(cc(cc1Cl)F)F 1458a_100000119028_100000210303 [0,2,0,0,0,0|2,0,0]=4 12042 B14R1.18811 CCCC(=O)c1c(cc(cc1Cl)I)Cl 1458a_100010740244_100000210303 [0,2,0,0,0,0|2,0,0]=4 12043 B14R1.18811 CCCC(=O)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_100000210303 [0,2,0,0,0,0|2,0,0]=4 12044 B14R1.18811 CCCC(=O)c1c(cc(cc1F)Br)C 1458a_100000708665_100000210303 [0,2,0,0,0,0|2,0,0]=4 12045 B14R1.18811 CCCC(=O)c1c(cc(cc1F)Br)F 1458a_100000766946_100000210303 [0,2,0,0,0,0|2,0,0]=4 12046 B14R1.18811 CCCC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_100000210303 [0,2,0,0,0,0|1,0,0]=3 12047 B14R1.18811 CCCC(=O)c1c(cc(cc1F)C)F 1458a_100009878570_100000210303 [0,2,0,0,0,0|2,0,0]=4 12048 B14R1.18811 CCCC(=O)c1c(cc(cc1F)Cl)C 1458a_100010768517_100000210303 [0,2,0,0,0,0|2,0,0]=4 12049 B14R1.18811 CCCC(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_100000210303 [0,2,0,0,0,0|2,0,0]=4 12050 B14R1.18811 CCCC(=O)c1c(cc(cc1F)F)F 1458a_100000751013_100000210303 [0,2,0,0,0,0|2,0,0]=4 12051 B14R1.18811 CCCC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_100000210303 [0,2,0,0,0,0|1,0,0]=3 12052 B14R1.18811 CCCC(=O)c1c(cc(cc1F)O)F 1458a_100000038755_100000210303 [0,2,0,0,0,0|2,0,0]=4 12053 B14R1.18811 CCCC(=O)c1c(cc(cc1I)C)I 1458a_200010371430_100000210303 [0,2,0,0,0,0|2,0,0]=4 12054 B14R1.18811 CCCC(=O)c1c(cc(cc1I)F)C 1458a_200010371433_100000210303 [0,2,0,0,0,0|2,0,0]=4 12055 B14R1.18811 CCCC(=O)c1c(cc(cc1O)C)C 1458a_100011255216_100000210303 [0,2,0,0,0,0|1,0,0]=3 12056 B14R1.18811 CCCC(=O)c1c(cc(cc1O)C)O 1458a_100000036929_100000210303 [0,2,0,0,0,0|1,0,0]=3 12057 B14R1.18811 CCCC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_100000210303 [0,2,0,0,0,0|1,0,0]=3 12058 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)Br)Br 11a_100015525214_100011217931 [0,2,0,0,0,0|2,0,0]=4 12059 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)Br)Br 240690a_100015525214_100011217931 [0,2,0,0,0,0|2,0,0]=4 12060 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)Br)Br 527a_100015525214_100011217931 [0,2,0,0,0,0|2,0,0]=4 12061 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)Br)F 11a_100015525214_100009813784 [0,2,0,0,0,0|2,0,0]=4 12062 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)Br)F 240690a_100015525214_100009813784 [0,2,0,0,0,0|2,0,0]=4 12063 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)Br)F 527a_100015525214_100009813784 [0,2,0,0,0,0|2,0,0]=4 12064 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)C)F 11a_100015525214_100010768510 [0,2,0,0,0,0|2,0,0]=4 12065 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)C)F 240690a_100015525214_100010768510 [0,2,0,0,0,0|2,0,0]=4 12066 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)C)F 527a_100015525214_100010768510 [0,2,0,0,0,0|2,0,0]=4 12067 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)Cl)F 11a_100015525214_100010244364 [0,2,0,0,0,0|2,0,0]=4 12068 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)Cl)F 240690a_100015525214_100010244364 [0,2,0,0,0,0|2,0,0]=4 12069 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)Cl)F 527a_100015525214_100010244364 [0,2,0,0,0,0|2,0,0]=4 12070 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)F)Br 11a_100015525214_200015320377 [0,2,0,0,0,0|2,0,0]=4 12071 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)F)Br 240690a_100015525214_200015320377 [0,2,0,0,0,0|2,0,0]=4 12072 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)F)Br 527a_100015525214_200015320377 [0,2,0,0,0,0|2,0,0]=4 12073 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)F)C 11a_100015525214_100010204434 [0,2,0,0,0,0|2,0,0]=4 12074 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)F)C 240690a_100015525214_100010204434 [0,2,0,0,0,0|2,0,0]=4 12075 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)F)C 527a_100015525214_100010204434 [0,2,0,0,0,0|2,0,0]=4 12076 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)F)F 11a_100015525214_100013316034 [0,2,0,0,0,0|2,0,0]=4 12077 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)F)F 240690a_100015525214_100013316034 [0,2,0,0,0,0|2,0,0]=4 12078 B14R1.18811 CCNC(=O)c1c(cc(cc1Br)F)F 527a_100015525214_100013316034 [0,2,0,0,0,0|2,0,0]=4 12079 B14R1.18811 CCNC(=O)c1c(cc(cc1C)Br)C 11a_100015525214_100000739581 [0,2,0,0,0,0|2,0,0]=4 12080 B14R1.18811 CCNC(=O)c1c(cc(cc1C)Br)C 240690a_100015525214_100000739581 [0,2,0,0,0,0|2,0,0]=4 12081 B14R1.18811 CCNC(=O)c1c(cc(cc1C)C)C 11a_100015525214_100000211658 [0,2,0,0,0,0|2,0,0]=4 12082 B14R1.18811 CCNC(=O)c1c(cc(cc1C)C)C 240690a_100015525214_100000211658 [0,2,0,0,0,0|2,0,0]=4 12083 B14R1.18811 CCNC(=O)c1c(cc(cc1C)Cl)C 11a_100015525214_100000088873 [0,2,0,0,0,0|2,0,0]=4 12084 B14R1.18811 CCNC(=O)c1c(cc(cc1C)Cl)C 240690a_100015525214_100000088873 [0,2,0,0,0,0|2,0,0]=4 12085 B14R1.18811 CCNC(=O)c1c(cc(cc1C)F)C 11a_100015525214_100012017201 [0,2,0,0,0,0|2,0,0]=4 12086 B14R1.18811 CCNC(=O)c1c(cc(cc1C)F)C 240690a_100015525214_100012017201 [0,2,0,0,0,0|2,0,0]=4 12087 B14R1.18811 CCNC(=O)c1c(cc(cc1C)O)C 240690a_100015525214_100000066486 [0,2,0,0,0,0|2,0,0]=4 12088 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Br)C 11a_100015525214_100000698028 [0,2,0,0,0,0|2,0,0]=4 12089 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Br)C 240690a_100015525214_100000698028 [0,2,0,0,0,0|2,0,0]=4 12090 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Br)Cl 11a_100015525214_100012360385 [0,2,0,0,0,0|2,0,0]=4 12091 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Br)Cl 240690a_100015525214_100012360385 [0,2,0,0,0,0|2,0,0]=4 12092 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Br)F 11a_100015525214_100010078411 [0,2,0,0,0,0|2,0,0]=4 12093 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Br)F 240690a_100015525214_100010078411 [0,2,0,0,0,0|2,0,0]=4 12094 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Br)F 527a_100015525214_100010078411 [0,2,0,0,0,0|2,0,0]=4 12095 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)C)Cl 11a_100015525214_100009989429 [0,2,0,0,0,0|2,0,0]=4 12096 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)C)Cl 240690a_100015525214_100009989429 [0,2,0,0,0,0|2,0,0]=4 12097 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)C)Cl 527a_100015525214_100009989429 [0,2,0,0,0,0|2,0,0]=4 12098 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Cl)Cl 11a_100015525214_100011215713 [0,2,0,0,0,0|2,0,0]=4 12099 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Cl)Cl 240690a_100015525214_100011215713 [0,2,0,0,0,0|2,0,0]=4 12100 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Cl)F 11a_100015525214_100010068318 [0,2,0,0,0,0|2,0,0]=4 12101 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Cl)F 240690a_100015525214_100010068318 [0,2,0,0,0,0|2,0,0]=4 12102 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)Cl)F 527a_100015525214_100010068318 [0,2,0,0,0,0|2,0,0]=4 12103 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)F)Cl 11a_100015525214_100000703918 [0,2,0,0,0,0|2,0,0]=4 12104 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)F)Cl 240690a_100015525214_100000703918 [0,2,0,0,0,0|2,0,0]=4 12105 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)F)F 11a_100015525214_100000119028 [0,2,0,0,0,0|2,0,0]=4 12106 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)F)F 240690a_100015525214_100000119028 [0,2,0,0,0,0|2,0,0]=4 12107 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)F)F 527a_100015525214_100000119028 [0,2,0,0,0,0|2,0,0]=4 12108 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)I)Cl 11a_100015525214_100010740244 [0,2,0,0,0,0|2,0,0]=4 12109 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)I)Cl 240690a_100015525214_100010740244 [0,2,0,0,0,0|2,0,0]=4 12110 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)I)Cl 527a_100015525214_100010740244 [0,2,0,0,0,0|2,0,0]=4 12111 B14R1.18811 CCNC(=O)c1c(cc(cc1Cl)O)Cl 240690a_100015525214_100010423397 [0,2,0,0,0,0|2,0,0]=4 12112 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Br)C 11a_100015525214_100000708665 [0,2,0,0,0,0|2,0,0]=4 12113 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Br)C 240690a_100015525214_100000708665 [0,2,0,0,0,0|2,0,0]=4 12114 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Br)C 527a_100015525214_100000708665 [0,2,0,0,0,0|2,0,0]=4 12115 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Br)F 11a_100015525214_100000766946 [0,2,0,0,0,0|2,0,0]=4 12116 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Br)F 240690a_100015525214_100000766946 [0,2,0,0,0,0|2,0,0]=4 12117 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Br)F 527a_100015525214_100000766946 [0,2,0,0,0,0|2,0,0]=4 12118 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Br)O 527a_100015525214_200015963038 [0,2,0,0,0,0|1,0,0]=3 12119 B14R1.18811 CCNC(=O)c1c(cc(cc1F)C)F 11a_100015525214_100009878570 [0,2,0,0,0,0|2,0,0]=4 12120 B14R1.18811 CCNC(=O)c1c(cc(cc1F)C)F 240690a_100015525214_100009878570 [0,2,0,0,0,0|2,0,0]=4 12121 B14R1.18811 CCNC(=O)c1c(cc(cc1F)C)F 527a_100015525214_100009878570 [0,2,0,0,0,0|2,0,0]=4 12122 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Cl)C 11a_100015525214_100010768517 [0,2,0,0,0,0|2,0,0]=4 12123 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Cl)C 240690a_100015525214_100010768517 [0,2,0,0,0,0|2,0,0]=4 12124 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Cl)C 527a_100015525214_100010768517 [0,2,0,0,0,0|2,0,0]=4 12125 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Cl)F 11a_100015525214_100000062413 [0,2,0,0,0,0|2,0,0]=4 12126 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Cl)F 240690a_100015525214_100000062413 [0,2,0,0,0,0|2,0,0]=4 12127 B14R1.18811 CCNC(=O)c1c(cc(cc1F)Cl)F 527a_100015525214_100000062413 [0,2,0,0,0,0|2,0,0]=4 12128 B14R1.18811 CCNC(=O)c1c(cc(cc1F)F)F 11a_100015525214_100000751013 [0,2,0,0,0,0|2,0,0]=4 12129 B14R1.18811 CCNC(=O)c1c(cc(cc1F)F)F 240690a_100015525214_100000751013 [0,2,0,0,0,0|2,0,0]=4 12130 B14R1.18811 CCNC(=O)c1c(cc(cc1F)F)F 527a_100015525214_100000751013 [0,2,0,0,0,0|2,0,0]=4 12131 B14R1.18811 CCNC(=O)c1c(cc(cc1F)F)O 240690a_100015525214_100000746385 [0,2,0,0,0,0|1,0,0]=3 12132 B14R1.18811 CCNC(=O)c1c(cc(cc1F)F)O 527a_100015525214_100000746385 [0,2,0,0,0,0|1,0,0]=3 12133 B14R1.18811 CCNC(=O)c1c(cc(cc1F)O)F 240690a_100015525214_100000038755 [0,2,0,0,0,0|2,0,0]=4 12134 B14R1.18811 CCNC(=O)c1c(cc(cc1F)O)F 527a_100015525214_100000038755 [0,2,0,0,0,0|2,0,0]=4 12135 B14R1.18811 CCNC(=O)c1c(cc(cc1I)C)I 11a_100015525214_200010371430 [0,2,0,0,0,0|2,0,0]=4 12136 B14R1.18811 CCNC(=O)c1c(cc(cc1I)C)I 240690a_100015525214_200010371430 [0,2,0,0,0,0|2,0,0]=4 12137 B14R1.18811 CCNC(=O)c1c(cc(cc1I)C)I 527a_100015525214_200010371430 [0,2,0,0,0,0|2,0,0]=4 12138 B14R1.18811 CCNC(=O)c1c(cc(cc1I)F)C 11a_100015525214_200010371433 [0,2,0,0,0,0|2,0,0]=4 12139 B14R1.18811 CCNC(=O)c1c(cc(cc1I)F)C 240690a_100015525214_200010371433 [0,2,0,0,0,0|2,0,0]=4 12140 B14R1.18811 CCNC(=O)c1c(cc(cc1I)F)C 527a_100015525214_200010371433 [0,2,0,0,0,0|2,0,0]=4 12141 B14R1.18811 CCNC(=O)c1c(cc(cc1O)C)O 527a_100015525214_100000036929 [0,2,0,0,0,0|1,0,0]=3 12142 B14R1.18811 CCNC(=O)c1c(cc(cc1O)O)O 527a_100015525214_100000040092 [0,2,0,0,0,0|1,0,0]=3 12143 B14R1.18811 CCOC(=O)c1c(cc([nH]c1=O)C)O 271570a_203496583355_100010499337 [0,2,0,0,0,0|1,0,0]=3 12144 B14R1.18811 CCOC(=O)c1c(cc(cc1F)O)F 271570a_203496583355_200010164513 [0,2,0,0,0,0|1,0,0]=3 12145 B14R1.18811 CNNC(=O)c1c(cc(cc1F)Br)O 22a_100016993582_200015963038 [0,2,0,0,0,0|2,0,0]=4 12146 B14R1.18811 CNNC(=O)c1c(cc(cc1O)C)C 22a_100016993582_100011255216 [0,2,0,0,0,0|2,0,0]=4 12147 B14R1.18811 Cc1cc(c(c(c1)O)C(=O)CCF)C 1458a_100011255216_100011217306 [0,2,0,0,0,0|2,0,0]=4 12148 B14R1.18811 Cc1cc(c(c(c1)O)C(=O)CCF)O 1458a_100000036929_100011217306 [0,2,0,0,0,0|2,0,0]=4 12149 B14R1.18811 Cc1cc(c(c(c1)O)C(=O)CCO)C 1458a_100011255216_100000211926 [0,2,0,0,0,0|2,0,0]=4 12150 B14R1.18811 Cc1cc(c(c(c1)O)C(=O)CCO)O 1458a_100000036929_100000211926 [0,2,0,0,0,0|2,0,0]=4 12151 B14R1.18811 Cc1cc(cc(c1C(=O)CCF)O)O 1458a_200000061528_100011217306 [0,2,0,0,0,0|2,0,0]=4 12152 B14R1.18811 Cc1cc(cc(c1C(=O)CCO)O)O 1458a_200000061528_100000211926 [0,2,0,0,0,0|2,0,0]=4 12153 B14R1.18811 O=C(CCF)c1c(cc(cc1F)Br)O 1458a_200015963038_100011217306 [0,2,0,0,0,0|2,0,0]=4 12154 B14R1.18811 O=C(CCF)c1c(cc(cc1F)F)O 1458a_100000746385_100011217306 [0,2,0,0,0,0|2,0,0]=4 12155 B14R1.18811 O=C(CCO)c1c(cc(cc1F)Br)O 1458a_200015963038_100000211926 [0,2,0,0,0,0|2,0,0]=4 12156 B14R1.18811 O=C(CCO)c1c(cc(cc1F)F)O 1458a_100000746385_100000211926 [0,2,0,0,0,0|2,0,0]=4 12157 B12R1.51 CCCC(=O)C=Cc1cccs1 1458a_100000182767_100000210303 [0,0,1,1,0,0|1,1,0]=4 12158 B12R1.51 CCNC(=O)C=Cc1cccs1 11a_100015525214_100000182767 [0,0,1,1,0,0|1,1,0]=4 12159 B12R1.51 CCNC(=O)C=Cc1cccs1 240690a_100015525214_100000182767 [0,0,1,1,0,0|1,1,0]=4 12160 B12R1.51 CCOC(=O)C=Cc1c[nH]cn1 271570a_100010199719_100000756875 [0,0,1,1,0,0|2,0,0]=4 12161 B12R1.51 CCOC(=O)C=Cc1cc[nH]n1 271570a_100010199719_100000062575 [0,0,1,1,0,0|2,0,0]=4 12162 B12R1.51 CCOC(=O)C=Cc1ccco1 271570a_100010199719_100009814098 [0,0,1,1,0,0|0,0,0]=2 12163 B12R1.51 CCOC(=O)C=Cc1cccs1 271570a_100010199719_100011215356 [0,0,1,1,0,0|0,1,0]=3 12164 B12R1.51 CCOC(=O)C=Cc1ccoc1 271570a_100010199719_100011215275 [0,0,1,1,0,0|2,0,0]=4 12165 B12R1.51 CCOC(=O)C=Cc1ccsc1 271570a_100010199719_100000738268 [0,0,1,1,0,0|2,0,0]=4 12166 B12R1.51 CCOC(=O)C=Cc1ccsn1 271570a_100010199719_100009818082 [0,0,1,1,0,0|2,0,0]=4 12167 B12R1.51 CCOC(=O)C=Cc1cnco1 271570a_100010199719_100020591547 [0,0,1,1,0,0|1,0,0]=3 12168 B12R1.51 CCOC(=O)C=Cc1cncs1 271570a_100010199719_100011934649 [0,0,1,1,0,0|1,1,0]=4 12169 B12R1.51 CCOC(=O)C=Cc1cscn1 271570a_100010199719_100000751502 [0,0,1,1,0,0|2,0,0]=4 12170 B12R1.51 CCOC(=O)C=Cc1ncc[nH]1 271570a_100010199719_100025796157 [0,0,1,1,0,0|2,0,0]=4 12171 B12R1.51 CCOC(=O)C=Cc1ncco1 271570a_100010199719_100011787736 [0,0,1,1,0,0|1,0,0]=3 12172 B12R1.51 CCOC(=O)C=Cc1nccs1 271570a_100010199719_100000211983 [0,0,1,1,0,0|1,1,0]=4 12173 B12R1.51 CCOC(=O)CSc1ccco1 62a_100000188475_100009814098 [0,0,1,1,0,0|1,0,1]=4 12174 B12R1.51 CCOC(=O)CSc1ccco1 62a_100009814098_100000188475 [0,0,1,1,0,0|1,0,1]=4 12175 B12R1.51 CNNC(=O)C=Cc1ccco1 22a_100016993582_100000720202 [0,0,1,1,0,0|2,0,0]=4 12176 B12R1.278 CC=Cc1cccc(c1)OCC 271570a_100016259895_100000170002 [0,0,1,1,0,0|2,0,0]=4 12177 B12R1.278 CC=Cc1cccc(n1)OCC 271570a_100016259895_100000752924 [0,0,1,1,0,0|2,0,0]=4 12178 B12R1.41 C=Cc1cc(cc(c1)OCC)F 271570a_100011290941_100012343907 [0,0,1,1,0,0|2,0,0]=4 12179 B12R1.283 C=C(C)c1ccccc1OCC 271570a_100000694244_100000230754 [0,0,1,1,0,0|2,0,0]=4 12180 B12R1.283 C=C(C)c1cccnc1OCC 271570a_100000694244_100011465154 [0,0,1,1,0,0|2,0,0]=4 12181 B12R1.312 C=Cc1cc(cs1)C(=O)OCC 271570a_100011290941_100011228516 [0,0,1,1,0,0|0,1,0]=3 12182 B12R1.312 C=Cc1cc(n[nH]1)C(=O)OCC 271570a_100011290941_100010743333 [0,0,1,1,0,0|2,0,0]=4 12183 B12R1.312 C=Cc1ccc([nH]1)C(=O)OCC 271570a_100011290941_200000687776 [0,0,1,1,0,0|2,0,0]=4 12184 B12R1.312 C=Cc1ccc(o1)C(=O)OCC 271570a_100011290941_200000170220 [0,0,1,1,0,0|2,0,0]=4 12185 B12R1.312 C=Cc1ccc(s1)C(=O)OCC 271570a_100011290941_100000172375 [0,0,1,1,0,0|2,0,0]=4 12186 B12R1.312 C=Cc1csc(c1)C(=O)OCC 271570a_100011290941_100009815474 [0,0,1,1,0,0|2,0,0]=4 12187 B12R1.312 C=Cc1nc(c[nH]1)C(=O)OCC 271570a_100011290941_100010231773 [0,0,1,1,0,0|2,0,0]=4 12188 B12R1.312 C=Cc1nc(co1)C(=O)OCC 271570a_100011290941_100011935043 [0,0,1,1,0,0|1,0,0]=3 12189 B12R1.312 C=Cc1nc(cs1)C(=O)OCC 271570a_100011290941_100009814092 [0,0,1,1,0,0|1,1,0]=4 12190 B12R1.312 C=Cc1ncc(o1)C(=O)OCC 271570a_100011290941_100010205802 [0,0,1,1,0,0|2,0,0]=4 12191 B12R1.312 C=Cc1ncc(s1)C(=O)OCC 271570a_100011290941_100009814955 [0,0,1,1,0,0|2,0,0]=4 12192 B12R2.2 C1=C(CCC1)c2ccccc2 271570a_100000089523_100000210277 [1,0,0,1,0,0|2,0,0]=4 12193 B12R2.2075 C=C(c1ccccc1)C2CC2 271570a_100010895485_100000210277 [1,0,0,1,0,0|2,0,0]=4 12194 B12R2.32 CSc1cc2ccccc2o1 62a_200000210301_100010159458 [1,0,0,1,0,0|2,0,0]=4 12195 B12R2.32 [13CH3]Sc1cc2ccccc2o1 62a_200025704644_100010159458 [1,0,0,1,0,0|2,0,0]=4 12196 B12R2.196 Cn1ccc2c1cccc2O 271570a_203496583355_200011934935 [1,0,0,1,0,0|2,0,0]=4 12197 B12R2.196 Cn1ncc2c1cccc2O 271570a_203496583355_100009817161 [1,0,0,1,0,0|2,0,0]=4 12198 B12R2.225 Oc1ccccc1NC2CC2 34a_100000185747_100000211595 [1,0,0,1,0,0|2,0,0]=4 12199 B12R2.225 Oc1ccccc1OC2CC2 271570a_203496583355_100012344913 [1,0,0,1,0,0|2,0,0]=4 12200 B12R2.225 Oc1ccccc1SC2CC2 62a_100000739446_100000211595 [1,0,0,1,0,0|2,0,0]=4 12201 B12R2.1 COc1csc2c1cccc2 34a_100000077758_200000210301 [1,0,0,1,0,0|1,1,0]=4 12202 B12R2.1 COc1csc2c1cccc2 7a_100000077758_200000210301 [1,0,0,1,0,0|1,1,0]=4 12203 B12R2.1 CSc1coc2c1cccc2 62a_200000210301_100009812202 [1,0,0,1,0,0|1,1,0]=4 12204 B12R2.1 CSc1noc2c1cccc2 62a_200000210301_200000703156 [1,0,0,1,0,0|1,1,0]=4 12205 B12R2.1 CSc1noc2c1cccc2 62a_200000703156_200000210301 [1,0,0,1,0,0|1,1,0]=4 12206 B12R2.1 [13CH3]Oc1csc2c1cccc2 34a_100000077758_200025704644 [1,0,0,1,0,0|1,1,0]=4 12207 B12R2.1 [13CH3]Oc1csc2c1cccc2 7a_100000077758_200025704644 [1,0,0,1,0,0|1,1,0]=4 12208 B12R2.1 [13CH3]Sc1coc2c1cccc2 62a_200025704644_100009812202 [1,0,0,1,0,0|1,1,0]=4 12209 B12R2.1 [13CH3]Sc1noc2c1cccc2 62a_200000703156_200025704644 [1,0,0,1,0,0|1,1,0]=4 12210 B12R2.1 [13CH3]Sc1noc2c1cccc2 62a_200025704644_200000703156 [1,0,0,1,0,0|1,1,0]=4 12211 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [1,0,0,1,0,0|0,0,2]=4 12212 B12R2.88 NC1(CC1)c2ccccc2O 271570a_203496583355_200000691159 [1,0,0,1,0,0|1,0,1]=4 12213 B12R2.203 NC1CCc2c1c(ccc2)O 271570a_203496583355_100103168669 [1,0,0,1,0,0|1,0,1]=4 12214 B12R2.203 O=C1CCc2c1c(ccc2)O 271570a_203496583355_100009816781 [1,0,0,1,0,0|0,0,0]=2 12215 B12R2.203 O=C1COc2c1c(ccc2)O 271570a_203496583355_100010205902 [1,0,0,1,0,0|1,0,0]=3 12216 B12R2.203 O=C1NCc2c1c(ccc2)O 271570a_203496583355_100000724024 [1,0,0,1,0,0|1,0,0]=3 12217 B12R2.203 O=C1OCc2c1c(ccc2)O 271570a_203496583355_100010132333 [1,0,0,1,0,0|0,0,0]=2 12218 B12R2.203 O=c1[nH][nH]c2c1c(ccc2)O 271570a_203496583355_100010170957 [1,0,0,1,0,0|2,0,0]=4 12219 B14R2.50 Oc1ccccc1C=C2CCCC2 271570a_100010378317_100000739446 [0,0,0,1,0,1|2,0,0]=4 12220 B14R2.112 CCOc1ccc2ccccc2c1 34a_100000185828_100000210202 [0,0,0,1,0,1|2,0,0]=4 12221 B14R2.112 CCOc1ccc2ccccc2c1 7a_100000185828_100000210202 [0,0,0,1,0,1|2,0,0]=4 12222 B14R2.112 CCOc1cnc2ccccc2c1 34a_100011934006_100000210202 [0,0,0,1,0,1|2,0,0]=4 12223 B14R2.112 CCOc1cnc2ccccc2c1 7a_100011934006_100000210202 [0,0,0,1,0,1|2,0,0]=4 12224 B14R2.4621 Cc1ccccc1CC(=O)C2CC2 1458a_100000210395_100000211839 [0,0,0,1,0,1|2,0,0]=4 12225 B14R2.4621 Cc1ccccc1NC(=O)C2CC2 11a_100015192222_100000210395 [0,0,0,1,0,1|2,0,0]=4 12226 B14R2.4621 Cc1ccccc1NC(=O)C2CC2 1626a_100015192222_100000210395 [0,0,0,1,0,1|2,0,0]=4 12227 B14R2.4621 Cc1ccccc1NC(=O)C2CC2 22a_100015192222_100000210395 [0,0,0,1,0,1|2,0,0]=4 12228 B14R2.4621 Cc1ccccc1NC(=O)C2CC2 527a_100015192222_100000210395 [0,0,0,1,0,1|2,0,0]=4 12229 B14R2.4621 O=C(Cc1ccccc1Br)C2CC2 1458a_100000210395_100000184730 [0,0,0,1,0,1|2,0,0]=4 12230 B14R2.4621 O=C(Cc1ccccc1Cl)C2CC2 1458a_100000210395_100000187162 [0,0,0,1,0,1|2,0,0]=4 12231 B14R2.4621 O=C(Cc1ccccc1F)C2CC2 1458a_100000210395_100000187165 [0,0,0,1,0,1|2,0,0]=4 12232 B14R2.4621 O=C(Cc1ccccc1I)C2CC2 1458a_100000210395_100011216222 [0,0,0,1,0,1|2,0,0]=4 12233 B14R2.4621 O=C(Cc1ncccc1O)C2CC2 1458a_100000210395_200020655725 [0,0,0,1,0,1|2,0,0]=4 12234 B14R2.4621 O=C(Nc1ccccc1Br)C2CC2 11a_100000210017_100000210395 [0,0,0,1,0,1|2,0,0]=4 12235 B14R2.4621 O=C(Nc1ccccc1Br)C2CC2 1626a_100000210017_100000210395 [0,0,0,1,0,1|2,0,0]=4 12236 B14R2.4621 O=C(Nc1ccccc1Cl)C2CC2 11a_100000185783_100000210395 [0,0,0,1,0,1|2,0,0]=4 12237 B14R2.4621 O=C(Nc1ccccc1Cl)C2CC2 1626a_100000185783_100000210395 [0,0,0,1,0,1|2,0,0]=4 12238 B14R2.4621 O=C(Nc1ccccc1Cl)C2CC2 22a_100000185783_100000210395 [0,0,0,1,0,1|2,0,0]=4 12239 B14R2.4621 O=C(Nc1ccccc1Cl)C2CC2 527a_100000185783_100000210395 [0,0,0,1,0,1|2,0,0]=4 12240 B14R2.4621 O=C(Nc1ccccc1F)C2CC2 11a_100000210422_100000210395 [0,0,0,1,0,1|2,0,0]=4 12241 B14R2.4621 O=C(Nc1ccccc1F)C2CC2 1626a_100000210422_100000210395 [0,0,0,1,0,1|2,0,0]=4 12242 B14R2.4621 O=C(Nc1ccccc1F)C2CC2 22a_100000210422_100000210395 [0,0,0,1,0,1|2,0,0]=4 12243 B14R2.4621 O=C(Nc1ccccc1F)C2CC2 527a_100000210422_100000210395 [0,0,0,1,0,1|2,0,0]=4 12244 B14R2.4621 O=C(Nc1ccccc1I)C2CC2 11a_100000210053_100000210395 [0,0,0,1,0,1|2,0,0]=4 12245 B14R2.4621 O=C(Nc1ccccc1I)C2CC2 1626a_100000210053_100000210395 [0,0,0,1,0,1|2,0,0]=4 12246 B14R2.4621 O=C(Nc1ccccc1O)C2CC2 22a_100000185747_100000210395 [0,0,0,1,0,1|1,0,0]=3 12247 B14R2.4621 O=C(Nc1ccccc1O)C2CC2 271570a_203496583355_200000153537 [0,0,0,1,0,1|1,0,0]=3 12248 B14R2.4621 O=C(Nc1ccccc1O)C2CC2 527a_100000185747_100000210395 [0,0,0,1,0,1|1,0,0]=3 12249 B14R2.4621 O=C(Nc1ccccc1O)C2CO2 22a_100000185747_100000701028 [0,0,0,1,0,1|2,0,0]=4 12250 B14R2.4621 O=C(Nc1ccccc1O)C2CO2 527a_100000185747_100000701028 [0,0,0,1,0,1|2,0,0]=4 12251 B14R2.8045 O=c1[nH]c2c(cccc2c(=O)o1)O 271570a_203496583355_100000695655 [0,0,0,1,0,1|1,0,1]=4 12252 B14R2.33858 CCCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000210303 [0,0,0,1,0,1|2,0,0]=4 12253 B14R2.33858 CCNC(=O)C1Cc2c1cccc2 11a_100015525214_200000238571 [0,0,0,1,0,1|2,0,0]=4 12254 B14R2.33858 CCNC(=O)C1Cc2c1cccc2 240690a_100015525214_200000238571 [0,0,0,1,0,1|2,0,0]=4 12255 B14R2.33858 CCNC(=O)C1Cc2c1cccc2 527a_100015525214_200000238571 [0,0,0,1,0,1|2,0,0]=4 12256 B14R2.7 CCOc1noc2c1cccc2C 34a_100000041175_100000210202 [0,1,0,1,0,0|1,0,0]=3 12257 B14R2.7 Cc1cccc2c1onc2OCF 34a_100000041175_100015361967 [0,1,0,1,0,0|2,0,0]=4 12258 B14R2.23 Cc1cccc(c1O)C2=CCCC2 271570a_100000089523_100009817157 [0,1,0,1,0,0|2,0,0]=4 12259 B14R2.23 Nc1cccc(c1O)C2=CCCC2 271570a_100000089523_100011934915 [0,1,0,1,0,0|2,0,0]=4 12260 B14R2.23 Oc1c(cccc1C2=CCCC2)Br 271570a_100000089523_100010084509 [0,1,0,1,0,0|2,0,0]=4 12261 B14R2.23 Oc1c(cccc1C2=CCCC2)Cl 271570a_100000089523_100010202889 [0,1,0,1,0,0|2,0,0]=4 12262 B14R2.23 Oc1c(cccc1C2=CCCC2)F 271570a_100000089523_100009813666 [0,1,0,1,0,0|2,0,0]=4 12263 B14R2.23 Oc1cccc(c1O)C2=CCCC2 271570a_100000089523_100009815950 [0,1,0,1,0,0|2,0,0]=4 12264 B14R2.9064 C=C(c1cccc(c1O)Br)C2CC2 271570a_100010895485_100010084509 [0,1,0,1,0,0|2,0,0]=4 12265 B14R2.9064 C=C(c1cccc(c1O)C)C2CC2 271570a_100010895485_100009817157 [0,1,0,1,0,0|2,0,0]=4 12266 B14R2.9064 C=C(c1cccc(c1O)Cl)C2CC2 271570a_100010895485_100010202889 [0,1,0,1,0,0|2,0,0]=4 12267 B14R2.9064 C=C(c1cccc(c1O)F)C2CC2 271570a_100010895485_100009813666 [0,1,0,1,0,0|2,0,0]=4 12268 B14R2.9064 C=C(c1cccc(c1O)N)C2CC2 271570a_100010895485_100011934915 [0,1,0,1,0,0|2,0,0]=4 12269 B14R2.9064 C=C(c1cccc(c1O)O)C2CC2 271570a_100010895485_100009815950 [0,1,0,1,0,0|2,0,0]=4 12270 B14R2.28523 Nc1ccc2c(c1O)C(=O)CCC2 271570a_203496583355_100015235771 [0,1,0,1,0,0|1,0,0]=3 12271 B14R2.24 Brc1ccccc1C2=CCCCO2 271570a_100010177797_100000695589 [0,1,0,1,0,0|2,0,0]=4 12272 B14R2.24 Brc1ccccc1C2=COCCC2 271570a_100010175576_100000695589 [0,1,0,1,0,0|2,0,0]=4 12273 B14R2.24 Cc1ccccc1C2=CCCCO2 271570a_100010177797_100000210755 [0,1,0,1,0,0|2,0,0]=4 12274 B14R2.24 Cc1ccccc1C2=COCCC2 271570a_100010175576_100000210755 [0,1,0,1,0,0|2,0,0]=4 12275 B14R2.24 Clc1ccccc1C2=CCCCO2 271570a_100010177797_100000764095 [0,1,0,1,0,0|2,0,0]=4 12276 B14R2.24 Clc1ccccc1C2=COCCC2 271570a_100010175576_100000764095 [0,1,0,1,0,0|2,0,0]=4 12277 B14R2.24 Fc1ccccc1C2=CCCCO2 271570a_100010177797_100011215700 [0,1,0,1,0,0|2,0,0]=4 12278 B14R2.24 Fc1ccccc1C2=COCCC2 271570a_100010175576_100011215700 [0,1,0,1,0,0|2,0,0]=4 12279 B14R2.24 Nc1ccccc1C2=CCCCO2 271570a_100010177797_100000210017 [0,1,0,1,0,0|2,0,0]=4 12280 B14R2.24 Nc1ccccc1C2=COCCC2 271570a_100010175576_100000210017 [0,1,0,1,0,0|2,0,0]=4 12281 B14R2.24 Oc1ccccc1B2OCCCO2 271570a_203496583355_103437846672 [0,1,0,1,0,0|1,0,1]=4 12282 B14R2.24 Oc1ccccc1C2=CCCCC2 271570a_100000062251_100000739446 [0,1,0,1,0,0|2,0,0]=4 12283 B14R2.24 Oc1ccccc1C2=CCCCO2 271570a_100010177797_100000739446 [0,1,0,1,0,0|1,0,0]=3 12284 B14R2.24 Oc1ccccc1C2=CCNCC2 271570a_100000731432_100000739446 [0,1,0,1,0,0|2,0,0]=4 12285 B14R2.24 Oc1ccccc1C2=CCOCC2 271570a_100000070234_100000739446 [0,1,0,1,0,0|2,0,0]=4 12286 B14R2.24 Oc1ccccc1C2=CCSCC2 271570a_100010232141_100000739446 [0,1,0,1,0,0|2,0,0]=4 12287 B14R2.24 Oc1ccccc1C2=COCCC2 271570a_100010175576_100000739446 [0,1,0,1,0,0|1,0,0]=3 12288 B14R2.24 Oc1cccnc1C2=CCCCO2 271570a_100010177797_100000034122 [0,1,0,1,0,0|2,0,0]=4 12289 B14R2.24 Oc1cccnc1C2=COCCC2 271570a_100010175576_100000034122 [0,1,0,1,0,0|2,0,0]=4 12290 B14R2.24 Oc1cnccc1C2=CCCCO2 271570a_100010177797_100009817591 [0,1,0,1,0,0|2,0,0]=4 12291 B14R2.24 Oc1cnccc1C2=COCCC2 271570a_100010175576_100009817591 [0,1,0,1,0,0|2,0,0]=4 12292 B14R2.256 Cc1ccc(o1)c2ccccc2O 271570a_100000061910_100000739446 [0,1,0,1,0,0|1,0,1]=4 12293 B14R2.256 Cc1nc(no1)c2ccccc2O 270196a_100000211048_100000070787 [0,1,0,1,0,0|1,0,1]=4 12294 B14R2.256 Cc1nc(no1)c2ccccc2O 271570a_100000035170_100012003639 [0,1,0,1,0,0|1,0,1]=4 12295 B14R2.256 Cc1nc(no1)c2ccccc2O 271570a_203496583355_100000756727 [0,1,0,1,0,0|1,0,1]=4 12296 B14R2.256 Cc1nnc(o1)c2ccccc2O 271570a_100000035170_100000708914 [0,1,0,1,0,0|1,0,1]=4 12297 B14R2.256 Cc1nnc(o1)c2ccccc2O 271570a_203496583355_100000209789 [0,1,0,1,0,0|1,0,1]=4 12298 B14R2.256 Cc1noc(n1)c2ccccc2O 270196a_100000212224_100015234032 [0,1,0,1,0,0|1,0,1]=4 12299 B14R2.256 Cc1noc(n1)c2ccccc2O 271570a_203496583355_200000756749 [0,1,0,1,0,0|1,0,1]=4 12300 B14R2.517 CCSc1c(oc2c1cccc2)C 62a_100000210202_200010236113 [0,1,0,1,0,0|1,1,0]=4 12301 B14R2.6368 CCOc1noc2c1c(ccc2)F 34a_100009888067_100000210202 [0,1,0,1,0,0|1,0,0]=3 12302 B14R2.6368 FCOc1noc2c1c(ccc2)F 34a_100009888067_100015361967 [0,1,0,1,0,0|2,0,0]=4 12303 B14R2.7150 CCOC1CCOc2c1cccc2 7a_100000708930_100000210202 [0,1,0,1,0,0|1,0,1]=4 12304 B14R2.7150 CCOC1COCc2c1cccc2 34a_100012179175_100000210202 [0,1,0,1,0,0|1,0,1]=4 12305 B14R2.7150 CCOc1cccc2c1cccc2 34a_100000210388_100000210202 [0,1,0,1,0,0|2,0,0]=4 12306 B14R2.7150 CCOc1cccc2c1cccc2 7a_100000210388_100000210202 [0,1,0,1,0,0|2,0,0]=4 12307 B14R2.7150 CCOc1cncc2c1cccc2 34a_100000066178_100000210202 [0,1,0,1,0,0|2,0,0]=4 12308 B14R2.7150 CCOc1cncc2c1cccc2 7a_100000066178_100000210202 [0,1,0,1,0,0|2,0,0]=4 12309 B14R2.7150 CCOc1nccc2c1cccc2 34a_102531767632_100000210202 [0,1,0,1,0,0|2,0,0]=4 12310 B14R2.11635 C=Cc1cccc2c1C(=O)CCC2 271570a_100011290941_100009816782 [0,1,0,1,0,0|2,0,0]=4 12311 B14R2.11635 CSc1cccc2c1C(=O)CCC2 62a_100009816782_200000210301 [0,1,0,1,0,0|1,1,0]=4 12312 B14R2.11635 CSc1cccc2c1C(=O)CCC2 62a_200000210301_100009816782 [0,1,0,1,0,0|1,1,0]=4 12313 B14R2.11635 [13CH3]Sc1cccc2c1C(=O)CCC2 62a_100009816782_200025704644 [0,1,0,1,0,0|1,1,0]=4 12314 B14R2.11635 [13CH3]Sc1cccc2c1C(=O)CCC2 62a_200025704644_100009816782 [0,1,0,1,0,0|1,1,0]=4 12315 B14R2.2 CC(C)Oc1csc2c1cccc2 34a_100000077758_100000210206 [0,1,0,1,0,0|1,1,0]=4 12316 B14R2.2 CC(C)Oc1csc2c1cccc2 7a_100000077758_100000210206 [0,1,0,1,0,0|1,1,0]=4 12317 B14R2.2 CC(C)Sc1coc2c1cccc2 62a_100000210206_100009812202 [0,1,0,1,0,0|1,1,0]=4 12318 B14R2.2 CC(C)Sc1noc2c1cccc2 62a_100000210206_200000703156 [0,1,0,1,0,0|1,1,0]=4 12319 B14R2.2 CC(C)Sc1noc2c1cccc2 62a_200000703156_100000210206 [0,1,0,1,0,0|1,1,0]=4 12320 B14R2.4633 Cc1ccccc1C(=O)CC2CC2 1458a_100000212026_100000742324 [0,1,0,1,0,0|2,0,0]=4 12321 B14R2.4633 Cc1ccccc1C(=O)CC2CO2 1458a_100000212026_100011216344 [0,1,0,1,0,0|2,0,0]=4 12322 B14R2.4633 Cc1ccccc1C(=O)CC2CS2 1458a_100000212026_100000031435 [0,1,0,1,0,0|2,0,0]=4 12323 B14R2.4633 Cc1ccccc1C(=O)C[C@@H]2CO2 1458a_100000212026_100000745022 [0,1,0,1,0,0|2,0,0]=4 12324 B14R2.4633 Cc1ccccc1C(=O)NC2CC2 1626a_100000212008_100000212026 [0,1,0,1,0,0|2,0,0]=4 12325 B14R2.4633 Cc1ccccc1C(=O)NC2CC2 240690a_100000212008_100000212026 [0,1,0,1,0,0|2,0,0]=4 12326 B14R2.4633 Cc1ccccc1C(=O)NC2CC2 527a_100000212008_100000212026 [0,1,0,1,0,0|2,0,0]=4 12327 B14R2.4633 O=C(CC1CC1)c2ccccc2Br 1458a_100000188424_100000742324 [0,1,0,1,0,0|2,0,0]=4 12328 B14R2.4633 O=C(CC1CC1)c2ccccc2Cl 1458a_100000185844_100000742324 [0,1,0,1,0,0|2,0,0]=4 12329 B14R2.4633 O=C(CC1CC1)c2ccccc2F 1458a_100000188656_100000742324 [0,1,0,1,0,0|2,0,0]=4 12330 B14R2.4633 O=C(CC1CC1)c2ccccc2I 1458a_100000187884_100000742324 [0,1,0,1,0,0|2,0,0]=4 12331 B14R2.4633 O=C(CC1CC1)c2ccccc2O 1458a_100015234032_100000742324 [0,1,0,1,0,0|1,0,0]=3 12332 B14R2.4633 O=C(CC1CC1)c2ccccc2[O-] 1458a_100009911694_100000742324 [0,1,0,1,0,0|1,0,1]=4 12333 B14R2.4633 O=C(CC1CO1)c2ccccc2Br 1458a_100000188424_100011216344 [0,1,0,1,0,0|2,0,0]=4 12334 B14R2.4633 O=C(CC1CO1)c2ccccc2Cl 1458a_100000185844_100011216344 [0,1,0,1,0,0|2,0,0]=4 12335 B14R2.4633 O=C(CC1CO1)c2ccccc2F 1458a_100000188656_100011216344 [0,1,0,1,0,0|2,0,0]=4 12336 B14R2.4633 O=C(CC1CO1)c2ccccc2I 1458a_100000187884_100011216344 [0,1,0,1,0,0|2,0,0]=4 12337 B14R2.4633 O=C(CC1CO1)c2ccccc2O 1458a_100015234032_100011216344 [0,1,0,1,0,0|1,0,0]=3 12338 B14R2.4633 O=C(CC1CO1)c2ccccc2[O-] 1458a_100009911694_100011216344 [0,1,0,1,0,0|1,0,1]=4 12339 B14R2.4633 O=C(CC1CS1)c2ccccc2Br 1458a_100000188424_100000031435 [0,1,0,1,0,0|2,0,0]=4 12340 B14R2.4633 O=C(CC1CS1)c2ccccc2Cl 1458a_100000185844_100000031435 [0,1,0,1,0,0|2,0,0]=4 12341 B14R2.4633 O=C(CC1CS1)c2ccccc2F 1458a_100000188656_100000031435 [0,1,0,1,0,0|2,0,0]=4 12342 B14R2.4633 O=C(CC1CS1)c2ccccc2I 1458a_100000187884_100000031435 [0,1,0,1,0,0|2,0,0]=4 12343 B14R2.4633 O=C(CC1CS1)c2ccccc2O 1458a_100015234032_100000031435 [0,1,0,1,0,0|1,0,0]=3 12344 B14R2.4633 O=C(CC1CS1)c2ccccc2[O-] 1458a_100009911694_100000031435 [0,1,0,1,0,0|1,0,1]=4 12345 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2Br 1458a_100000188424_100000745022 [0,1,0,1,0,0|2,0,0]=4 12346 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2Cl 1458a_100000185844_100000745022 [0,1,0,1,0,0|2,0,0]=4 12347 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2F 1458a_100000188656_100000745022 [0,1,0,1,0,0|2,0,0]=4 12348 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2I 1458a_100000187884_100000745022 [0,1,0,1,0,0|2,0,0]=4 12349 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2O 1458a_100015234032_100000745022 [0,1,0,1,0,0|1,0,0]=3 12350 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2[O-] 1458a_100009911694_100000745022 [0,1,0,1,0,0|1,0,1]=4 12351 B14R2.4633 O=C(NC1CC1)c2ccccc2Br 1626a_100000212008_100000188424 [0,1,0,1,0,0|2,0,0]=4 12352 B14R2.4633 O=C(NC1CC1)c2ccccc2Br 240690a_100000212008_100000188424 [0,1,0,1,0,0|2,0,0]=4 12353 B14R2.4633 O=C(NC1CC1)c2ccccc2Br 527a_100000212008_100000188424 [0,1,0,1,0,0|2,0,0]=4 12354 B14R2.4633 O=C(NC1CC1)c2ccccc2Cl 1626a_100000212008_100000185844 [0,1,0,1,0,0|2,0,0]=4 12355 B14R2.4633 O=C(NC1CC1)c2ccccc2Cl 240690a_100000212008_100000185844 [0,1,0,1,0,0|2,0,0]=4 12356 B14R2.4633 O=C(NC1CC1)c2ccccc2Cl 527a_100000212008_100000185844 [0,1,0,1,0,0|2,0,0]=4 12357 B14R2.4633 O=C(NC1CC1)c2ccccc2F 1626a_100000212008_100000188656 [0,1,0,1,0,0|2,0,0]=4 12358 B14R2.4633 O=C(NC1CC1)c2ccccc2F 240690a_100000212008_100000188656 [0,1,0,1,0,0|2,0,0]=4 12359 B14R2.4633 O=C(NC1CC1)c2ccccc2F 527a_100000212008_100000188656 [0,1,0,1,0,0|2,0,0]=4 12360 B14R2.4633 O=C(NC1CC1)c2ccccc2I 1626a_100000212008_100000187884 [0,1,0,1,0,0|2,0,0]=4 12361 B14R2.4633 O=C(NC1CC1)c2ccccc2I 240690a_100000212008_100000187884 [0,1,0,1,0,0|2,0,0]=4 12362 B14R2.4633 O=C(NC1CC1)c2ccccc2I 527a_100000212008_100000187884 [0,1,0,1,0,0|2,0,0]=4 12363 B14R2.4633 O=C(NC1CC1)c2ccccc2O 240690a_100000212008_100015234032 [0,1,0,1,0,0|1,0,0]=3 12364 B14R2.4633 O=C(NC1CC1)c2ccccc2O 271570a_203496583355_200000155669 [0,1,0,1,0,0|1,0,0]=3 12365 B14R2.4633 O=C(NC1CC1)c2ccccc2[O-] 1626a_100000212008_100009911694 [0,1,0,1,0,0|1,0,1]=4 12366 B14R2.4633 O=C(NC1CC1)c2ccccc2[O-] 240690a_100000212008_100009911694 [0,1,0,1,0,0|1,0,1]=4 12367 B14R2.4633 O=C(NC1CC1)c2ccccc2[O-] 527a_100000212008_100009911694 [0,1,0,1,0,0|1,0,1]=4 12368 B14R2.4633 O=C(NC1CC1)c2cccnc2O 271570a_203496583355_100000160638 [0,1,0,1,0,0|2,0,0]=4 12369 B14R2.8052 CC1(OC(=O)c2c1ccnc2O)C 271570a_203496583355_100000057204 [0,1,0,1,0,0|1,0,0]=3 12370 B14R2.28480 Cc1nc2cccc(c2c(=O)o1)O 271570a_203496583355_200010128068 [0,1,0,1,0,0|0,0,1]=3 12371 B14R2.28480 O=C1CCOc2c1c(cc(c2)F)O 271570a_203496583355_100010133418 [0,1,0,1,0,0|2,0,0]=4 12372 B14R2.28480 O=C1NCCc2c1c(cc(c2)O)F 271570a_203496583355_100010371480 [0,1,0,1,0,0|2,0,0]=4 12373 B14R2.28480 O=c1[nH]c2cccc(c2c(=O)o1)O 271570a_203496583355_100010201677 [0,1,0,1,0,0|1,0,1]=4 12374 B14R2.306 Cc1ccc(c(c1)C2=CCCC2)O 271570a_100000089523_100000765521 [0,1,0,1,0,0|2,0,0]=4 12375 B14R2.306 Nc1ccc(c(c1)C2=CCCC2)O 271570a_100000089523_100011534360 [0,1,0,1,0,0|2,0,0]=4 12376 B14R2.306 Oc1ccc(c(c1)C2=CCCC2)O 271570a_100000089523_100009813629 [0,1,0,1,0,0|2,0,0]=4 12377 B14R2.306 Oc1ccc(cc1C2=CCCC2)Br 271570a_100000089523_100012355227 [0,1,0,1,0,0|2,0,0]=4 12378 B14R2.306 Oc1ccc(cc1C2=CCCC2)Cl 271570a_100000089523_100011356953 [0,1,0,1,0,0|2,0,0]=4 12379 B14R2.306 Oc1ccc(cc1C2=CCCC2)F 271570a_100000089523_100000211999 [0,1,0,1,0,0|2,0,0]=4 12380 B14R2.1060 CSC1Oc2ccc(cc2C1=O)Br 62a_200000210301_100011071988 [0,1,0,1,0,0|2,0,0]=4 12381 B14R2.1060 [13CH3]SC1Oc2ccc(cc2C1=O)Br 62a_200025704644_100011071988 [0,1,0,1,0,0|2,0,0]=4 12382 B14R2.5637 O=C1CCCCc2c1cc(cc2)O 271570a_203496583355_100011742502 [0,1,0,1,0,0|2,0,0]=4 12383 B14R2.5637 O=C1CCCNc2c1cc(cc2)O 271570a_203496583355_100010003710 [0,1,0,1,0,0|2,0,0]=4 12384 B14R2.5637 O=C1CCCOc2c1cc(cc2)O 271570a_203496583355_100000735629 [0,1,0,1,0,0|1,0,0]=3 12385 B14R2.8051 O=C1CCCc2c1c(ccc2O)F 271570a_203496583355_100010133564 [0,1,0,1,0,0|2,0,0]=4 12386 B14R2.8235 Cc1nc2ccc(cc2c(=O)o1)O 271570a_203496583355_200009814615 [0,1,0,1,0,0|1,0,1]=4 12387 B14R2.30096 C=C(c1cc(ccc1O)Br)C2CC2 271570a_100010895485_100012355227 [0,1,0,1,0,0|2,0,0]=4 12388 B14R2.30096 C=C(c1cc(ccc1O)C)C2CC2 271570a_100010895485_100000765521 [0,1,0,1,0,0|2,0,0]=4 12389 B14R2.30096 C=C(c1cc(ccc1O)Cl)C2CC2 271570a_100010895485_100011356953 [0,1,0,1,0,0|2,0,0]=4 12390 B14R2.30096 C=C(c1cc(ccc1O)F)C2CC2 271570a_100010895485_100000211999 [0,1,0,1,0,0|2,0,0]=4 12391 B14R2.30096 C=C(c1cc(ccc1O)N)C2CC2 271570a_100010895485_100011534360 [0,1,0,1,0,0|2,0,0]=4 12392 B14R2.30096 C=C(c1cc(ccc1O)O)C2CC2 271570a_100010895485_100009813629 [0,1,0,1,0,0|2,0,0]=4 12393 B14R2.30096 O=C(c1cc(ccc1F)O)C2CC2 271570a_203496583355_100012343552 [0,1,0,1,0,0|2,0,0]=4 12394 B14R2.92 CSc1coc2ccccc2c1=O 62a_200000210301_100009813851 [0,1,0,1,0,0|2,0,0]=4 12395 B14R2.92 [13CH3]Sc1coc2ccccc2c1=O 62a_200025704644_100009813851 [0,1,0,1,0,0|2,0,0]=4 12396 B14R2.98 COc1ccccc1C2=CCCC2 271570a_100000089523_100000174000 [0,1,0,1,0,0|2,0,0]=4 12397 B14R2.98 OCc1ccccc1C2=CCCC2 271570a_100000089523_100000187465 [0,1,0,1,0,0|2,0,0]=4 12398 B14R2.3348 C=C(c1ccccc1CO)C2CC2 271570a_100010895485_100000187465 [0,1,0,1,0,0|2,0,0]=4 12399 B14R2.3348 C=C(c1ccccc1OC)C2CC2 271570a_100010895485_100000174000 [0,1,0,1,0,0|2,0,0]=4 12400 B14R2.3348 COc1ccccc1C(=O)C2CC2 34a_100010648536_200000210301 [0,1,0,1,0,0|1,0,0]=3 12401 B14R2.3348 COc1ccccc1C(=O)C2CC2 7a_100010648536_200000210301 [0,1,0,1,0,0|1,0,0]=3 12402 B14R2.3348 [13CH3]Oc1ccccc1C(=O)C2CC2 34a_100010648536_200025704644 [0,1,0,1,0,0|1,0,0]=3 12403 B14R2.3348 [13CH3]Oc1ccccc1C(=O)C2CC2 7a_100010648536_200025704644 [0,1,0,1,0,0|1,0,0]=3 12404 B14R2.11691 COc1cccc2c1C(=O)OC2=O 7a_100000042631_200000210301 [0,1,0,1,0,0|1,0,1]=4 12405 B14R2.11691 [13CH3]Oc1cccc2c1C(=O)OC2=O 7a_100000042631_200025704644 [0,1,0,1,0,0|1,0,1]=4 12406 B14R2.3 CCCCc1coc2c1cccc2 271570a_100020621405_100009812202 [0,1,0,1,0,0|2,0,0]=4 12407 B14R2.3 CCCOc1csc2c1cccc2 34a_100000077758_100000210303 [0,1,0,1,0,0|1,1,0]=4 12408 B14R2.3 CCCOc1csc2c1cccc2 7a_100000077758_100000210303 [0,1,0,1,0,0|1,1,0]=4 12409 B14R2.3 CCCSc1coc2c1cccc2 62a_100000210303_100009812202 [0,1,0,1,0,0|1,1,0]=4 12410 B14R2.3 CCCSc1noc2c1cccc2 62a_100000210303_200000703156 [0,1,0,1,0,0|1,1,0]=4 12411 B14R2.3 CCCSc1noc2c1cccc2 62a_200000703156_100000210303 [0,1,0,1,0,0|1,1,0]=4 12412 B14R2.3 CCNCc1coc2c1cccc2 207a_100015525214_100000688544 [0,1,0,1,0,0|2,0,0]=4 12413 B14R2.3 CCNCc1coc2c1cccc2 270004a_100015525214_100000688544 [0,1,0,1,0,0|2,0,0]=4 12414 B14R2.3 CCNN=C1COc2c1cccc2 4a_100000756455_100000185568 [0,1,0,1,0,0|2,0,0]=4 12415 B14R2.3 CCOCc1csc2c1cccc2 34a_100011219454_100000210202 [0,1,0,1,0,0|1,1,0]=4 12416 B14R2.3 CCOCc1csc2c1cccc2 34a_100121572206_200000742921 [0,1,0,1,0,0|1,1,0]=4 12417 B14R2.3 CCOCc1noc2c1cccc2 34a_100121572206_100009813815 [0,1,0,1,0,0|1,0,0]=3 12418 B14R2.3 CCSCc1noc2c1cccc2 62a_100000210202_100009813815 [0,1,0,1,0,0|1,1,0]=4 12419 B14R2.3 CCSCc1noc2c1cccc2 62a_100009813815_100000210202 [0,1,0,1,0,0|1,1,0]=4 12420 B14R2.3 CNCCc1coc2c1cccc2 2230a_100011934666_200000210301 [0,1,0,1,0,0|2,0,0]=4 12421 B14R2.3 CNCCc1coc2c1cccc2 34a_100011934666_200000210301 [0,1,0,1,0,0|2,0,0]=4 12422 B14R2.3 COCSc1coc2c1cccc2 62a_100000766300_100009812202 [0,1,0,1,0,0|1,1,0]=4 12423 B14R2.3 COCSc1noc2c1cccc2 62a_100000766300_200000703156 [0,1,0,1,0,0|1,1,0]=4 12424 B14R2.3 COCSc1noc2c1cccc2 62a_200000703156_100000766300 [0,1,0,1,0,0|1,1,0]=4 12425 B14R2.3 CSCOc1csc2c1cccc2 34a_100000077758_100011218213 [0,1,0,1,0,0|1,1,0]=4 12426 B14R2.3 CSCSc1coc2c1cccc2 62a_100011218213_100009812202 [0,1,0,1,0,0|1,1,0]=4 12427 B14R2.3 CSCSc1noc2c1cccc2 62a_100011218213_200000703156 [0,1,0,1,0,0|1,1,0]=4 12428 B14R2.3 CSCSc1noc2c1cccc2 62a_200000703156_100011218213 [0,1,0,1,0,0|1,1,0]=4 12429 B14R2.3 FCCOc1csc2c1cccc2 34a_100000077758_100011217306 [0,1,0,1,0,0|1,1,0]=4 12430 B14R2.3 FCCOc1csc2c1cccc2 7a_100000077758_100011217306 [0,1,0,1,0,0|1,1,0]=4 12431 B14R2.3 FCCSc1coc2c1cccc2 62a_100011217306_100009812202 [0,1,0,1,0,0|1,1,0]=4 12432 B14R2.3 FCCSc1noc2c1cccc2 62a_100011217306_200000703156 [0,1,0,1,0,0|1,1,0]=4 12433 B14R2.3 FCCSc1noc2c1cccc2 62a_200000703156_100011217306 [0,1,0,1,0,0|1,1,0]=4 12434 B14R2.3 OCCOc1csc2c1cccc2 34a_100000077758_100000211926 [0,1,0,1,0,0|1,1,0]=4 12435 B14R2.3 OCCOc1csc2c1cccc2 7a_100000077758_100000211926 [0,1,0,1,0,0|1,1,0]=4 12436 B14R2.3 OCCSc1coc2c1cccc2 62a_100000211926_100009812202 [0,1,0,1,0,0|1,1,0]=4 12437 B14R2.3 OCCSc1noc2c1cccc2 62a_100000211926_200000703156 [0,1,0,1,0,0|1,1,0]=4 12438 B14R2.3 OCCSc1noc2c1cccc2 62a_200000703156_100000211926 [0,1,0,1,0,0|1,1,0]=4 12439 B14R2.3 [13CH3]NCCc1coc2c1cccc2 2230a_100011934666_200025704644 [0,1,0,1,0,0|2,0,0]=4 12440 B14R2.3 [13CH3]NCCc1coc2c1cccc2 34a_100011934666_200025704644 [0,1,0,1,0,0|2,0,0]=4 12441 B14R2.44 CCSC1Cc2ccccc2C1=O 62a_100000210202_100011218503 [0,1,0,1,0,0|1,1,0]=4 12442 B14R2.44 CCSC1Cc2ccccc2C1=O 62a_100011218503_100000210202 [0,1,0,1,0,0|1,1,0]=4 12443 B14R2.44 CNCc1oc2ccccc2c1C 207a_100102657272_100000077534 [0,1,0,1,0,0|2,0,0]=4 12444 B14R2.44 CNCc1oc2ccccc2c1C 2230a_100153394726_200000210301 [0,1,0,1,0,0|2,0,0]=4 12445 B14R2.44 CNCc1oc2ccccc2c1C 270004a_106832991635_100000077534 [0,1,0,1,0,0|2,0,0]=4 12446 B14R2.44 CNCc1oc2ccccc2c1C 34a_100153394726_200000210301 [0,1,0,1,0,0|2,0,0]=4 12447 B14R2.44 Cc1c(oc2c1cccc2)CN[13CH3] 2230a_100153394726_200025704644 [0,1,0,1,0,0|2,0,0]=4 12448 B14R2.44 Cc1c(oc2c1cccc2)CN[13CH3] 34a_100153394726_200025704644 [0,1,0,1,0,0|2,0,0]=4 12449 B14R2.21545 Cc1ccccc1C(=O)C2CCC2 1458a_100000212026_100000749161 [0,1,0,1,0,0|2,0,0]=4 12450 B14R2.21545 Cc1ccccc1C(=O)C2COC2 1458a_100000212026_100000687716 [0,1,0,1,0,0|2,0,0]=4 12451 B14R2.21545 Cc1ccccc1C(=O)N2CCC2 11a_100000754969_100000212026 [0,1,0,1,0,0|2,0,0]=4 12452 B14R2.21545 Cc1ccccc1C(=O)N2CCC2 240690a_100000754969_100000212026 [0,1,0,1,0,0|2,0,0]=4 12453 B14R2.21545 Cc1ccccc1C(=O)N2CCC2 527a_100000754969_100000212026 [0,1,0,1,0,0|2,0,0]=4 12454 B14R2.21545 O=C(c1ccccc1Br)C2CCC2 1458a_100000188424_100000749161 [0,1,0,1,0,0|2,0,0]=4 12455 B14R2.21545 O=C(c1ccccc1Br)C2COC2 1458a_100000188424_100000687716 [0,1,0,1,0,0|2,0,0]=4 12456 B14R2.21545 O=C(c1ccccc1Br)N2CCC2 11a_100000754969_100000188424 [0,1,0,1,0,0|2,0,0]=4 12457 B14R2.21545 O=C(c1ccccc1Br)N2CCC2 240690a_100000754969_100000188424 [0,1,0,1,0,0|2,0,0]=4 12458 B14R2.21545 O=C(c1ccccc1Br)N2CCC2 527a_100000754969_100000188424 [0,1,0,1,0,0|2,0,0]=4 12459 B14R2.21545 O=C(c1ccccc1Cl)C2CCC2 1458a_100000185844_100000749161 [0,1,0,1,0,0|2,0,0]=4 12460 B14R2.21545 O=C(c1ccccc1Cl)C2COC2 1458a_100000185844_100000687716 [0,1,0,1,0,0|2,0,0]=4 12461 B14R2.21545 O=C(c1ccccc1Cl)N2CCC2 11a_100000754969_100000185844 [0,1,0,1,0,0|2,0,0]=4 12462 B14R2.21545 O=C(c1ccccc1Cl)N2CCC2 240690a_100000754969_100000185844 [0,1,0,1,0,0|2,0,0]=4 12463 B14R2.21545 O=C(c1ccccc1Cl)N2CCC2 527a_100000754969_100000185844 [0,1,0,1,0,0|2,0,0]=4 12464 B14R2.21545 O=C(c1ccccc1F)C2CCC2 1458a_100000188656_100000749161 [0,1,0,1,0,0|2,0,0]=4 12465 B14R2.21545 O=C(c1ccccc1F)C2COC2 1458a_100000188656_100000687716 [0,1,0,1,0,0|2,0,0]=4 12466 B14R2.21545 O=C(c1ccccc1F)N2CCC2 11a_100000754969_100000188656 [0,1,0,1,0,0|2,0,0]=4 12467 B14R2.21545 O=C(c1ccccc1F)N2CCC2 240690a_100000754969_100000188656 [0,1,0,1,0,0|2,0,0]=4 12468 B14R2.21545 O=C(c1ccccc1F)N2CCC2 527a_100000754969_100000188656 [0,1,0,1,0,0|2,0,0]=4 12469 B14R2.21545 O=C(c1ccccc1I)C2CCC2 1458a_100000187884_100000749161 [0,1,0,1,0,0|2,0,0]=4 12470 B14R2.21545 O=C(c1ccccc1I)C2COC2 1458a_100000187884_100000687716 [0,1,0,1,0,0|2,0,0]=4 12471 B14R2.21545 O=C(c1ccccc1I)N2CCC2 11a_100000754969_100000187884 [0,1,0,1,0,0|2,0,0]=4 12472 B14R2.21545 O=C(c1ccccc1I)N2CCC2 240690a_100000754969_100000187884 [0,1,0,1,0,0|2,0,0]=4 12473 B14R2.21545 O=C(c1ccccc1I)N2CCC2 527a_100000754969_100000187884 [0,1,0,1,0,0|2,0,0]=4 12474 B14R2.21545 O=C(c1ccccc1O)C2CCC2 1458a_100015234032_100000749161 [0,1,0,1,0,0|1,0,0]=3 12475 B14R2.21545 O=C(c1ccccc1O)C2COC2 1458a_100015234032_100000687716 [0,1,0,1,0,0|1,0,0]=3 12476 B14R2.21545 O=C(c1ccccc1O)N2CCC2 240690a_100000754969_100015234032 [0,1,0,1,0,0|1,0,0]=3 12477 B14R2.21545 O=C(c1ccccc1[O-])C2CCC2 1458a_100009911694_100000749161 [0,1,0,1,0,0|1,0,1]=4 12478 B14R2.21545 O=C(c1ccccc1[O-])C2COC2 1458a_100009911694_100000687716 [0,1,0,1,0,0|1,0,1]=4 12479 B14R2.21545 O=C(c1ccccc1[O-])N2CCC2 240690a_100000754969_100009911694 [0,1,0,1,0,0|1,0,1]=4 12480 B14R2.21545 O=C(c1ccccc1[O-])N2CCC2 527a_100000754969_100009911694 [0,1,0,1,0,0|1,0,1]=4 12481 B14R2.739 Cc1ccc(c(c1)O)C2=CCCC2 271570a_100000089523_100012002257 [0,1,0,1,0,0|2,0,0]=4 12482 B14R2.739 Cc1ccc(c(c1)O)C2OCCO2 271570a_203496583355_200010165253 [0,1,0,1,0,0|0,0,2]=4 12483 B14R2.739 Oc1cc(ccc1C2=CCCC2)Br 271570a_100000089523_100012344904 [0,1,0,1,0,0|2,0,0]=4 12484 B14R2.739 Oc1cc(ccc1C2=CCCC2)Cl 271570a_100000089523_100000050036 [0,1,0,1,0,0|2,0,0]=4 12485 B14R2.739 Oc1cc(ccc1C2=CCCC2)F 271570a_100000089523_100000690578 [0,1,0,1,0,0|2,0,0]=4 12486 B14R2.739 Oc1cc(ccc1C2OCCO2)F 271570a_203496583355_200010165289 [0,1,0,1,0,0|0,0,2]=4 12487 B14R2.739 Oc1ccc(c(c1)O)C2=CCCC2 271570a_100000089523_100009813921 [0,1,0,1,0,0|2,0,0]=4 12488 B14R2.8719 O=C1CCCOc2c1ccc(c2)O 271570a_203496583355_100000735630 [0,1,0,1,0,0|1,0,0]=3 12489 B14R2.8719 O=C1NCCNc2c1ccc(c2)O 271570a_203496583355_200000725643 [0,1,0,1,0,0|2,0,0]=4 12490 B14R2.8719 O=C1NCCOc2c1ccc(c2)O 271570a_203496583355_200013358270 [0,1,0,1,0,0|1,0,0]=3 12491 B14R2.9203 C=C(c1ccc(cc1O)Br)C2CC2 271570a_100010895485_100012344904 [0,1,0,1,0,0|2,0,0]=4 12492 B14R2.9203 C=C(c1ccc(cc1O)C)C2CC2 271570a_100010895485_100012002257 [0,1,0,1,0,0|2,0,0]=4 12493 B14R2.9203 C=C(c1ccc(cc1O)Cl)C2CC2 271570a_100010895485_100000050036 [0,1,0,1,0,0|2,0,0]=4 12494 B14R2.9203 C=C(c1ccc(cc1O)F)C2CC2 271570a_100010895485_100000690578 [0,1,0,1,0,0|2,0,0]=4 12495 B14R2.9203 C=C(c1ccc(cc1O)O)C2CC2 271570a_100010895485_100009813921 [0,1,0,1,0,0|2,0,0]=4 12496 B14R2.9066 Cc1cccc(c1C2=CCCC2)O 271570a_100000089523_100000686692 [0,1,0,1,0,0|2,0,0]=4 12497 B14R2.9066 Nc1cccc(c1C2=CCCC2)O 271570a_100000089523_100012183704 [0,1,0,1,0,0|2,0,0]=4 12498 B14R2.9066 Oc1cccc(c1C2=CCCC2)Br 271570a_100000089523_100010187912 [0,1,0,1,0,0|2,0,0]=4 12499 B14R2.9066 Oc1cccc(c1C2=CCCC2)Cl 271570a_100000089523_100000050174 [0,1,0,1,0,0|2,0,0]=4 12500 B14R2.9066 Oc1cccc(c1C2=CCCC2)F 271570a_100000089523_100009820682 [0,1,0,1,0,0|2,0,0]=4 12501 B14R2.9066 Oc1cccc(c1C2=CCCC2)O 271570a_100000089523_100010205330 [0,1,0,1,0,0|2,0,0]=4 12502 B14R2.9066 Oc1cccc(c1C2OCCO2)F 271570a_203496583355_200135211078 [0,1,0,1,0,0|0,0,2]=4 12503 B14R2.23396 C=C(c1c(cccc1Br)O)C2CC2 271570a_100010895485_100010187912 [0,1,0,1,0,0|2,0,0]=4 12504 B14R2.23396 C=C(c1c(cccc1Cl)O)C2CC2 271570a_100010895485_100000050174 [0,1,0,1,0,0|2,0,0]=4 12505 B14R2.23396 C=C(c1c(cccc1F)O)C2CC2 271570a_100010895485_100009820682 [0,1,0,1,0,0|2,0,0]=4 12506 B14R2.23396 C=C(c1c(cccc1O)C)C2CC2 271570a_100010895485_100000686692 [0,1,0,1,0,0|2,0,0]=4 12507 B14R2.23396 C=C(c1c(cccc1O)N)C2CC2 271570a_100010895485_100012183704 [0,1,0,1,0,0|2,0,0]=4 12508 B14R2.23396 C=C(c1c(cccc1O)O)C2CC2 271570a_100010895485_100010205330 [0,1,0,1,0,0|2,0,0]=4 12509 B14R3.51 c1ccc2c(coc2c1)C3CC3 271570a_100011220607_100009812202 [0,0,0,2,0,0|2,0,0]=4 12510 B10R1.149 COC(=O)c1[nH]ccc1O 271570a_203496583355_100102525103 [1,0,0,0,1,0|1,0,0]=3 12511 B10R1.149 COC(=O)c1[nH]cnc1O 271570a_203496583355_100010290838 [1,0,0,0,1,0|2,0,0]=4 12512 B10R1.149 COC(=O)c1[nH]ncc1O 271570a_203496583355_100011934057 [1,0,0,0,1,0|2,0,0]=4 12513 B10R1.149 COC(=O)c1ccoc1O 271570a_203496583355_100011935261 [1,0,0,0,1,0|1,0,0]=3 12514 B10R1.149 COC(=O)c1ccsc1O 271570a_203496583355_100009822520 [1,0,0,0,1,0|1,0,0]=3 12515 B10R1.149 COC(=O)c1cscc1O 271570a_203496583355_100012351140 [1,0,0,0,1,0|1,0,0]=3 12516 B10R1.149 COC(=O)c1ncsc1O 271570a_203496583355_100009816836 [1,0,0,0,1,0|2,0,0]=4 12517 B10R1.149 COC(=O)c1occc1O 271570a_203496583355_100012676306 [1,0,0,0,1,0|1,0,0]=3 12518 B10R1.149 COC(=O)c1sccc1O 271570a_203496583355_100000730364 [1,0,0,0,1,0|1,0,0]=3 12519 B10R1.149 COC(=O)c1scnc1O 271570a_203496583355_100013370767 [1,0,0,0,1,0|2,0,0]=4 12520 B14R1.598 C=COC(=O)CNc1ccccc1O 34a_100000185747_100000036128 [0,0,0,0,0,2|0,0,2]=4 12521 B14R1.598 C=COC(=O)CSc1ccccc1O 62a_100000036128_100000739446 [0,0,0,0,0,2|0,0,2]=4 12522 B14R1.598 C=COC(=O)CSc1ccccc1O 62a_100000739446_100000036128 [0,0,0,0,0,2|0,0,2]=4 12523 B14R1.598 CC#CC(=O)CCc1ccccc1O 1458a_100000763181_100000722297 [0,0,0,0,0,2|1,0,1]=4 12524 B14R1.598 CC=CC(=O)CCc1ccccc1O 1458a_100000210699_100000722297 [0,0,0,0,0,2|1,0,1]=4 12525 B14R1.598 CC=CC(=O)NCc1ccccc1O 240690a_100000185550_100000210699 [0,0,0,0,0,2|1,0,1]=4 12526 B14R1.598 CCCC(=O)C#Cc1ccccc1F 1458a_100011892747_100000210303 [0,0,0,0,0,2|2,0,0]=4 12527 B14R1.598 CCCC(=O)C=Cc1ccccc1Br 1458a_100000719032_100000210303 [0,0,0,0,0,2|2,0,0]=4 12528 B14R1.598 CCCC(=O)C=Cc1ccccc1Cl 1458a_100000720304_100000210303 [0,0,0,0,0,2|2,0,0]=4 12529 B14R1.598 CCCC(=O)C=Cc1ccccc1F 1458a_100016256065_100000210303 [0,0,0,0,0,2|2,0,0]=4 12530 B14R1.598 CCCC(=O)C=Cc1ccccc1O 1458a_100016263591_100000210303 [0,0,0,0,0,2|1,0,0]=3 12531 B14R1.598 CCCC(=O)CCc1ccccc1Br 1458a_100000211992_100012161201 [0,0,0,0,0,2|2,0,0]=4 12532 B14R1.598 CCCC(=O)CCc1ccccc1Br 1458a_100000740810_100000210303 [0,0,0,0,0,2|2,0,0]=4 12533 B14R1.598 CCCC(=O)CCc1ccccc1C 1458a_100000211992_100011713688 [0,0,0,0,0,2|2,0,0]=4 12534 B14R1.598 CCCC(=O)CCc1ccccc1C 1458a_100000748742_100000210303 [0,0,0,0,0,2|2,0,0]=4 12535 B14R1.598 CCCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000210303 [0,0,0,0,0,2|2,0,0]=4 12536 B14R1.598 CCCC(=O)CCc1ccccc1Cl 1458a_100000211992_100011713703 [0,0,0,0,0,2|2,0,0]=4 12537 B14R1.598 CCCC(=O)CCc1ccccc1F 1458a_100000189703_100000210303 [0,0,0,0,0,2|2,0,0]=4 12538 B14R1.598 CCCC(=O)CCc1ccccc1F 1458a_100000211992_100000720011 [0,0,0,0,0,2|2,0,0]=4 12539 B14R1.598 CCCC(=O)CCc1ccccc1I 1458a_100000037306_100000210303 [0,0,0,0,0,2|2,0,0]=4 12540 B14R1.598 CCCC(=O)CCc1ccccc1O 1458a_100000181328_100000210303 [0,0,0,0,0,2|1,0,0]=3 12541 B14R1.598 CCCC(=O)CCc1ccccc1O 1458a_100000211992_100000722297 [0,0,0,0,0,2|1,0,0]=3 12542 B14R1.598 CCCC(=O)COc1ccccc1Br 1458a_100000216496_100000210303 [0,0,0,0,0,2|2,0,0]=4 12543 B14R1.598 CCCC(=O)COc1ccccc1Br 7a_100000181306_100000747444 [0,0,0,0,0,2|2,0,0]=4 12544 B14R1.598 CCCC(=O)COc1ccccc1C 1458a_100000182418_100000210303 [0,0,0,0,0,2|2,0,0]=4 12545 B14R1.598 CCCC(=O)COc1ccccc1C 7a_100000210338_100000747444 [0,0,0,0,0,2|2,0,0]=4 12546 B14R1.598 CCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000210303 [0,0,0,0,0,2|2,0,0]=4 12547 B14R1.598 CCCC(=O)COc1ccccc1Cl 7a_100000210172_100000747444 [0,0,0,0,0,2|2,0,0]=4 12548 B14R1.598 CCCC(=O)COc1ccccc1F 1458a_100000182486_100000210303 [0,0,0,0,0,2|2,0,0]=4 12549 B14R1.598 CCCC(=O)COc1ccccc1F 7a_100000210171_100000747444 [0,0,0,0,0,2|2,0,0]=4 12550 B14R1.598 CCCC(=O)COc1ccccc1I 7a_100000739446_100000747444 [0,0,0,0,0,2|2,0,0]=4 12551 B14R1.598 CCCC(=O)COc1ccccc1N 7a_100000185747_100000747444 [0,0,0,0,0,2|2,0,0]=4 12552 B14R1.598 CCCC(=O)COc1ccccc1O 1458a_100000183020_100000210303 [0,0,0,0,0,2|1,0,0]=3 12553 B14R1.598 CCCC(=O)CSc1ccccc1Br 62a_100000695589_100000747444 [0,0,0,0,0,2|2,0,0]=4 12554 B14R1.598 CCCC(=O)CSc1ccccc1Br 62a_100000747444_100000695589 [0,0,0,0,0,2|2,0,0]=4 12555 B14R1.598 CCCC(=O)CSc1ccccc1C 1458a_100000183026_100000210303 [0,0,0,0,0,2|2,0,0]=4 12556 B14R1.598 CCCC(=O)CSc1ccccc1C 62a_100000210755_100000747444 [0,0,0,0,0,2|2,0,0]=4 12557 B14R1.598 CCCC(=O)CSc1ccccc1C 62a_100000747444_100000210755 [0,0,0,0,0,2|2,0,0]=4 12558 B14R1.598 CCCC(=O)CSc1ccccc1Cl 62a_100000747444_100000764095 [0,0,0,0,0,2|2,0,0]=4 12559 B14R1.598 CCCC(=O)CSc1ccccc1Cl 62a_100000764095_100000747444 [0,0,0,0,0,2|2,0,0]=4 12560 B14R1.598 CCCC(=O)CSc1ccccc1F 1458a_100000179528_100000210303 [0,0,0,0,0,2|2,0,0]=4 12561 B14R1.598 CCCC(=O)CSc1ccccc1F 62a_100000747444_100011215700 [0,0,0,0,0,2|2,0,0]=4 12562 B14R1.598 CCCC(=O)CSc1ccccc1F 62a_100011215700_100000747444 [0,0,0,0,0,2|2,0,0]=4 12563 B14R1.598 CCCC(=O)CSc1ccccc1N 62a_100000210017_100000747444 [0,0,0,0,0,2|2,0,0]=4 12564 B14R1.598 CCCC(=O)CSc1ccccc1N 62a_100000747444_100000210017 [0,0,0,0,0,2|2,0,0]=4 12565 B14R1.598 CCCC(=O)CSc1ccccc1O 1458a_100000695322_100000210303 [0,0,0,0,0,2|1,0,0]=3 12566 B14R1.598 CCCC(=O)CSc1ccccc1O 62a_100000739446_100000747444 [0,0,0,0,0,2|1,0,0]=3 12567 B14R1.598 CCCC(=O)CSc1ccccc1O 62a_100000747444_100000739446 [0,0,0,0,0,2|1,0,0]=3 12568 B14R1.598 CCCC(=O)CSc1cccnc1O 62a_100000747444_100000760158 [0,0,0,0,0,2|2,0,0]=4 12569 B14R1.598 CCCC(=O)CSc1cccnc1O 62a_100000760158_100000747444 [0,0,0,0,0,2|2,0,0]=4 12570 B14R1.598 CCCC(=O)CSc1ccncc1O 62a_100000747444_100009817591 [0,0,0,0,0,2|2,0,0]=4 12571 B14R1.598 CCCC(=O)CSc1ccncc1O 62a_100009817591_100000747444 [0,0,0,0,0,2|2,0,0]=4 12572 B14R1.598 CCCC(=O)CSc1ncccc1O 62a_100000034122_100000747444 [0,0,0,0,0,2|2,0,0]=4 12573 B14R1.598 CCCC(=O)CSc1ncccc1O 62a_100000747444_100000034122 [0,0,0,0,0,2|2,0,0]=4 12574 B14R1.598 CCCC(=O)NCc1ccccc1Br 11a_100000689332_100000211992 [0,0,0,0,0,2|2,0,0]=4 12575 B14R1.598 CCCC(=O)NCc1ccccc1Br 1626a_100000689332_100000211992 [0,0,0,0,0,2|2,0,0]=4 12576 B14R1.598 CCCC(=O)NCc1ccccc1Br 240690a_100000689332_100000211992 [0,0,0,0,0,2|2,0,0]=4 12577 B14R1.598 CCCC(=O)NCc1ccccc1Br 527a_100000689332_100000211992 [0,0,0,0,0,2|2,0,0]=4 12578 B14R1.598 CCCC(=O)NCc1ccccc1C 11a_100000174972_100000211992 [0,0,0,0,0,2|2,0,0]=4 12579 B14R1.598 CCCC(=O)NCc1ccccc1C 1626a_100000174972_100000211992 [0,0,0,0,0,2|2,0,0]=4 12580 B14R1.598 CCCC(=O)NCc1ccccc1C 240690a_100000174972_100000211992 [0,0,0,0,0,2|2,0,0]=4 12581 B14R1.598 CCCC(=O)NCc1ccccc1C 527a_100000174972_100000211992 [0,0,0,0,0,2|2,0,0]=4 12582 B14R1.598 CCCC(=O)NCc1ccccc1Cl 11a_100000174879_100000211992 [0,0,0,0,0,2|2,0,0]=4 12583 B14R1.598 CCCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000211992 [0,0,0,0,0,2|2,0,0]=4 12584 B14R1.598 CCCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000211992 [0,0,0,0,0,2|2,0,0]=4 12585 B14R1.598 CCCC(=O)NCc1ccccc1Cl 527a_100000174879_100000211992 [0,0,0,0,0,2|2,0,0]=4 12586 B14R1.598 CCCC(=O)NCc1ccccc1F 11a_100000174869_100000211992 [0,0,0,0,0,2|2,0,0]=4 12587 B14R1.598 CCCC(=O)NCc1ccccc1F 1626a_100000174869_100000211992 [0,0,0,0,0,2|2,0,0]=4 12588 B14R1.598 CCCC(=O)NCc1ccccc1F 240690a_100000174869_100000211992 [0,0,0,0,0,2|2,0,0]=4 12589 B14R1.598 CCCC(=O)NCc1ccccc1F 527a_100000174869_100000211992 [0,0,0,0,0,2|2,0,0]=4 12590 B14R1.598 CCCC(=O)NCc1ccccc1I 11a_100015347259_100000211992 [0,0,0,0,0,2|2,0,0]=4 12591 B14R1.598 CCCC(=O)NCc1ccccc1I 1626a_100015347259_100000211992 [0,0,0,0,0,2|2,0,0]=4 12592 B14R1.598 CCCC(=O)NCc1ccccc1I 240690a_100015347259_100000211992 [0,0,0,0,0,2|2,0,0]=4 12593 B14R1.598 CCCC(=O)NCc1ccccc1I 527a_100015347259_100000211992 [0,0,0,0,0,2|2,0,0]=4 12594 B14R1.598 CCCC(=O)NCc1ccccc1O 240690a_100000185550_100000211992 [0,0,0,0,0,2|1,0,0]=3 12595 B14R1.598 CCCC(=O)NCc1ccccc1O 527a_100000185550_100000211992 [0,0,0,0,0,2|1,0,0]=3 12596 B14R1.598 CCCC(=O)NNc1ccccc1Br 22a_100000241748_100000211992 [0,0,0,0,0,2|2,0,0]=4 12597 B14R1.598 CCCC(=O)NNc1ccccc1C 22a_100000184220_100000211992 [0,0,0,0,0,2|2,0,0]=4 12598 B14R1.598 CCCC(=O)NNc1ccccc1Cl 22a_100000683529_100000211992 [0,0,0,0,0,2|2,0,0]=4 12599 B14R1.598 CCCC(=O)NNc1ccccc1F 22a_100000239246_100000211992 [0,0,0,0,0,2|2,0,0]=4 12600 B14R1.598 CCCC(=O)NNc1ccccc1I 22a_100011218156_100000211992 [0,0,0,0,0,2|2,0,0]=4 12601 B14R1.598 CCNC(=O)C=Cc1ccccc1Br 11a_100015525214_100000719032 [0,0,0,0,0,2|2,0,0]=4 12602 B14R1.598 CCNC(=O)C=Cc1ccccc1Br 240690a_100015525214_100000719032 [0,0,0,0,0,2|2,0,0]=4 12603 B14R1.598 CCNC(=O)C=Cc1ccccc1Cl 11a_100015525214_100000720304 [0,0,0,0,0,2|2,0,0]=4 12604 B14R1.598 CCNC(=O)C=Cc1ccccc1Cl 240690a_100015525214_100000720304 [0,0,0,0,0,2|2,0,0]=4 12605 B14R1.598 CCNC(=O)C=Cc1ccccc1F 11a_100015525214_100016256065 [0,0,0,0,0,2|2,0,0]=4 12606 B14R1.598 CCNC(=O)C=Cc1ccccc1F 240690a_100015525214_100016256065 [0,0,0,0,0,2|2,0,0]=4 12607 B14R1.598 CCNC(=O)CCc1ccccc1Br 11a_100015525214_100000740810 [0,0,0,0,0,2|2,0,0]=4 12608 B14R1.598 CCNC(=O)CCc1ccccc1Br 240690a_100015525214_100000740810 [0,0,0,0,0,2|2,0,0]=4 12609 B14R1.598 CCNC(=O)CCc1ccccc1Br 527a_100015525214_100000740810 [0,0,0,0,0,2|2,0,0]=4 12610 B14R1.598 CCNC(=O)CCc1ccccc1C 11a_100015525214_100000748742 [0,0,0,0,0,2|2,0,0]=4 12611 B14R1.598 CCNC(=O)CCc1ccccc1C 240690a_100015525214_100000748742 [0,0,0,0,0,2|2,0,0]=4 12612 B14R1.598 CCNC(=O)CCc1ccccc1C 527a_100015525214_100000748742 [0,0,0,0,0,2|2,0,0]=4 12613 B14R1.598 CCNC(=O)CCc1ccccc1Cl 11a_100015525214_100000184300 [0,0,0,0,0,2|2,0,0]=4 12614 B14R1.598 CCNC(=O)CCc1ccccc1Cl 240690a_100015525214_100000184300 [0,0,0,0,0,2|2,0,0]=4 12615 B14R1.598 CCNC(=O)CCc1ccccc1Cl 527a_100015525214_100000184300 [0,0,0,0,0,2|2,0,0]=4 12616 B14R1.598 CCNC(=O)CCc1ccccc1F 11a_100015525214_100000189703 [0,0,0,0,0,2|2,0,0]=4 12617 B14R1.598 CCNC(=O)CCc1ccccc1F 240690a_100015525214_100000189703 [0,0,0,0,0,2|2,0,0]=4 12618 B14R1.598 CCNC(=O)CCc1ccccc1F 527a_100015525214_100000189703 [0,0,0,0,0,2|2,0,0]=4 12619 B14R1.598 CCNC(=O)CCc1ccccc1I 11a_100015525214_100000037306 [0,0,0,0,0,2|2,0,0]=4 12620 B14R1.598 CCNC(=O)CCc1ccccc1I 240690a_100015525214_100000037306 [0,0,0,0,0,2|2,0,0]=4 12621 B14R1.598 CCNC(=O)CCc1ccccc1I 527a_100015525214_100000037306 [0,0,0,0,0,2|2,0,0]=4 12622 B14R1.598 CCNC(=O)CCc1ccccc1O 11a_100015525214_100000181328 [0,0,0,0,0,2|1,0,0]=3 12623 B14R1.598 CCNC(=O)CCc1ccccc1O 240690a_100015525214_100000181328 [0,0,0,0,0,2|1,0,0]=3 12624 B14R1.598 CCNC(=O)CCc1ccccc1O 527a_100015525214_100000181328 [0,0,0,0,0,2|1,0,0]=3 12625 B14R1.598 CCNC(=O)CNc1ccccc1Br 34a_100000210017_100000183381 [0,0,0,0,0,2|2,0,0]=4 12626 B14R1.598 CCNC(=O)CNc1ccccc1C 34a_100015192222_100000183381 [0,0,0,0,0,2|2,0,0]=4 12627 B14R1.598 CCNC(=O)CNc1ccccc1Cl 34a_100000185783_100000183381 [0,0,0,0,0,2|2,0,0]=4 12628 B14R1.598 CCNC(=O)CNc1ccccc1F 34a_100000210422_100000183381 [0,0,0,0,0,2|2,0,0]=4 12629 B14R1.598 CCNC(=O)CNc1ccccc1I 34a_100000210053_100000183381 [0,0,0,0,0,2|2,0,0]=4 12630 B14R1.598 CCNC(=O)CNc1ccccc1O 34a_100000185747_100000183381 [0,0,0,0,0,2|1,0,0]=3 12631 B14R1.598 CCNC(=O)COc1ccccc1Br 11a_100015525214_100000216496 [0,0,0,0,0,2|2,0,0]=4 12632 B14R1.598 CCNC(=O)COc1ccccc1Br 240690a_100015525214_100000216496 [0,0,0,0,0,2|2,0,0]=4 12633 B14R1.598 CCNC(=O)COc1ccccc1Br 34a_100000181306_100000183381 [0,0,0,0,0,2|2,0,0]=4 12634 B14R1.598 CCNC(=O)COc1ccccc1Br 527a_100015525214_100000216496 [0,0,0,0,0,2|2,0,0]=4 12635 B14R1.598 CCNC(=O)COc1ccccc1Br 7a_100000181306_100000183381 [0,0,0,0,0,2|2,0,0]=4 12636 B14R1.598 CCNC(=O)COc1ccccc1C 11a_100015525214_100000182418 [0,0,0,0,0,2|2,0,0]=4 12637 B14R1.598 CCNC(=O)COc1ccccc1C 240690a_100015525214_100000182418 [0,0,0,0,0,2|2,0,0]=4 12638 B14R1.598 CCNC(=O)COc1ccccc1C 34a_100000210338_100000183381 [0,0,0,0,0,2|2,0,0]=4 12639 B14R1.598 CCNC(=O)COc1ccccc1C 527a_100015525214_100000182418 [0,0,0,0,0,2|2,0,0]=4 12640 B14R1.598 CCNC(=O)COc1ccccc1C 7a_100000210338_100000183381 [0,0,0,0,0,2|2,0,0]=4 12641 B14R1.598 CCNC(=O)COc1ccccc1Cl 11a_100015525214_100000185159 [0,0,0,0,0,2|2,0,0]=4 12642 B14R1.598 CCNC(=O)COc1ccccc1Cl 240690a_100015525214_100000185159 [0,0,0,0,0,2|2,0,0]=4 12643 B14R1.598 CCNC(=O)COc1ccccc1Cl 34a_100000210172_100000183381 [0,0,0,0,0,2|2,0,0]=4 12644 B14R1.598 CCNC(=O)COc1ccccc1Cl 527a_100015525214_100000185159 [0,0,0,0,0,2|2,0,0]=4 12645 B14R1.598 CCNC(=O)COc1ccccc1Cl 7a_100000210172_100000183381 [0,0,0,0,0,2|2,0,0]=4 12646 B14R1.598 CCNC(=O)COc1ccccc1F 11a_100015525214_100000182486 [0,0,0,0,0,2|2,0,0]=4 12647 B14R1.598 CCNC(=O)COc1ccccc1F 240690a_100015525214_100000182486 [0,0,0,0,0,2|2,0,0]=4 12648 B14R1.598 CCNC(=O)COc1ccccc1F 34a_100000210171_100000183381 [0,0,0,0,0,2|2,0,0]=4 12649 B14R1.598 CCNC(=O)COc1ccccc1F 527a_100015525214_100000182486 [0,0,0,0,0,2|2,0,0]=4 12650 B14R1.598 CCNC(=O)COc1ccccc1F 7a_100000210171_100000183381 [0,0,0,0,0,2|2,0,0]=4 12651 B14R1.598 CCNC(=O)COc1ccccc1I 34a_100000739446_100000183381 [0,0,0,0,0,2|2,0,0]=4 12652 B14R1.598 CCNC(=O)COc1ccccc1I 7a_100000739446_100000183381 [0,0,0,0,0,2|2,0,0]=4 12653 B14R1.598 CCNC(=O)COc1ccccc1N 34a_100000185747_100000183381 [0,0,0,0,0,2|2,0,0]=4 12654 B14R1.598 CCNC(=O)COc1ccccc1N 7a_100000185747_100000183381 [0,0,0,0,0,2|2,0,0]=4 12655 B14R1.598 CCNC(=O)COc1ccccc1O 240690a_100015525214_100000183020 [0,0,0,0,0,2|1,0,0]=3 12656 B14R1.598 CCNC(=O)COc1ccccc1O 527a_100015525214_100000183020 [0,0,0,0,0,2|1,0,0]=3 12657 B14R1.598 CCNC(=O)CSc1ccccc1Br 62a_100000183381_100000695589 [0,0,0,0,0,2|2,0,0]=4 12658 B14R1.598 CCNC(=O)CSc1ccccc1Br 62a_100000695589_100000183381 [0,0,0,0,0,2|2,0,0]=4 12659 B14R1.598 CCNC(=O)CSc1ccccc1C 11a_100015525214_100000183026 [0,0,0,0,0,2|2,0,0]=4 12660 B14R1.598 CCNC(=O)CSc1ccccc1C 240690a_100015525214_100000183026 [0,0,0,0,0,2|2,0,0]=4 12661 B14R1.598 CCNC(=O)CSc1ccccc1C 527a_100015525214_100000183026 [0,0,0,0,0,2|2,0,0]=4 12662 B14R1.598 CCNC(=O)CSc1ccccc1C 62a_100000183381_100000210755 [0,0,0,0,0,2|2,0,0]=4 12663 B14R1.598 CCNC(=O)CSc1ccccc1C 62a_100000210755_100000183381 [0,0,0,0,0,2|2,0,0]=4 12664 B14R1.598 CCNC(=O)CSc1ccccc1Cl 62a_100000183381_100000764095 [0,0,0,0,0,2|2,0,0]=4 12665 B14R1.598 CCNC(=O)CSc1ccccc1Cl 62a_100000764095_100000183381 [0,0,0,0,0,2|2,0,0]=4 12666 B14R1.598 CCNC(=O)CSc1ccccc1F 11a_100015525214_100000179528 [0,0,0,0,0,2|2,0,0]=4 12667 B14R1.598 CCNC(=O)CSc1ccccc1F 240690a_100015525214_100000179528 [0,0,0,0,0,2|2,0,0]=4 12668 B14R1.598 CCNC(=O)CSc1ccccc1F 62a_100000183381_100011215700 [0,0,0,0,0,2|2,0,0]=4 12669 B14R1.598 CCNC(=O)CSc1ccccc1F 62a_100011215700_100000183381 [0,0,0,0,0,2|2,0,0]=4 12670 B14R1.598 CCNC(=O)CSc1ccccc1N 62a_100000183381_100000210017 [0,0,0,0,0,2|2,0,0]=4 12671 B14R1.598 CCNC(=O)CSc1ccccc1N 62a_100000210017_100000183381 [0,0,0,0,0,2|2,0,0]=4 12672 B14R1.598 CCNC(=O)CSc1ccccc1O 240690a_100015525214_100000695322 [0,0,0,0,0,2|1,0,0]=3 12673 B14R1.598 CCNC(=O)CSc1ccccc1O 527a_100015525214_100000695322 [0,0,0,0,0,2|1,0,0]=3 12674 B14R1.598 CCNC(=O)CSc1ccccc1O 62a_100000183381_100000739446 [0,0,0,0,0,2|1,0,0]=3 12675 B14R1.598 CCNC(=O)CSc1ccccc1O 62a_100000739446_100000183381 [0,0,0,0,0,2|1,0,0]=3 12676 B14R1.598 CCNC(=O)CSc1cccnc1O 62a_100000183381_100000760158 [0,0,0,0,0,2|2,0,0]=4 12677 B14R1.598 CCNC(=O)CSc1cccnc1O 62a_100000760158_100000183381 [0,0,0,0,0,2|2,0,0]=4 12678 B14R1.598 CCNC(=O)CSc1ccncc1O 62a_100000183381_100009817591 [0,0,0,0,0,2|2,0,0]=4 12679 B14R1.598 CCNC(=O)CSc1ccncc1O 62a_100009817591_100000183381 [0,0,0,0,0,2|2,0,0]=4 12680 B14R1.598 CCNC(=O)CSc1ncccc1O 62a_100000034122_100000183381 [0,0,0,0,0,2|2,0,0]=4 12681 B14R1.598 CCNC(=O)CSc1ncccc1O 62a_100000183381_100000034122 [0,0,0,0,0,2|2,0,0]=4 12682 B14R1.598 CCNC(=O)NCc1ccccc1Br 2708a_100000689332_100015525214 [0,0,0,0,0,2|2,0,0]=4 12683 B14R1.598 CCNC(=O)NCc1ccccc1Br 2708a_100015525214_100000689332 [0,0,0,0,0,2|2,0,0]=4 12684 B14R1.598 CCNC(=O)NCc1ccccc1Br 273464a_100000689332_100015525214 [0,0,0,0,0,2|2,0,0]=4 12685 B14R1.598 CCNC(=O)NCc1ccccc1Br 273464a_100015525214_100000689332 [0,0,0,0,0,2|2,0,0]=4 12686 B14R1.598 CCNC(=O)NCc1ccccc1Br 512a_100000689332_100015525214 [0,0,0,0,0,2|2,0,0]=4 12687 B14R1.598 CCNC(=O)NCc1ccccc1Br 512a_100015525214_100000689332 [0,0,0,0,0,2|2,0,0]=4 12688 B14R1.598 CCNC(=O)NCc1ccccc1C 2708a_100000174972_100015525214 [0,0,0,0,0,2|2,0,0]=4 12689 B14R1.598 CCNC(=O)NCc1ccccc1C 2708a_100015525214_100000174972 [0,0,0,0,0,2|2,0,0]=4 12690 B14R1.598 CCNC(=O)NCc1ccccc1C 273464a_100000174972_100015525214 [0,0,0,0,0,2|2,0,0]=4 12691 B14R1.598 CCNC(=O)NCc1ccccc1C 273464a_100015525214_100000174972 [0,0,0,0,0,2|2,0,0]=4 12692 B14R1.598 CCNC(=O)NCc1ccccc1C 512a_100000174972_100015525214 [0,0,0,0,0,2|2,0,0]=4 12693 B14R1.598 CCNC(=O)NCc1ccccc1C 512a_100015525214_100000174972 [0,0,0,0,0,2|2,0,0]=4 12694 B14R1.598 CCNC(=O)NCc1ccccc1Cl 2708a_100000174879_100015525214 [0,0,0,0,0,2|2,0,0]=4 12695 B14R1.598 CCNC(=O)NCc1ccccc1Cl 2708a_100015525214_100000174879 [0,0,0,0,0,2|2,0,0]=4 12696 B14R1.598 CCNC(=O)NCc1ccccc1Cl 273464a_100000174879_100015525214 [0,0,0,0,0,2|2,0,0]=4 12697 B14R1.598 CCNC(=O)NCc1ccccc1Cl 273464a_100015525214_100000174879 [0,0,0,0,0,2|2,0,0]=4 12698 B14R1.598 CCNC(=O)NCc1ccccc1Cl 512a_100015525214_100000174879 [0,0,0,0,0,2|2,0,0]=4 12699 B14R1.598 CCNC(=O)NCc1ccccc1F 2708a_100000174869_100015525214 [0,0,0,0,0,2|2,0,0]=4 12700 B14R1.598 CCNC(=O)NCc1ccccc1F 2708a_100015525214_100000174869 [0,0,0,0,0,2|2,0,0]=4 12701 B14R1.598 CCNC(=O)NCc1ccccc1F 273464a_100000174869_100015525214 [0,0,0,0,0,2|2,0,0]=4 12702 B14R1.598 CCNC(=O)NCc1ccccc1F 273464a_100015525214_100000174869 [0,0,0,0,0,2|2,0,0]=4 12703 B14R1.598 CCNC(=O)NCc1ccccc1F 512a_100000174869_100015525214 [0,0,0,0,0,2|2,0,0]=4 12704 B14R1.598 CCNC(=O)NCc1ccccc1F 512a_100015525214_100000174869 [0,0,0,0,0,2|2,0,0]=4 12705 B14R1.598 CCNC(=O)NCc1ccccc1I 2708a_100015347259_100015525214 [0,0,0,0,0,2|2,0,0]=4 12706 B14R1.598 CCNC(=O)NCc1ccccc1I 2708a_100015525214_100015347259 [0,0,0,0,0,2|2,0,0]=4 12707 B14R1.598 CCNC(=O)NCc1ccccc1I 273464a_100015347259_100015525214 [0,0,0,0,0,2|2,0,0]=4 12708 B14R1.598 CCNC(=O)NCc1ccccc1I 273464a_100015525214_100015347259 [0,0,0,0,0,2|2,0,0]=4 12709 B14R1.598 CCNC(=O)NCc1ccccc1I 512a_100015347259_100015525214 [0,0,0,0,0,2|2,0,0]=4 12710 B14R1.598 CCNC(=O)NCc1ccccc1I 512a_100015525214_100015347259 [0,0,0,0,0,2|2,0,0]=4 12711 B14R1.598 CCNC(=O)NCc1ccccc1O 2708a_100000185550_100015525214 [0,0,0,0,0,2|1,0,0]=3 12712 B14R1.598 CCNC(=O)NCc1ccccc1O 2708a_100015525214_100000185550 [0,0,0,0,0,2|1,0,0]=3 12713 B14R1.598 CCNC(=O)NCc1ccccc1O 273464a_100000185550_100015525214 [0,0,0,0,0,2|1,0,0]=3 12714 B14R1.598 CCNC(=O)NCc1ccccc1O 273464a_100015525214_100000185550 [0,0,0,0,0,2|1,0,0]=3 12715 B14R1.598 CCNC(=O)NCc1ccccc1O 512a_100000185550_100015525214 [0,0,0,0,0,2|1,0,0]=3 12716 B14R1.598 CCNC(=O)NNc1ccccc1Br 273464a_100015525214_100000241748 [0,0,0,0,0,2|2,0,0]=4 12717 B14R1.598 CCNC(=O)NNc1ccccc1Br 512a_100015525214_100000241748 [0,0,0,0,0,2|2,0,0]=4 12718 B14R1.598 CCNC(=O)NNc1ccccc1C 273464a_100015525214_100000184220 [0,0,0,0,0,2|2,0,0]=4 12719 B14R1.598 CCNC(=O)NNc1ccccc1C 512a_100015525214_100000184220 [0,0,0,0,0,2|2,0,0]=4 12720 B14R1.598 CCNC(=O)NNc1ccccc1Cl 273464a_100015525214_100000683529 [0,0,0,0,0,2|2,0,0]=4 12721 B14R1.598 CCNC(=O)NNc1ccccc1Cl 512a_100015525214_100000683529 [0,0,0,0,0,2|2,0,0]=4 12722 B14R1.598 CCNC(=O)NNc1ccccc1F 273464a_100015525214_100000239246 [0,0,0,0,0,2|2,0,0]=4 12723 B14R1.598 CCNC(=O)NNc1ccccc1F 512a_100015525214_100000239246 [0,0,0,0,0,2|2,0,0]=4 12724 B14R1.598 CCNC(=O)NNc1ccccc1I 273464a_100015525214_100011218156 [0,0,0,0,0,2|2,0,0]=4 12725 B14R1.598 CCNC(=O)NNc1ccccc1I 512a_100015525214_100011218156 [0,0,0,0,0,2|2,0,0]=4 12726 B14R1.598 CCOC(=O)/C=C/c1ccccc1O 271570a_203496583355_100016317929 [0,0,0,0,0,2|0,0,0]=2 12727 B14R1.598 CCOC(=O)/C=C/c1cccnc1O 271570a_203496583355_200020681690 [0,0,0,0,0,2|1,0,0]=3 12728 B14R1.598 CCOC(=O)C=Cc1c[nH]ccc1=O 271570a_100010199719_100009998708 [0,0,0,0,0,2|1,0,1]=4 12729 B14R1.598 CCOC(=O)C=Cc1c[nH]ccc1=S 271570a_100010199719_200012280681 [0,0,0,0,0,2|1,1,0]=4 12730 B14R1.598 CCOC(=O)C=Cc1ccc[nH]c1=O 271570a_100010199719_100000050042 [0,0,0,0,0,2|1,0,1]=4 12731 B14R1.598 CCOC(=O)C=Cc1cccc[n+]1C 271570a_100010199719_100000212160 [0,0,0,0,0,2|2,0,0]=4 12732 B14R1.598 CCOC(=O)C=Cc1cccc[n+]1[O-] 271570a_100010199719_200000042595 [0,0,0,0,0,2|1,0,1]=4 12733 B14R1.598 CCOC(=O)C=Cc1ccccc1Br 271570a_100010199719_100000695589 [0,0,0,0,0,2|1,0,0]=3 12734 B14R1.598 CCOC(=O)C=Cc1ccccc1C 271570a_100010199719_100000210755 [0,0,0,0,0,2|1,0,0]=3 12735 B14R1.598 CCOC(=O)C=Cc1ccccc1Cl 271570a_100010199719_100000764095 [0,0,0,0,0,2|1,0,0]=3 12736 B14R1.598 CCOC(=O)C=Cc1ccccc1F 271570a_100010199719_100011215700 [0,0,0,0,0,2|1,0,0]=3 12737 B14R1.598 CCOC(=O)C=Cc1ccccc1N 271570a_100010199719_100000210017 [0,0,0,0,0,2|1,0,0]=3 12738 B14R1.598 CCOC(=O)C=Cc1ccccc1O 271570a_100010199719_100000739446 [0,0,0,0,0,2|0,0,0]=2 12739 B14R1.598 CCOC(=O)C=Cc1cccnc1Br 271570a_100010199719_100010202626 [0,0,0,0,0,2|2,0,0]=4 12740 B14R1.598 CCOC(=O)C=Cc1cccnc1C 271570a_100010199719_100000751574 [0,0,0,0,0,2|2,0,0]=4 12741 B14R1.598 CCOC(=O)C=Cc1cccnc1Cl 271570a_100010199719_100000036424 [0,0,0,0,0,2|2,0,0]=4 12742 B14R1.598 CCOC(=O)C=Cc1cccnc1F 271570a_100010199719_100009816115 [0,0,0,0,0,2|2,0,0]=4 12743 B14R1.598 CCOC(=O)C=Cc1cccnc1N 271570a_100010199719_100000045569 [0,0,0,0,0,2|2,0,0]=4 12744 B14R1.598 CCOC(=O)C=Cc1ccncc1Br 271570a_100010199719_100000726257 [0,0,0,0,0,2|2,0,0]=4 12745 B14R1.598 CCOC(=O)C=Cc1ccncc1C 271570a_100010199719_100015191297 [0,0,0,0,0,2|2,0,0]=4 12746 B14R1.598 CCOC(=O)C=Cc1ccncc1Cl 271570a_100010199719_100000708259 [0,0,0,0,0,2|2,0,0]=4 12747 B14R1.598 CCOC(=O)C=Cc1ccncc1F 271570a_100010199719_100000047030 [0,0,0,0,0,2|2,0,0]=4 12748 B14R1.598 CCOC(=O)C=Cc1ccncc1N 271570a_100010199719_100009815883 [0,0,0,0,0,2|2,0,0]=4 12749 B14R1.598 CCOC(=O)C=Cc1ccncc1O 271570a_100010199719_100009817591 [0,0,0,0,0,2|1,0,0]=3 12750 B14R1.598 CCOC(=O)C=Cc1cnccc1Br 271570a_100010199719_100010138639 [0,0,0,0,0,2|2,0,0]=4 12751 B14R1.598 CCOC(=O)C=Cc1cnccc1C 271570a_100010199719_100000761580 [0,0,0,0,0,2|2,0,0]=4 12752 B14R1.598 CCOC(=O)C=Cc1cnccc1Cl 271570a_100010199719_100009995489 [0,0,0,0,0,2|2,0,0]=4 12753 B14R1.598 CCOC(=O)C=Cc1cnccc1F 271570a_100010199719_100009820683 [0,0,0,0,0,2|2,0,0]=4 12754 B14R1.598 CCOC(=O)C=Cc1cnccc1N 271570a_100010199719_100000047001 [0,0,0,0,0,2|2,0,0]=4 12755 B14R1.598 CCOC(=O)C=Cc1cncnc1O 271570a_100010199719_100000751107 [0,0,0,0,0,2|2,0,0]=4 12756 B14R1.598 CCOC(=O)C=Cc1ncccc1Br 271570a_100010199719_100000696092 [0,0,0,0,0,2|2,0,0]=4 12757 B14R1.598 CCOC(=O)C=Cc1ncccc1C 271570a_100010199719_100000751373 [0,0,0,0,0,2|2,0,0]=4 12758 B14R1.598 CCOC(=O)C=Cc1ncccc1Cl 271570a_100010199719_100011356963 [0,0,0,0,0,2|2,0,0]=4 12759 B14R1.598 CCOC(=O)C=Cc1ncccc1F 271570a_100010199719_100000685392 [0,0,0,0,0,2|2,0,0]=4 12760 B14R1.598 CCOC(=O)C=Cc1ncccc1N 271570a_100010199719_100000688686 [0,0,0,0,0,2|2,0,0]=4 12761 B14R1.598 CCOC(=O)C=Cc1ncccc1O 271570a_100010199719_100000034122 [0,0,0,0,0,2|1,0,0]=3 12762 B14R1.598 CCOC(=O)CCc1ccccc1O 271570a_203496583355_100009815309 [0,0,0,0,0,2|0,0,0]=2 12763 B14R1.598 CCOC(=O)CNc1ccccc1Br 34a_100000210017_100000188475 [0,0,0,0,0,2|1,0,0]=3 12764 B14R1.598 CCOC(=O)CNc1ccccc1C 34a_100015192222_100000188475 [0,0,0,0,0,2|1,0,0]=3 12765 B14R1.598 CCOC(=O)CNc1ccccc1Cl 34a_100000185783_100000188475 [0,0,0,0,0,2|1,0,0]=3 12766 B14R1.598 CCOC(=O)CNc1ccccc1F 34a_100000210422_100000188475 [0,0,0,0,0,2|1,0,0]=3 12767 B14R1.598 CCOC(=O)CNc1ccccc1I 34a_100000210053_100000188475 [0,0,0,0,0,2|1,0,0]=3 12768 B14R1.598 CCOC(=O)CNc1ccccc1O 34a_100000185747_100000188475 [0,0,0,0,0,2|0,0,0]=2 12769 B14R1.598 CCOC(=O)COc1cccc[n+]1[O-] 7a_100000211761_100000188475 [0,0,0,0,0,2|1,0,1]=4 12770 B14R1.598 CCOC(=O)COc1ccccc1Br 34a_100000181306_100000188475 [0,0,0,0,0,2|1,0,0]=3 12771 B14R1.598 CCOC(=O)COc1ccccc1Br 7a_100000181306_100000188475 [0,0,0,0,0,2|1,0,0]=3 12772 B14R1.598 CCOC(=O)COc1ccccc1C 34a_100000210338_100000188475 [0,0,0,0,0,2|1,0,0]=3 12773 B14R1.598 CCOC(=O)COc1ccccc1C 7a_100000210338_100000188475 [0,0,0,0,0,2|1,0,0]=3 12774 B14R1.598 CCOC(=O)COc1ccccc1Cl 34a_100000210172_100000188475 [0,0,0,0,0,2|1,0,0]=3 12775 B14R1.598 CCOC(=O)COc1ccccc1Cl 7a_100000210172_100000188475 [0,0,0,0,0,2|1,0,0]=3 12776 B14R1.598 CCOC(=O)COc1ccccc1F 34a_100000210171_100000188475 [0,0,0,0,0,2|1,0,0]=3 12777 B14R1.598 CCOC(=O)COc1ccccc1F 7a_100000210171_100000188475 [0,0,0,0,0,2|1,0,0]=3 12778 B14R1.598 CCOC(=O)COc1ccccc1I 34a_100000739446_100000188475 [0,0,0,0,0,2|1,0,0]=3 12779 B14R1.598 CCOC(=O)COc1ccccc1I 7a_100000739446_100000188475 [0,0,0,0,0,2|1,0,0]=3 12780 B14R1.598 CCOC(=O)COc1ccccc1N 34a_100000185747_100000188475 [0,0,0,0,0,2|1,0,0]=3 12781 B14R1.598 CCOC(=O)COc1ccccc1N 7a_100000185747_100000188475 [0,0,0,0,0,2|1,0,0]=3 12782 B14R1.598 CCOC(=O)COc1ccccc1O 271570a_203496583355_100000174061 [0,0,0,0,0,2|0,0,0]=2 12783 B14R1.598 CCOC(=O)COc1cccnc1Br 34a_100000744436_100000188475 [0,0,0,0,0,2|2,0,0]=4 12784 B14R1.598 CCOC(=O)COc1cccnc1Br 7a_100000744436_100000188475 [0,0,0,0,0,2|2,0,0]=4 12785 B14R1.598 CCOC(=O)COc1cccnc1C 34a_100000745507_100000188475 [0,0,0,0,0,2|2,0,0]=4 12786 B14R1.598 CCOC(=O)COc1cccnc1C 7a_100000745507_100000188475 [0,0,0,0,0,2|2,0,0]=4 12787 B14R1.598 CCOC(=O)COc1cccnc1Cl 34a_100000757616_100000188475 [0,0,0,0,0,2|2,0,0]=4 12788 B14R1.598 CCOC(=O)COc1cccnc1Cl 7a_100000757616_100000188475 [0,0,0,0,0,2|2,0,0]=4 12789 B14R1.598 CCOC(=O)COc1cccnc1F 34a_100000061740_100000188475 [0,0,0,0,0,2|2,0,0]=4 12790 B14R1.598 CCOC(=O)COc1cccnc1F 7a_100000061740_100000188475 [0,0,0,0,0,2|2,0,0]=4 12791 B14R1.598 CCOC(=O)COc1cccnc1I 34a_100000034122_100000188475 [0,0,0,0,0,2|2,0,0]=4 12792 B14R1.598 CCOC(=O)COc1cccnc1I 7a_100000034122_100000188475 [0,0,0,0,0,2|2,0,0]=4 12793 B14R1.598 CCOC(=O)COc1cccnc1N 34a_100000211975_100000188475 [0,0,0,0,0,2|2,0,0]=4 12794 B14R1.598 CCOC(=O)COc1cccnc1N 7a_100000211975_100000188475 [0,0,0,0,0,2|2,0,0]=4 12795 B14R1.598 CCOC(=O)COc1cccoc1=O 34a_100000077404_100000188475 [0,0,0,0,0,2|1,0,1]=4 12796 B14R1.598 CCOC(=O)COc1cccoc1=O 7a_100000077404_100000188475 [0,0,0,0,0,2|1,0,1]=4 12797 B14R1.598 CCOC(=O)COc1ccncc1Br 34a_100011996408_100000188475 [0,0,0,0,0,2|2,0,0]=4 12798 B14R1.598 CCOC(=O)COc1ccncc1C 34a_100000694293_100000188475 [0,0,0,0,0,2|2,0,0]=4 12799 B14R1.598 CCOC(=O)COc1ccncc1Cl 34a_100011997054_100000188475 [0,0,0,0,0,2|2,0,0]=4 12800 B14R1.598 CCOC(=O)COc1ccncc1F 34a_200000081243_100000188475 [0,0,0,0,0,2|2,0,0]=4 12801 B14R1.598 CCOC(=O)COc1cnccc1C 34a_100011997053_100000188475 [0,0,0,0,0,2|2,0,0]=4 12802 B14R1.598 CCOC(=O)COc1cnccc1C 7a_100011997053_100000188475 [0,0,0,0,0,2|2,0,0]=4 12803 B14R1.598 CCOC(=O)COc1cnccc1Cl 34a_100011996695_100000188475 [0,0,0,0,0,2|2,0,0]=4 12804 B14R1.598 CCOC(=O)COc1cnccc1I 34a_100000050107_100000188475 [0,0,0,0,0,2|2,0,0]=4 12805 B14R1.598 CCOC(=O)COc1cnccc1N 34a_100000753702_100000188475 [0,0,0,0,0,2|2,0,0]=4 12806 B14R1.598 CCOC(=O)COc1coccc1=O 34a_100000060831_100000188475 [0,0,0,0,0,2|1,0,1]=4 12807 B14R1.598 CCOC(=O)COc1ncccc1Cl 34a_100011290957_100000188475 [0,0,0,0,0,2|2,0,0]=4 12808 B14R1.598 CCOC(=O)COc1ncccc1F 34a_100011219419_100000188475 [0,0,0,0,0,2|2,0,0]=4 12809 B14R1.598 CCOC(=O)COc1ncccc1N 34a_100000746358_100000188475 [0,0,0,0,0,2|2,0,0]=4 12810 B14R1.598 CCOC(=O)CSc1c[nH]ccc1=O 62a_100000188475_100009998708 [0,0,0,0,0,2|1,0,1]=4 12811 B14R1.598 CCOC(=O)CSc1c[nH]ccc1=O 62a_100009998708_100000188475 [0,0,0,0,0,2|1,0,1]=4 12812 B14R1.598 CCOC(=O)CSc1c[nH]ccc1=S 62a_100000188475_200012280681 [0,0,0,0,0,2|1,1,0]=4 12813 B14R1.598 CCOC(=O)CSc1c[nH]ccc1=S 62a_200012280681_100000188475 [0,0,0,0,0,2|1,1,0]=4 12814 B14R1.598 CCOC(=O)CSc1cccc[n+]1C 62a_100000188475_100000212160 [0,0,0,0,0,2|2,0,0]=4 12815 B14R1.598 CCOC(=O)CSc1cccc[n+]1[O-] 62a_100000188475_200000042595 [0,0,0,0,0,2|1,0,1]=4 12816 B14R1.598 CCOC(=O)CSc1ccccc1Br 62a_100000188475_100000695589 [0,0,0,0,0,2|1,0,0]=3 12817 B14R1.598 CCOC(=O)CSc1ccccc1Br 62a_100000695589_100000188475 [0,0,0,0,0,2|1,0,0]=3 12818 B14R1.598 CCOC(=O)CSc1ccccc1C 62a_100000188475_100000210755 [0,0,0,0,0,2|1,0,0]=3 12819 B14R1.598 CCOC(=O)CSc1ccccc1C 62a_100000210755_100000188475 [0,0,0,0,0,2|1,0,0]=3 12820 B14R1.598 CCOC(=O)CSc1ccccc1Cl 62a_100000188475_100000764095 [0,0,0,0,0,2|1,0,0]=3 12821 B14R1.598 CCOC(=O)CSc1ccccc1Cl 62a_100000764095_100000188475 [0,0,0,0,0,2|1,0,0]=3 12822 B14R1.598 CCOC(=O)CSc1ccccc1F 62a_100000188475_100011215700 [0,0,0,0,0,2|1,0,0]=3 12823 B14R1.598 CCOC(=O)CSc1ccccc1F 62a_100011215700_100000188475 [0,0,0,0,0,2|1,0,0]=3 12824 B14R1.598 CCOC(=O)CSc1ccccc1N 62a_100000188475_100000210017 [0,0,0,0,0,2|1,0,0]=3 12825 B14R1.598 CCOC(=O)CSc1ccccc1N 62a_100000210017_100000188475 [0,0,0,0,0,2|1,0,0]=3 12826 B14R1.598 CCOC(=O)CSc1ccccc1O 62a_100000188475_100000739446 [0,0,0,0,0,2|0,0,0]=2 12827 B14R1.598 CCOC(=O)CSc1ccccc1O 62a_100000739446_100000188475 [0,0,0,0,0,2|0,0,0]=2 12828 B14R1.598 CCOC(=O)CSc1cccnc1Br 62a_100000188475_100010202626 [0,0,0,0,0,2|2,0,0]=4 12829 B14R1.598 CCOC(=O)CSc1cccnc1Br 62a_100010202626_100000188475 [0,0,0,0,0,2|2,0,0]=4 12830 B14R1.598 CCOC(=O)CSc1cccnc1C 62a_100000188475_100000751574 [0,0,0,0,0,2|2,0,0]=4 12831 B14R1.598 CCOC(=O)CSc1cccnc1C 62a_100000751574_100000188475 [0,0,0,0,0,2|2,0,0]=4 12832 B14R1.598 CCOC(=O)CSc1cccnc1Cl 62a_100000036424_100000188475 [0,0,0,0,0,2|2,0,0]=4 12833 B14R1.598 CCOC(=O)CSc1cccnc1Cl 62a_100000188475_100000036424 [0,0,0,0,0,2|2,0,0]=4 12834 B14R1.598 CCOC(=O)CSc1cccnc1F 62a_100000188475_100009816115 [0,0,0,0,0,2|2,0,0]=4 12835 B14R1.598 CCOC(=O)CSc1cccnc1F 62a_100009816115_100000188475 [0,0,0,0,0,2|2,0,0]=4 12836 B14R1.598 CCOC(=O)CSc1cccnc1N 62a_100000045569_100000188475 [0,0,0,0,0,2|2,0,0]=4 12837 B14R1.598 CCOC(=O)CSc1cccnc1N 62a_100000188475_100000045569 [0,0,0,0,0,2|2,0,0]=4 12838 B14R1.598 CCOC(=O)CSc1cccnc1O 62a_100000188475_100000760158 [0,0,0,0,0,2|1,0,0]=3 12839 B14R1.598 CCOC(=O)CSc1cccnc1O 62a_100000760158_100000188475 [0,0,0,0,0,2|1,0,0]=3 12840 B14R1.598 CCOC(=O)CSc1ccncc1Br 62a_100000188475_100000726257 [0,0,0,0,0,2|2,0,0]=4 12841 B14R1.598 CCOC(=O)CSc1ccncc1Br 62a_100000726257_100000188475 [0,0,0,0,0,2|2,0,0]=4 12842 B14R1.598 CCOC(=O)CSc1ccncc1C 62a_100000188475_100000765111 [0,0,0,0,0,2|2,0,0]=4 12843 B14R1.598 CCOC(=O)CSc1ccncc1C 62a_100000765111_100000188475 [0,0,0,0,0,2|2,0,0]=4 12844 B14R1.598 CCOC(=O)CSc1ccncc1Cl 62a_100000188475_100000708259 [0,0,0,0,0,2|2,0,0]=4 12845 B14R1.598 CCOC(=O)CSc1ccncc1Cl 62a_100000708259_100000188475 [0,0,0,0,0,2|2,0,0]=4 12846 B14R1.598 CCOC(=O)CSc1ccncc1F 62a_100000047030_100000188475 [0,0,0,0,0,2|2,0,0]=4 12847 B14R1.598 CCOC(=O)CSc1ccncc1F 62a_100000188475_100000047030 [0,0,0,0,0,2|2,0,0]=4 12848 B14R1.598 CCOC(=O)CSc1ccncc1N 62a_100000188475_100000756074 [0,0,0,0,0,2|2,0,0]=4 12849 B14R1.598 CCOC(=O)CSc1ccncc1N 62a_100000756074_100000188475 [0,0,0,0,0,2|2,0,0]=4 12850 B14R1.598 CCOC(=O)CSc1ccncc1O 62a_100000188475_100009817591 [0,0,0,0,0,2|1,0,0]=3 12851 B14R1.598 CCOC(=O)CSc1ccncc1O 62a_100009817591_100000188475 [0,0,0,0,0,2|1,0,0]=3 12852 B14R1.598 CCOC(=O)CSc1cnccc1Br 62a_100000188475_100010138639 [0,0,0,0,0,2|2,0,0]=4 12853 B14R1.598 CCOC(=O)CSc1cnccc1Br 62a_100010138639_100000188475 [0,0,0,0,0,2|2,0,0]=4 12854 B14R1.598 CCOC(=O)CSc1cnccc1C 62a_100000188475_100000761580 [0,0,0,0,0,2|2,0,0]=4 12855 B14R1.598 CCOC(=O)CSc1cnccc1C 62a_100000761580_100000188475 [0,0,0,0,0,2|2,0,0]=4 12856 B14R1.598 CCOC(=O)CSc1cnccc1Cl 62a_100000188475_100009995489 [0,0,0,0,0,2|2,0,0]=4 12857 B14R1.598 CCOC(=O)CSc1cnccc1Cl 62a_100009995489_100000188475 [0,0,0,0,0,2|2,0,0]=4 12858 B14R1.598 CCOC(=O)CSc1cnccc1F 62a_100000188475_100009820683 [0,0,0,0,0,2|2,0,0]=4 12859 B14R1.598 CCOC(=O)CSc1cnccc1F 62a_100009820683_100000188475 [0,0,0,0,0,2|2,0,0]=4 12860 B14R1.598 CCOC(=O)CSc1cnccc1N 62a_100000047001_100000188475 [0,0,0,0,0,2|2,0,0]=4 12861 B14R1.598 CCOC(=O)CSc1cnccc1N 62a_100000188475_100000047001 [0,0,0,0,0,2|2,0,0]=4 12862 B14R1.598 CCOC(=O)CSc1cncnc1O 62a_100000188475_100000751107 [0,0,0,0,0,2|2,0,0]=4 12863 B14R1.598 CCOC(=O)CSc1cncnc1O 62a_100000751107_100000188475 [0,0,0,0,0,2|2,0,0]=4 12864 B14R1.598 CCOC(=O)CSc1ncccc1Br 62a_100000188475_100000696092 [0,0,0,0,0,2|2,0,0]=4 12865 B14R1.598 CCOC(=O)CSc1ncccc1Br 62a_100000696092_100000188475 [0,0,0,0,0,2|2,0,0]=4 12866 B14R1.598 CCOC(=O)CSc1ncccc1C 62a_100000188475_100000751373 [0,0,0,0,0,2|2,0,0]=4 12867 B14R1.598 CCOC(=O)CSc1ncccc1C 62a_100000751373_100000188475 [0,0,0,0,0,2|2,0,0]=4 12868 B14R1.598 CCOC(=O)CSc1ncccc1Cl 62a_100000188475_100011356963 [0,0,0,0,0,2|2,0,0]=4 12869 B14R1.598 CCOC(=O)CSc1ncccc1Cl 62a_100011356963_100000188475 [0,0,0,0,0,2|2,0,0]=4 12870 B14R1.598 CCOC(=O)CSc1ncccc1F 62a_100000188475_100000685392 [0,0,0,0,0,2|2,0,0]=4 12871 B14R1.598 CCOC(=O)CSc1ncccc1F 62a_100000685392_100000188475 [0,0,0,0,0,2|2,0,0]=4 12872 B14R1.598 CCOC(=O)CSc1ncccc1N 62a_100000188475_100000688686 [0,0,0,0,0,2|2,0,0]=4 12873 B14R1.598 CCOC(=O)CSc1ncccc1N 62a_100000688686_100000188475 [0,0,0,0,0,2|2,0,0]=4 12874 B14R1.598 CCOC(=O)CSc1ncccc1O 62a_100000034122_100000188475 [0,0,0,0,0,2|1,0,0]=3 12875 B14R1.598 CCOC(=O)CSc1ncccc1O 62a_100000188475_100000034122 [0,0,0,0,0,2|1,0,0]=3 12876 B14R1.598 CCOC(=S)SCc1cccnc1O 271570a_203496583355_200160468918 [0,0,0,0,0,2|1,1,0]=4 12877 B14R1.598 CNNC(=O)C=Cc1ccccc1O 22a_100016993582_100016263591 [0,0,0,0,0,2|2,0,0]=4 12878 B14R1.598 CNNC(=O)CCc1ccccc1O 22a_100016993582_100000181328 [0,0,0,0,0,2|2,0,0]=4 12879 B14R1.598 CNNC(=O)COc1ccccc1O 22a_100016993582_100000183020 [0,0,0,0,0,2|2,0,0]=4 12880 B14R1.598 CNNC(=O)CSc1ccccc1O 22a_100016993582_100000695322 [0,0,0,0,0,2|2,0,0]=4 12881 B14R1.598 CNNC(=O)NCc1ccccc1O 273464a_100000185550_100016993582 [0,0,0,0,0,2|2,0,0]=4 12882 B14R1.598 CNNC(=O)NCc1ccccc1O 512a_100000185550_100016993582 [0,0,0,0,0,2|2,0,0]=4 12883 B14R1.598 COCC(=O)CCc1ccccc1O 1458a_100000210968_100000722297 [0,0,0,0,0,2|2,0,0]=4 12884 B14R1.598 COCC(=O)NCc1ccccc1O 240690a_100000185550_100000210968 [0,0,0,0,0,2|2,0,0]=4 12885 B14R1.598 COCC(=O)NCc1ccccc1O 527a_100000185550_100000210968 [0,0,0,0,0,2|2,0,0]=4 12886 B14R1.598 CSCC(=O)CCc1ccccc1O 1458a_100000184570_100000722297 [0,0,0,0,0,2|2,0,0]=4 12887 B14R1.598 CSCC(=O)NCc1ccccc1O 240690a_100000185550_100000184570 [0,0,0,0,0,2|2,0,0]=4 12888 B14R1.598 CSCC(=O)NCc1ccccc1O 527a_100000185550_100000184570 [0,0,0,0,0,2|2,0,0]=4 12889 B14R1.598 O=C(C=Cc1ccccc1O)CCF 1458a_100016263591_100011217306 [0,0,0,0,0,2|2,0,0]=4 12890 B14R1.598 O=C(C=Cc1ccccc1O)CCO 1458a_100016263591_100000211926 [0,0,0,0,0,2|2,0,0]=4 12891 B14R1.598 O=C(CCF)CCc1ccccc1O 1458a_100000181328_100011217306 [0,0,0,0,0,2|2,0,0]=4 12892 B14R1.598 O=C(CCF)COc1ccccc1O 1458a_100000183020_100011217306 [0,0,0,0,0,2|2,0,0]=4 12893 B14R1.598 O=C(CCF)CSc1ccccc1O 1458a_100000695322_100011217306 [0,0,0,0,0,2|2,0,0]=4 12894 B14R1.598 O=C(CCO)CCc1ccccc1O 1458a_100000181328_100000211926 [0,0,0,0,0,2|2,0,0]=4 12895 B14R1.598 O=C(CCO)CCc1ccccc1O 1458a_100011216618_100000722297 [0,0,0,0,0,2|2,0,0]=4 12896 B14R1.598 O=C(CCO)COc1ccccc1O 1458a_100000183020_100000211926 [0,0,0,0,0,2|2,0,0]=4 12897 B14R1.598 O=C(CCO)CSc1ccccc1O 1458a_100000695322_100000211926 [0,0,0,0,0,2|2,0,0]=4 12898 B14R1.598 O=C(CCO)NCc1ccccc1O 240690a_100000185550_100011216618 [0,0,0,0,0,2|2,0,0]=4 12899 B14R1.598 O=C(CNc1ccccc1O)NCO 34a_100000185747_100000185155 [0,0,0,0,0,2|2,0,0]=4 12900 B14R1.598 O=C(CSc1ccccc1O)NCO 62a_100000185155_100000739446 [0,0,0,0,0,2|2,0,0]=4 12901 B14R1.598 O=C(CSc1ccccc1O)NCO 62a_100000739446_100000185155 [0,0,0,0,0,2|2,0,0]=4