0 B14R1.744 CC(=Cc1ccccc1C(=O)NN)C 271570a_100102525489_100000190081 [0,0,0,0,0,0|4,0,0]=4 1 B14R1.744 CC(C)Sc1ccccc1C(=O)O[Na] 62a_100000210206_114855342371 [0,0,0,0,0,0|3,0,1]=4 2 B14R1.744 CCC(=O)c1ccccc1CN(C)C 1458a_100000743624_100000210202 [0,0,0,0,0,0|4,0,0]=4 3 B14R1.744 CCC(=O)c1ccccc1OC(C)C 1458a_100000244644_100000210202 [0,0,0,0,0,0|3,0,1]=4 4 B14R1.744 CCC(=O)c1ccccc1OC(C)C 7a_100000184720_100000210206 [0,0,0,0,0,0|3,0,1]=4 5 B14R1.744 CCC(=O)c1ccccc1SC(C)C 1458a_100000229993_100000210202 [0,0,0,0,0,0|3,0,1]=4 6 B14R1.744 CCC(C)c1ccccc1NC(=O)C 11a_200000211393_100015343762 [0,0,0,0,0,0|2,0,1]=3 7 B14R1.744 CCC(C)c1ccccc1NC(=O)C 1626a_200000211393_100015343762 [0,0,0,0,0,0|2,0,1]=3 8 B14R1.744 CCC(C)c1ccccc1NC(=O)C 22a_200000211393_100000070787 [0,0,0,0,0,0|2,0,1]=3 9 B14R1.744 CCN(C)c1ccccc1NC(=O)C 11a_103437849306_100015343762 [0,0,0,0,0,0|3,0,0]=3 10 B14R1.744 CCN(C)c1ccccc1NC(=O)C 1626a_103437849306_100015343762 [0,0,0,0,0,0|3,0,0]=3 11 B14R1.744 CCN(C)c1ccccc1NC(=O)C 22a_103437849306_100000070787 [0,0,0,0,0,0|3,0,0]=3 12 B14R1.744 CCN(C)c1ccccc1NC(=O)C 527a_103437849306_100103153847 [0,0,0,0,0,0|3,0,0]=3 13 B14R1.744 CNC(=O)c1ccccc1C=C(C)C 271570a_100102525489_100000155073 [0,0,0,0,0,0|3,0,0]=3 14 B14R1.744 CNC(=O)c1ccccc1CN(C)C 1626a_100102657272_100000743624 [0,0,0,0,0,0|4,0,0]=4 15 B14R1.744 CNC(=O)c1ccccc1CN(C)C 240690a_100102657272_100000743624 [0,0,0,0,0,0|4,0,0]=4 16 B14R1.744 CNC(=O)c1ccccc1NC(=O)C 11a_100000185696_100015343762 [0,0,0,0,0,0|1,0,0]=1 17 B14R1.744 CNC(=O)c1ccccc1NC(=O)C 1626a_100000185696_100015343762 [0,0,0,0,0,0|1,0,0]=1 18 B14R1.744 CNC(=O)c1ccccc1NC(=O)C 22a_100000185696_100000070787 [0,0,0,0,0,0|1,0,0]=1 19 B14R1.744 CNC(=O)c1ccccc1NC(C)C 27a_100138425928_100000155073 [0,0,0,0,0,0|2,0,1]=3 20 B14R1.744 CNC(=O)c1ccccc1NC(C)C 34a_100000185696_100000210206 [0,0,0,0,0,0|2,0,1]=3 21 B14R1.744 CNC(=O)c1ccccc1OC(=O)C 240690a_100102657272_100000210466 [0,0,0,0,0,0|2,0,0]=2 22 B14R1.744 CNC(=O)c1ccccc1OC(C)C 11a_106832991635_100000244644 [0,0,0,0,0,0|3,0,1]=4 23 B14R1.744 CNC(=O)c1ccccc1OC(C)C 1626a_100102657272_100000244644 [0,0,0,0,0,0|3,0,1]=4 24 B14R1.744 CNC(=O)c1ccccc1OC(C)C 240690a_100102657272_100000244644 [0,0,0,0,0,0|3,0,1]=4 25 B14R1.744 CNC(=O)c1ccccc1OC(C)C 34a_100000185920_100000210206 [0,0,0,0,0,0|3,0,1]=4 26 B14R1.744 CNC(=O)c1ccccc1OC(C)C 527a_100102657272_100000244644 [0,0,0,0,0,0|3,0,1]=4 27 B14R1.744 CNC(=O)c1ccccc1OC(C)C 7a_100000185920_100000210206 [0,0,0,0,0,0|3,0,1]=4 28 B14R1.744 CNC(=O)c1ccccc1SC(C)C 11a_106832991635_100000229993 [0,0,0,0,0,0|3,0,1]=4 29 B14R1.744 CNC(=O)c1ccccc1SC(C)C 1626a_100102657272_100000229993 [0,0,0,0,0,0|3,0,1]=4 30 B14R1.744 CNC(=O)c1ccccc1SC(C)C 240690a_100102657272_100000229993 [0,0,0,0,0,0|3,0,1]=4 31 B14R1.744 CNC(=O)c1ccccc1SC(C)C 527a_100102657272_100000229993 [0,0,0,0,0,0|3,0,1]=4 32 B14R1.744 CNC(=O)c1ccccc1SC(C)C 62a_100000155073_100000210206 [0,0,0,0,0,0|3,0,1]=4 33 B14R1.744 CNC(=O)c1ccccc1SC(C)C 62a_100000210206_100000155073 [0,0,0,0,0,0|3,0,1]=4 34 B14R1.744 CNC(=O)c1cccnc1C=C(C)C 271570a_100102525489_100000159833 [0,0,0,0,0,0|4,0,0]=4 35 B14R1.744 CNC(=O)c1cccnc1NC(C)C 27a_100138425928_100000159833 [0,0,0,0,0,0|3,0,1]=4 36 B14R1.744 CNC(C)c1ccccc1NC(=O)C 269862a_106832991636_100000153761 [0,0,0,0,0,0|2,0,1]=3 37 B14R1.744 COC(=O)c1ccccc1C=C(C)C 271570a_100102525489_100000148710 [0,0,0,0,0,0|2,0,0]=2 38 B14R1.744 COC(=O)c1ccccc1CC(=O)C 1458a_100000070787_100000744672 [0,0,0,0,0,0|1,0,0]=1 39 B14R1.744 COC(=O)c1ccccc1CC(=O)C 1458a_100000695166_200000210301 [0,0,0,0,0,0|1,0,0]=1 40 B14R1.744 COC(=O)c1ccccc1CC(=O)[13CH3] 1458a_100000695166_200025704644 [0,0,0,0,0,0|1,0,0]=1 41 B14R1.744 COC(=O)c1ccccc1CN(C)C 2230a_100102631434_100000744672 [0,0,0,0,0,0|3,0,0]=3 42 B14R1.744 COC(=O)c1ccccc1CN(C)C 269982a_100102631434_100000744672 [0,0,0,0,0,0|3,0,0]=3 43 B14R1.744 COC(=O)c1ccccc1OC(C)C 7a_100000150335_100000210206 [0,0,0,0,0,0|2,0,1]=3 44 B14R1.744 COC(=O)c1ccccc1SC(C)C 62a_100000148710_100000210206 [0,0,0,0,0,0|2,0,1]=3 45 B14R1.744 COC(=O)c1ccccc1SC(C)C 62a_100000210206_100000148710 [0,0,0,0,0,0|2,0,1]=3 46 B14R1.744 COC(=O)c1cccnc1C=C(C)C 271570a_100102525489_100000150852 [0,0,0,0,0,0|3,0,0]=3 47 B14R1.744 COC(=O)c1cccnc1CC(=O)C 1458a_100000070787_100000709840 [0,0,0,0,0,0|2,0,0]=2 48 B14R1.744 COC(=O)c1cccnc1CN(C)C 2230a_100102631434_100000709840 [0,0,0,0,0,0|4,0,0]=4 49 B14R1.744 COC(=O)c1cccnc1CN(C)C 269982a_100102631434_100012347567 [0,0,0,0,0,0|4,0,0]=4 50 B14R1.744 COC(=O)c1cccnc1NC(C)C 27a_100138425928_100000150852 [0,0,0,0,0,0|2,0,1]=3 51 B14R1.744 COC(=O)c1cccnc1SC(C)C 62a_100000210206_100000150852 [0,0,0,0,0,0|3,0,1]=4 52 B14R1.744 COC(=O)c1cccnc1SC(C)C 62a_100011587185_100000210206 [0,0,0,0,0,0|3,0,1]=4 53 B14R1.744 COC(=O)c1ccncc1C=C(C)C 271570a_100102525489_100010008606 [0,0,0,0,0,0|3,0,0]=3 54 B14R1.744 COC(=O)c1ccncc1SC(C)C 62a_100000210206_100010008606 [0,0,0,0,0,0|3,0,1]=4 55 B14R1.744 COC(=O)c1ccncc1SC(C)C 62a_100010008606_100000210206 [0,0,0,0,0,0|3,0,1]=4 56 B14R1.744 COC(=O)c1cnccc1C=C(C)C 271570a_100102525489_100020629055 [0,0,0,0,0,0|3,0,0]=3 57 B14R1.744 COC(=O)c1cnccc1SC(C)C 62a_100000210206_100020629055 [0,0,0,0,0,0|3,0,1]=4 58 B14R1.744 COC(=O)c1cnccc1SC(C)C 62a_100020629055_100000210206 [0,0,0,0,0,0|3,0,1]=4 59 B14R1.744 COC(=O)c1cncnc1C=C(C)C 271570a_100102525489_100000726419 [0,0,0,0,0,0|4,0,0]=4 60 B14R1.744 COC(=O)c1cncnc1NC(C)C 27a_100138425928_100000726419 [0,0,0,0,0,0|3,0,1]=4 61 B14R1.744 COC(=O)c1ncccc1C=C(C)C 271570a_100102525489_100011935214 [0,0,0,0,0,0|3,0,0]=3 62 B14R1.744 COC(=O)c1ncccc1CC(=O)C 1458a_100000070787_100010177730 [0,0,0,0,0,0|2,0,0]=2 63 B14R1.744 COC(=O)c1ncccc1CN(C)C 2230a_100102631434_100010177730 [0,0,0,0,0,0|4,0,0]=4 64 B14R1.744 COC(=O)c1ncccc1CN(C)C 269982a_100102631434_100010177730 [0,0,0,0,0,0|4,0,0]=4 65 B14R1.744 COC(=O)c1ncccc1OC(C)C 34a_100000744052_100000210206 [0,0,0,0,0,0|3,0,1]=4 66 B14R1.744 COC(=O)c1ncccc1OC(C)C 7a_100000744052_100000210206 [0,0,0,0,0,0|3,0,1]=4 67 B14R1.744 COC(=O)c1ncccc1SC(C)C 62a_100000210206_100011935214 [0,0,0,0,0,0|3,0,1]=4 68 B14R1.744 COC(=O)c1ncccc1SC(C)C 62a_100011935214_100000210206 [0,0,0,0,0,0|3,0,1]=4 69 B14R1.744 COC(=O)c1nccnc1C=C(C)C 271570a_100102525489_100000688410 [0,0,0,0,0,0|4,0,0]=4 70 B14R1.744 COC(=O)c1nccnc1NC(C)C 27a_100138425928_100000079898 [0,0,0,0,0,0|3,0,1]=4 71 B14R1.744 COC(=O)c1ncncc1C=C(C)C 271570a_100102525489_100012360100 [0,0,0,0,0,0|4,0,0]=4 72 B13R1.380 C=C=Cc1ccccc1CC(=O)C 271570a_100015277604_100011350739 [1,0,0,0,0,0|2,0,1]=4 73 B13R1.380 C=C=Cc1ccccc1NC(=O)C 271570a_100015277604_100000153524 [1,0,0,0,0,0|1,0,1]=3 74 B13R1.380 C=C=Cc1ccccc1NC(=O)N 271570a_100015277604_100000742221 [1,0,0,0,0,0|2,0,1]=4 75 B13R1.380 C=C=Cc1ccccc1OC(=O)C 271570a_100015277604_100000051690 [1,0,0,0,0,0|2,0,1]=4 76 B13R1.380 C=C=Cc1cnccc1NC(=O)C 271570a_100015277604_100016132053 [1,0,0,0,0,0|2,0,1]=4 77 B13R1.380 C=CCc1ccccc1NC(=O)C 11a_200138433279_100015343762 [1,0,0,0,0,0|1,0,2]=4 78 B13R1.380 C=CCc1ccccc1NC(=O)C 1626a_200138433279_100015343762 [1,0,0,0,0,0|1,0,2]=4 79 B13R1.380 C=CCc1ccccc1NC(=O)C 22a_200138433279_100000070787 [1,0,0,0,0,0|1,0,2]=4 80 B13R1.380 C=CCc1ccccc1NC(=O)C 527a_200138433279_100103153847 [1,0,0,0,0,0|1,0,2]=4 81 B13R1.380 CC(=O)Nc1ccccc1CC#N 11a_100000032805_100015343762 [1,0,0,0,0,0|2,0,1]=4 82 B13R1.380 CC(=O)Nc1ccccc1CC#N 1626a_100000032805_100015343762 [1,0,0,0,0,0|2,0,1]=4 83 B13R1.380 CC(=O)Nc1ccccc1CC#N 22a_100000032805_100000070787 [1,0,0,0,0,0|2,0,1]=4 84 B13R1.380 CC(=O)Nc1ccccc1CCO 22a_100011215289_100000070787 [1,0,0,0,0,0|2,0,1]=4 85 B13R1.380 CC(=O)Nc1ccccc1CCO 527a_100011215289_100103153847 [1,0,0,0,0,0|2,0,1]=4 86 B13R1.380 CC(=O)Nc1ccccc1CO[13CH3] 34a_100000192217_200025704644 [1,0,0,0,0,0|0,0,1]=2 87 B13R1.380 CC(=O)Nc1ccccc1CO[13CH3] 7a_100000192217_200025704644 [1,0,0,0,0,0|0,0,1]=2 88 B13R1.380 CC(=O)Nc1ccccc1NCF 34a_100011193560_100015361967 [1,0,0,0,0,0|3,0,0]=4 89 B13R1.380 CC(=O)Nc1ccccc1OCF 34a_100000185124_100015361967 [1,0,0,0,0,0|3,0,0]=4 90 B13R1.380 CC(=O)Nc1ccccc1OCF 7a_100000185124_100015361967 [1,0,0,0,0,0|3,0,0]=4 91 B13R1.380 CC(=O)Nc1ccccc1SCF 62a_100015361967_100000153524 [1,0,0,0,0,0|3,0,0]=4 92 B13R1.380 CC=Cc1ccccc1CC(=O)C 271570a_100016259895_100011350739 [1,0,0,0,0,0|2,0,0]=3 93 B13R1.380 CC=Cc1ccccc1CC(=O)N 271570a_100016259895_200009814924 [1,0,0,0,0,0|3,0,0]=4 94 B13R1.380 CC=Cc1ccccc1NC(=O)C 271570a_100016259895_100000153524 [1,0,0,0,0,0|1,0,0]=2 95 B13R1.380 CC=Cc1ccccc1NC(=O)N 271570a_100016259895_100000742221 [1,0,0,0,0,0|2,0,0]=3 96 B13R1.380 CC=Cc1ccccc1NC(C)C 271570a_100016259895_100000219599 [1,0,0,0,0,0|2,0,1]=4 97 B13R1.380 CC=Cc1ccccc1OC(=O)C 271570a_100016259895_100000051690 [1,0,0,0,0,0|2,0,0]=3 98 B13R1.380 CC=Cc1cnccc1NC(=O)C 271570a_100016259895_100016132053 [1,0,0,0,0,0|2,0,0]=3 99 B13R1.380 CC=Cc1ncccc1OC(=O)C 271570a_100016259895_200009815371 [1,0,0,0,0,0|3,0,0]=4 100 B13R1.380 CCCc1ccccc1NC(=O)C 11a_100000737634_100015343762 [1,0,0,0,0,0|1,0,1]=3 101 B13R1.380 CCCc1ccccc1NC(=O)C 1626a_100000737634_100015343762 [1,0,0,0,0,0|1,0,1]=3 102 B13R1.380 CCCc1ccccc1NC(=O)C 22a_100000737634_100000070787 [1,0,0,0,0,0|1,0,1]=3 103 B13R1.380 CCCc1ccccc1NC(=O)C 527a_100000737634_100103153847 [1,0,0,0,0,0|1,0,1]=3 104 B13R1.380 CCNc1ccccc1NC(=O)C 34a_100011193560_100000210202 [1,0,0,0,0,0|2,0,0]=3 105 B13R1.380 CCOc1ccccc1CC(=O)C 1458a_100011247627_200000210301 [1,0,0,0,0,0|3,0,0]=4 106 B13R1.380 CCOc1ccccc1CC(=O)[13CH3] 1458a_100011247627_200025704644 [1,0,0,0,0,0|3,0,0]=4 107 B13R1.380 CCOc1ccccc1NC(=O)C 11a_100000211218_100015343762 [1,0,0,0,0,0|2,0,0]=3 108 B13R1.380 CCOc1ccccc1NC(=O)C 1626a_100000211218_100015343762 [1,0,0,0,0,0|2,0,0]=3 109 B13R1.380 CCOc1ccccc1NC(=O)C 22a_100000211218_100000070787 [1,0,0,0,0,0|2,0,0]=3 110 B13R1.380 CCOc1ccccc1NC(=O)C 34a_100000185124_100000210202 [1,0,0,0,0,0|2,0,0]=3 111 B13R1.380 CCOc1ccccc1NC(=O)C 7a_100000185124_100000210202 [1,0,0,0,0,0|2,0,0]=3 112 B13R1.380 CCOc1cccnc1NC(=O)C 34a_200000022013_100000210202 [1,0,0,0,0,0|3,0,0]=4 113 B13R1.380 CCOc1cccnc1NC(=O)C 7a_200000022013_100000210202 [1,0,0,0,0,0|3,0,0]=4 114 B13R1.380 CCSc1ccccc1CC(=O)C 62a_100000210202_100011350739 [1,0,0,0,0,0|3,0,0]=4 115 B13R1.380 CCSc1ccccc1CC(=O)C 62a_100011350739_100000210202 [1,0,0,0,0,0|3,0,0]=4 116 B13R1.380 CCSc1ccccc1NC(=O)C 11a_100011223125_100015343762 [1,0,0,0,0,0|2,0,0]=3 117 B13R1.380 CCSc1ccccc1NC(=O)C 1626a_100011223125_100015343762 [1,0,0,0,0,0|2,0,0]=3 118 B13R1.380 CCSc1ccccc1NC(=O)C 22a_100011223125_100000070787 [1,0,0,0,0,0|2,0,0]=3 119 B13R1.380 CCSc1ccccc1NC(=O)C 62a_100000210202_100000153524 [1,0,0,0,0,0|2,0,0]=3 120 B13R1.380 CCSc1ccccc1NC(=O)N 62a_100000210202_100000742221 [1,0,0,0,0,0|3,0,0]=4 121 B13R1.380 CCSc1ccccc1OC(=O)C 62a_100000051690_100000210202 [1,0,0,0,0,0|3,0,0]=4 122 B13R1.380 CCSc1ccccc1OC(=O)C 62a_100000210202_100000051690 [1,0,0,0,0,0|3,0,0]=4 123 B13R1.380 CCSc1cnccc1NC(=O)C 62a_100000210202_100016132053 [1,0,0,0,0,0|3,0,0]=4 124 B13R1.380 CNCc1ccccc1OC(=O)C 270004a_106832991635_100009864558 [1,0,0,0,0,0|2,0,1]=4 125 B13R1.380 COCc1ccccc1C=C(C)C 271570a_100102525489_100011493684 [1,0,0,0,0,0|2,0,1]=4 126 B13R1.380 COCc1ccccc1NC(=O)C 34a_100000192217_200000210301 [1,0,0,0,0,0|0,0,1]=2 127 B13R1.380 COCc1ccccc1NC(=O)C 7a_100000192217_200000210301 [1,0,0,0,0,0|0,0,1]=2 128 B13R1.382 C=C=Cc1ccccc1C(=O)OC 271570a_100015277604_100000148710 [1,0,0,0,0,0|1,0,2]=4 129 B13R1.382 CC=Cc1ccccc1C(=O)NC 271570a_100016259895_100000155073 [1,0,0,0,0,0|2,0,0]=3 130 B13R1.382 CC=Cc1ccccc1C(=O)NN 271570a_100016259895_100000190081 [1,0,0,0,0,0|3,0,0]=4 131 B13R1.382 CC=Cc1ccccc1C(=O)OC 271570a_100016259895_100000148710 [1,0,0,0,0,0|1,0,0]=2 132 B13R1.382 CC=Cc1cccnc1C(=O)OC 271570a_100016259895_100011935214 [1,0,0,0,0,0|2,0,0]=3 133 B13R1.382 CC=Cc1ccncc1C(=O)OC 271570a_100016259895_100020629055 [1,0,0,0,0,0|2,0,0]=3 134 B13R1.382 CC=Cc1cnccc1C(=O)OC 271570a_100016259895_100010008606 [1,0,0,0,0,0|2,0,0]=3 135 B13R1.382 CC=Cc1cncnc1C(=O)OC 271570a_100016259895_100012360100 [1,0,0,0,0,0|3,0,0]=4 136 B13R1.382 CC=Cc1ncccc1C(=O)NC 271570a_100016259895_100000159833 [1,0,0,0,0,0|3,0,0]=4 137 B13R1.382 CC=Cc1ncccc1C(=O)OC 271570a_100016259895_100000150852 [1,0,0,0,0,0|2,0,0]=3 138 B13R1.382 CC=Cc1nccnc1C(=O)OC 271570a_100016259895_100000688410 [1,0,0,0,0,0|3,0,0]=4 139 B13R1.382 CC=Cc1ncncc1C(=O)OC 271570a_100016259895_100000726419 [1,0,0,0,0,0|3,0,0]=4 140 B13R1.382 CCC(=O)c1ccccc1COC 1458a_100000737999_100000210202 [1,0,0,0,0,0|3,0,0]=4 141 B13R1.382 CCNc1ccccc1C(=O)NC 27a_100015525214_100000155073 [1,0,0,0,0,0|1,0,1]=3 142 B13R1.382 CCNc1ccccc1C(=O)NC 34a_100000185696_100000210202 [1,0,0,0,0,0|1,0,1]=3 143 B13R1.382 CCNc1ncccc1C(=O)NC 27a_100015525214_100000159833 [1,0,0,0,0,0|2,0,1]=4 144 B13R1.382 CCNc1ncccc1C(=O)OC 27a_100015525214_100000150852 [1,0,0,0,0,0|1,0,1]=3 145 B13R1.382 CCNc1nccnc1C(=O)OC 27a_100015525214_100000079898 [1,0,0,0,0,0|2,0,1]=4 146 B13R1.382 CCNc1ncncc1C(=O)OC 27a_100015525214_100000726419 [1,0,0,0,0,0|2,0,1]=4 147 B13R1.382 CCOc1ccccc1C(=O)CC 1458a_100000211144_100000210202 [1,0,0,0,0,0|2,0,1]=4 148 B13R1.382 CCOc1ccccc1C(=O)CC 7a_100000184720_100000210202 [1,0,0,0,0,0|2,0,1]=4 149 B13R1.382 CCOc1ccccc1C(=O)NC 11a_106832991635_100000211144 [1,0,0,0,0,0|2,0,1]=4 150 B13R1.382 CCOc1ccccc1C(=O)NC 1626a_100102657272_100000211144 [1,0,0,0,0,0|2,0,1]=4 151 B13R1.382 CCOc1ccccc1C(=O)NC 240690a_100102657272_100000211144 [1,0,0,0,0,0|2,0,1]=4 152 B13R1.382 CCOc1ccccc1C(=O)NC 34a_100000185920_100000210202 [1,0,0,0,0,0|2,0,1]=4 153 B13R1.382 CCOc1ccccc1C(=O)NC 527a_100102657272_100000211144 [1,0,0,0,0,0|2,0,1]=4 154 B13R1.382 CCOc1ccccc1C(=O)NC 7a_100000185920_100000210202 [1,0,0,0,0,0|2,0,1]=4 155 B13R1.382 CCOc1ccccc1C(=O)OC 7a_100000150335_100000210202 [1,0,0,0,0,0|1,0,1]=3 156 B13R1.382 CCOc1cccnc1C(=O)OC 34a_100000744052_100000210202 [1,0,0,0,0,0|2,0,1]=4 157 B13R1.382 CCOc1cccnc1C(=O)OC 7a_100000744052_100000210202 [1,0,0,0,0,0|2,0,1]=4 158 B13R1.382 CCSc1ccccc1C(=O)CC 1458a_100000195471_100000210202 [1,0,0,0,0,0|2,0,1]=4 159 B13R1.382 CCSc1ccccc1C(=O)NC 11a_106832991635_100000195471 [1,0,0,0,0,0|2,0,1]=4 160 B13R1.382 CCSc1ccccc1C(=O)NC 1626a_100102657272_100000195471 [1,0,0,0,0,0|2,0,1]=4 161 B13R1.382 CCSc1ccccc1C(=O)NC 240690a_100102657272_100000195471 [1,0,0,0,0,0|2,0,1]=4 162 B13R1.382 CCSc1ccccc1C(=O)NC 527a_100102657272_100000195471 [1,0,0,0,0,0|2,0,1]=4 163 B13R1.382 CCSc1ccccc1C(=O)NC 62a_100000155073_100000210202 [1,0,0,0,0,0|2,0,1]=4 164 B13R1.382 CCSc1ccccc1C(=O)NC 62a_100000210202_100000155073 [1,0,0,0,0,0|2,0,1]=4 165 B13R1.382 CCSc1ccccc1C(=O)OC 62a_100000148710_100000210202 [1,0,0,0,0,0|1,0,1]=3 166 B13R1.382 CCSc1ccccc1C(=O)OC 62a_100000210202_100000148710 [1,0,0,0,0,0|1,0,1]=3 167 B13R1.382 CCSc1ccccc1C(=O)O[Na] 62a_100000210202_114855342371 [1,0,0,0,0,0|2,0,1]=4 168 B13R1.382 CCSc1cccnc1C(=O)OC 62a_100000210202_100011935214 [1,0,0,0,0,0|2,0,1]=4 169 B13R1.382 CCSc1cccnc1C(=O)OC 62a_100011935214_100000210202 [1,0,0,0,0,0|2,0,1]=4 170 B13R1.382 CCSc1ccncc1C(=O)OC 62a_100000210202_100020629055 [1,0,0,0,0,0|2,0,1]=4 171 B13R1.382 CCSc1ccncc1C(=O)OC 62a_100020629055_100000210202 [1,0,0,0,0,0|2,0,1]=4 172 B13R1.382 CCSc1cnccc1C(=O)OC 62a_100000210202_100010008606 [1,0,0,0,0,0|2,0,1]=4 173 B13R1.382 CCSc1cnccc1C(=O)OC 62a_100010008606_100000210202 [1,0,0,0,0,0|2,0,1]=4 174 B13R1.382 CCSc1ncccc1C(=O)OC 62a_100000210202_100000150852 [1,0,0,0,0,0|2,0,1]=4 175 B13R1.382 CCSc1ncccc1C(=O)OC 62a_100011587185_100000210202 [1,0,0,0,0,0|2,0,1]=4 176 B13R1.382 CNC(=O)c1ccccc1COC 11a_106832991635_100000737999 [1,0,0,0,0,0|3,0,0]=4 177 B13R1.382 CNC(=O)c1ccccc1COC 1626a_100102657272_100000737999 [1,0,0,0,0,0|3,0,0]=4 178 B13R1.382 CNC(=O)c1ccccc1COC 240690a_100102657272_100000737999 [1,0,0,0,0,0|3,0,0]=4 179 B13R1.382 CNC(=O)c1ccccc1COC 34a_100009855793_200000210301 [1,0,0,0,0,0|3,0,0]=4 180 B13R1.382 CNC(=O)c1ccccc1COC 527a_100102657272_100000737999 [1,0,0,0,0,0|3,0,0]=4 181 B13R1.382 CNC(=O)c1ccccc1COC 7a_100009855793_200000210301 [1,0,0,0,0,0|3,0,0]=4 182 B13R1.382 CNC(=O)c1ccccc1CO[13CH3] 34a_100009855793_200025704644 [1,0,0,0,0,0|3,0,0]=4 183 B13R1.382 CNC(=O)c1ccccc1CO[13CH3] 7a_100009855793_200025704644 [1,0,0,0,0,0|3,0,0]=4 184 B13R1.382 CNC(=O)c1ccccc1NCF 34a_100000185696_100015361967 [1,0,0,0,0,0|2,0,1]=4 185 B13R1.382 CNCc1ccccc1C(=O)OC 2230a_106832991635_100000744672 [1,0,0,0,0,0|2,0,0]=3 186 B13R1.382 CNCc1ccccc1C(=O)OC 34a_100102657272_100000744672 [1,0,0,0,0,0|2,0,0]=3 187 B13R1.382 CNCc1ccccc1C(=O)OC 7a_106832991635_100000744672 [1,0,0,0,0,0|2,0,0]=3 188 B13R1.382 CNCc1cccnc1C(=O)OC 2230a_106832991635_100010177730 [1,0,0,0,0,0|3,0,0]=4 189 B13R1.382 CNCc1cccnc1C(=O)OC 34a_100102657272_100010177730 [1,0,0,0,0,0|3,0,0]=4 190 B13R1.382 CNCc1cccnc1C(=O)OC 7a_106832991635_100010177730 [1,0,0,0,0,0|3,0,0]=4 191 B13R1.382 CNCc1ncccc1C(=O)OC 2230a_106832991635_100000709840 [1,0,0,0,0,0|3,0,0]=4 192 B13R1.382 CNCc1ncccc1C(=O)OC 34a_100102657272_100012347567 [1,0,0,0,0,0|3,0,0]=4 193 B13R1.382 CNCc1ncccc1C(=O)OC 7a_106832991635_100000709840 [1,0,0,0,0,0|3,0,0]=4 194 B13R1.382 COC(=O)c1ccccc1CSC 62a_100000744672_200000210301 [1,0,0,0,0,0|2,0,0]=3 195 B13R1.382 COC(=O)c1ccccc1CSC 62a_200000210301_100000744672 [1,0,0,0,0,0|2,0,0]=3 196 B13R1.382 COC(=O)c1ccccc1CS[13CH3] 62a_100000744672_200025704644 [1,0,0,0,0,0|2,0,0]=3 197 B13R1.382 COC(=O)c1ccccc1CS[13CH3] 62a_200025704644_100000744672 [1,0,0,0,0,0|2,0,0]=3 198 B13R1.382 COC(=O)c1ccccc1OCF 7a_100000150335_100015361967 [1,0,0,0,0,0|2,0,1]=4 199 B13R1.382 COC(=O)c1ccccc1SCF 62a_100000148710_100015361967 [1,0,0,0,0,0|2,0,1]=4 200 B13R1.382 COC(=O)c1ccccc1SCF 62a_100015361967_100000148710 [1,0,0,0,0,0|2,0,1]=4 201 B13R1.382 COC(=O)c1cccnc1CSC 62a_100000709840_200000210301 [1,0,0,0,0,0|3,0,0]=4 202 B13R1.382 COC(=O)c1cccnc1CSC 62a_200000210301_100000709840 [1,0,0,0,0,0|3,0,0]=4 203 B13R1.382 COC(=O)c1cccnc1CS[13CH3] 62a_100000709840_200025704644 [1,0,0,0,0,0|3,0,0]=4 204 B13R1.382 COC(=O)c1cccnc1CS[13CH3] 62a_200025704644_100000709840 [1,0,0,0,0,0|3,0,0]=4 205 B13R1.382 COC(=O)c1ncccc1CSC 62a_100010177730_200000210301 [1,0,0,0,0,0|3,0,0]=4 206 B13R1.382 COC(=O)c1ncccc1CSC 62a_200000210301_100010177730 [1,0,0,0,0,0|3,0,0]=4 207 B13R1.382 COC(=O)c1ncccc1CS[13CH3] 62a_100010177730_200025704644 [1,0,0,0,0,0|3,0,0]=4 208 B13R1.382 COC(=O)c1ncccc1CS[13CH3] 62a_200025704644_100010177730 [1,0,0,0,0,0|3,0,0]=4 209 B13R1.382 COCc1ccccc1C(=O)OC 34a_100138415774_100000744672 [1,0,0,0,0,0|2,0,0]=3 210 B13R1.382 COCc1cccnc1C(=O)OC 34a_100138415774_100010177730 [1,0,0,0,0,0|3,0,0]=4 211 B13R1.382 COCc1ncccc1C(=O)OC 34a_100138415774_100012347567 [1,0,0,0,0,0|3,0,0]=4 212 B13R1.589 C=C(C)c1ccccc1CC(=O)C 271570a_100000694244_100011350739 [1,0,0,0,0,0|2,0,0]=3 213 B13R1.589 C=C(C)c1ccccc1CC(=O)N 271570a_100000694244_200009814924 [1,0,0,0,0,0|3,0,0]=4 214 B13R1.589 C=C(C)c1ccccc1NC(=O)C 11a_100000037685_100015343762 [1,0,0,0,0,0|1,0,0]=2 215 B13R1.589 C=C(C)c1ccccc1NC(=O)C 1626a_100000037685_100015343762 [1,0,0,0,0,0|1,0,0]=2 216 B13R1.589 C=C(C)c1ccccc1NC(=O)C 22a_100000037685_100000070787 [1,0,0,0,0,0|1,0,0]=2 217 B13R1.589 C=C(C)c1ccccc1NC(=O)C 271570a_100000694244_100000153524 [1,0,0,0,0,0|1,0,0]=2 218 B13R1.589 C=C(C)c1ccccc1NC(=O)N 271570a_100000694244_100000742221 [1,0,0,0,0,0|2,0,0]=3 219 B13R1.589 C=C(C)c1ccccc1NC(C)C 271570a_100000694244_100000219599 [1,0,0,0,0,0|2,0,1]=4 220 B13R1.589 C=C(C)c1ccccc1NC(C)C 34a_100000037685_100000210206 [1,0,0,0,0,0|2,0,1]=4 221 B13R1.589 C=C(C)c1ccccc1OC(=O)C 271570a_100000694244_100000051690 [1,0,0,0,0,0|2,0,0]=3 222 B13R1.589 C=C(C)c1cnccc1NC(=O)C 271570a_100000694244_100016132053 [1,0,0,0,0,0|2,0,0]=3 223 B13R1.589 C=C(C)c1ncccc1OC(=O)C 271570a_100000694244_200009815371 [1,0,0,0,0,0|3,0,0]=4 224 B13R1.589 CC(=Cc1ccccc1C(=O)N)C 271570a_100102525489_100000162227 [1,0,0,0,0,0|3,0,0]=4 225 B13R1.589 CC(=Cc1ccccc1S(=O)C)C 271570a_100102525489_100000734199 [1,0,0,0,0,0|3,0,0]=4 226 B13R1.589 CC(=O)Cc1ccccc1B(O)O 1458a_100000070787_100009814197 [1,0,0,0,0,0|2,0,1]=4 227 B13R1.589 CC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000070787_100000181388 [1,0,0,0,0,0|2,0,1]=4 228 B13R1.589 CC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_200000210301 [1,0,0,0,0,0|2,0,1]=4 229 B13R1.589 CC(=O)Nc1ccccc1C(=O)N 11a_100000185089_100015343762 [1,0,0,0,0,0|1,0,0]=2 230 B13R1.589 CC(=O)Nc1ccccc1C(=O)N 1626a_100000185089_100015343762 [1,0,0,0,0,0|1,0,0]=2 231 B13R1.589 CC(=O)Nc1ccccc1C(=O)N 22a_100000185089_100000070787 [1,0,0,0,0,0|1,0,0]=2 232 B13R1.589 CC(=O)Nc1ccccc1C(=S)N 1626a_100000206033_100015343762 [1,0,0,0,0,0|1,1,0]=3 233 B13R1.589 CC(=O)Nc1ccccc1C(C)C 11a_100000210643_100015343762 [1,0,0,0,0,0|1,0,1]=3 234 B13R1.589 CC(=O)Nc1ccccc1C(C)C 1626a_100000210643_100015343762 [1,0,0,0,0,0|1,0,1]=3 235 B13R1.589 CC(=O)Nc1ccccc1C(C)C 22a_100000210643_100000070787 [1,0,0,0,0,0|1,0,1]=3 236 B13R1.589 CC(=O)Nc1ccccc1C(C)C 527a_100000210643_100103153847 [1,0,0,0,0,0|1,0,1]=3 237 B13R1.589 CC(=O)Nc1ccccc1C(F)F 11a_100000734540_100015343762 [1,0,0,0,0,0|2,0,1]=4 238 B13R1.589 CC(=O)Nc1ccccc1C(F)F 1626a_100000734540_100015343762 [1,0,0,0,0,0|2,0,1]=4 239 B13R1.589 CC(=O)Nc1ccccc1C(F)F 22a_100000734540_100000070787 [1,0,0,0,0,0|2,0,1]=4 240 B13R1.589 CC(=O)Nc1ccccc1N(C)C 11a_100000737595_100015343762 [1,0,0,0,0,0|2,0,0]=3 241 B13R1.589 CC(=O)Nc1ccccc1N(C)C 1626a_100000737595_100015343762 [1,0,0,0,0,0|2,0,0]=3 242 B13R1.589 CC(=O)Nc1ccccc1N(C)C 22a_100000737595_100000070787 [1,0,0,0,0,0|2,0,0]=3 243 B13R1.589 CC(=O)Nc1ccccc1N(C)C 527a_100000737595_100103153847 [1,0,0,0,0,0|2,0,0]=3 244 B13R1.589 CC(=O)c1ccccc1C=C(C)C 271570a_100102525489_100000751169 [1,0,0,0,0,0|2,0,0]=3 245 B13R1.589 CC(=O)c1ccccc1CN(C)C 1458a_100000743624_200000210301 [1,0,0,0,0,0|3,0,0]=4 246 B13R1.589 CC(=O)c1ccccc1OC(C)C 1458a_100000244644_200000210301 [1,0,0,0,0,0|2,0,1]=4 247 B13R1.589 CC(=O)c1ccccc1SC(C)C 1458a_100000229993_200000210301 [1,0,0,0,0,0|2,0,1]=4 248 B13R1.589 CC(=O)c1ccccc1SC(C)C 62a_100000751169_100000210206 [1,0,0,0,0,0|2,0,1]=4 249 B13R1.589 CC(=O)c1cccnc1C=C(C)C 271570a_100102525489_100000753718 [1,0,0,0,0,0|3,0,0]=4 250 B13R1.589 CC(=O)c1cccnc1NC(C)C 27a_100138425928_100009816689 [1,0,0,0,0,0|2,0,1]=4 251 B13R1.589 CC(=O)c1ccncc1C=C(C)C 271570a_100102525489_100009993184 [1,0,0,0,0,0|3,0,0]=4 252 B13R1.589 CC(=O)c1cnccc1C=C(C)C 271570a_100102525489_100160469449 [1,0,0,0,0,0|3,0,0]=4 253 B13R1.589 CC(=O)c1cnccc1NC(C)C 27a_100138425928_100160469449 [1,0,0,0,0,0|2,0,1]=4 254 B13R1.589 CC(=O)c1ncccc1C=C(C)C 271570a_100102525489_100012348690 [1,0,0,0,0,0|3,0,0]=4 255 B13R1.589 CC(C)Nc1ccccc1C(=O)N 34a_100000185089_100000210206 [1,0,0,0,0,0|2,0,1]=4 256 B13R1.589 CC(C)Oc1ccccc1C(=O)[13CH3] 1458a_100000244644_200025704644 [1,0,0,0,0,0|2,0,1]=4 257 B13R1.589 CC(C)Sc1ccccc1C(=O)O 62a_100000210206_100000734275 [1,0,0,0,0,0|2,0,1]=4 258 B13R1.589 CC(C)Sc1ccccc1C(=O)O 62a_202125556159_100000210206 [1,0,0,0,0,0|2,0,1]=4 259 B13R1.589 CC(C)Sc1ccccc1C(=O)[13CH3] 1458a_100000229993_200025704644 [1,0,0,0,0,0|2,0,1]=4 260 B13R1.589 CN(C)Cc1ccccc1C(=O)[13CH3] 1458a_100000743624_200025704644 [1,0,0,0,0,0|3,0,0]=4 261 B13R1.589 [13CH3]C(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_200025704644 [1,0,0,0,0,0|2,0,1]=4 262 B15R1.340 CCS(=O)(=O)c1ccccc1NC(=O)C 11a_100000738084_100015343762 [0,1,0,0,0,0|2,0,0]=3 263 B15R1.340 CCS(=O)(=O)c1ccccc1NC(=O)C 1626a_100000738084_100015343762 [0,1,0,0,0,0|2,0,0]=3 264 B15R1.810 CC(=O)Nc1ccccc1N(C)CCO 22a_200011271616_100000070787 [0,1,0,0,0,0|3,0,0]=4 265 B15R1.810 CCCN(C)c1ccccc1NC(=O)C 11a_100011284199_100015343762 [0,1,0,0,0,0|3,0,0]=4 266 B15R1.810 CCCN(C)c1ccccc1NC(=O)C 1626a_100011284199_100015343762 [0,1,0,0,0,0|3,0,0]=4 267 B15R1.810 CCCN(C)c1ccccc1NC(=O)C 22a_100011284199_100000070787 [0,1,0,0,0,0|3,0,0]=4 268 B15R1.810 CCNC(=O)c1ccccc1C=C(C)C 271570a_100102525489_200000155173 [0,1,0,0,0,0|3,0,0]=4 269 B15R1.810 CCNC(=O)c1ccccc1NC(=O)C 11a_100000205978_100015343762 [0,1,0,0,0,0|1,0,0]=2 270 B15R1.810 CCNC(=O)c1ccccc1NC(=O)C 1626a_100000205978_100015343762 [0,1,0,0,0,0|1,0,0]=2 271 B15R1.810 CCNC(=O)c1ccccc1NC(=O)C 22a_100000205978_100000070787 [0,1,0,0,0,0|1,0,0]=2 272 B15R1.810 CCNC(=O)c1ccccc1NC(C)C 27a_100138425928_200000155173 [0,1,0,0,0,0|2,0,1]=4 273 B15R1.810 CCNC(=O)c1ccccc1NC(C)C 34a_100000205978_100000210206 [0,1,0,0,0,0|2,0,1]=4 274 B15R1.810 CCNC(=O)c1ccccc1OC(=O)C 240690a_100015525214_100000210466 [0,1,0,0,0,0|2,0,0]=3 275 B15R1.810 CCNC(C)c1ccccc1NC(=O)C 269862a_100015525214_100000153761 [0,1,0,0,0,0|2,0,1]=4 276 B15R1.810 CCOC(=O)c1ccccc1C=C(C)C 271570a_100102525489_100000169879 [0,1,0,0,0,0|2,0,0]=3 277 B15R1.810 CCOC(=O)c1ccccc1CC(=O)C 1458a_100000070787_100009816840 [0,1,0,0,0,0|1,0,0]=2 278 B15R1.810 CCOC(=O)c1ccccc1CN(C)C 2230a_100102631434_100009816840 [0,1,0,0,0,0|3,0,0]=4 279 B15R1.810 CCOC(=O)c1ccccc1CN(C)C 269982a_100102631434_100009816840 [0,1,0,0,0,0|3,0,0]=4 280 B15R1.810 CCOC(=O)c1ccccc1CN(C)C 270004a_100102631434_200000006220 [0,1,0,0,0,0|3,0,0]=4 281 B15R1.810 CCOC(=O)c1ccccc1OC(C)C 7a_100000169922_100000210206 [0,1,0,0,0,0|2,0,1]=4 282 B15R1.810 CCOC(=O)c1ccccc1SC(C)C 62a_100000169876_100000210206 [0,1,0,0,0,0|2,0,1]=4 283 B15R1.810 CCOC(=O)c1ccccc1SC(C)C 62a_100000210206_100000169879 [0,1,0,0,0,0|2,0,1]=4 284 B15R1.810 CCOC(=O)c1cccnc1C=C(C)C 271570a_100102525489_100000170124 [0,1,0,0,0,0|3,0,0]=4 285 B15R1.810 CCOC(=O)c1cccnc1NC(C)C 27a_100138425928_100000170124 [0,1,0,0,0,0|2,0,1]=4 286 B15R1.810 CCOC(=O)c1ccncc1C=C(C)C 271570a_100102525489_100010238393 [0,1,0,0,0,0|3,0,0]=4 287 B15R1.810 CCOC(=O)c1cnccc1C=C(C)C 271570a_100102525489_100016987518 [0,1,0,0,0,0|3,0,0]=4 288 B15R1.810 CCOC(=O)c1cnccc1NC(C)C 27a_100138425928_100016987518 [0,1,0,0,0,0|2,0,1]=4 289 B15R1.810 CCOC(=O)c1ncccc1C=C(C)C 271570a_100102525489_100012351660 [0,1,0,0,0,0|3,0,0]=4 290 B15R1.810 CONC(=O)c1ccccc1NC(=O)C 11a_100011599994_100015343762 [0,1,0,0,0,0|0,0,0]=1 291 B15R1.810 CONC(=O)c1ccccc1NC(=O)C 1626a_100011599994_100015343762 [0,1,0,0,0,0|0,0,0]=1 292 B15R1.810 CONC(=O)c1ccccc1NC(=O)C 22a_100011599994_100000070787 [0,1,0,0,0,0|0,0,0]=1 293 B15R1.810 CONC(=O)c1ccccc1NC(C)C 34a_100011599994_100000210206 [0,1,0,0,0,0|1,0,1]=3 294 B15R1.925 CC(=O)Nc1ccc(cc1C(=O)CF)Br 1458a_100000195241_100015361967 [0,1,0,0,0,0|2,0,0]=3 295 B15R1.925 CC(=O)Nc1ccc(cc1C(=O)CF)F 1458a_100011219192_100015361967 [0,1,0,0,0,0|2,0,0]=3 296 B15R1.925 CCC(=O)c1cc(ccc1NC(=O)C)Br 1458a_100000195241_100000210202 [0,1,0,0,0,0|1,0,0]=2 297 B15R1.925 CCC(=O)c1cc(ccc1NC(=O)C)F 1458a_100011219192_100000210202 [0,1,0,0,0,0|1,0,0]=2 298 B15R1.925 CNC(=O)c1cc(ccc1C=C(C)C)Cl 271570a_100102525489_200011279454 [0,1,0,0,0,0|3,0,0]=4 299 B15R1.925 CNC(=O)c1cc(ccc1C=C(C)C)F 271570a_100102525489_200000206232 [0,1,0,0,0,0|3,0,0]=4 300 B15R1.925 CNC(=O)c1cc(ccc1NC(=O)C)Br 11a_100000690504_100015343762 [0,1,0,0,0,0|1,0,0]=2 301 B15R1.925 CNC(=O)c1cc(ccc1NC(=O)C)Br 1626a_100000690504_100015343762 [0,1,0,0,0,0|1,0,0]=2 302 B15R1.925 CNC(=O)c1cc(ccc1NC(=O)C)Br 240690a_100102657272_100000195241 [0,1,0,0,0,0|1,0,0]=2 303 B15R1.925 CNC(=O)c1cc(ccc1NC(=O)C)Cl 11a_100000739363_100015343762 [0,1,0,0,0,0|1,0,0]=2 304 B15R1.925 CNC(=O)c1cc(ccc1NC(=O)C)Cl 1626a_100000739363_100015343762 [0,1,0,0,0,0|1,0,0]=2 305 B15R1.925 CNC(=O)c1cc(ccc1NC(=O)C)Cl 22a_100000739363_100000070787 [0,1,0,0,0,0|1,0,0]=2 306 B15R1.925 CNC(=O)c1cc(ccc1NC(=O)C)F 240690a_100102657272_100011219192 [0,1,0,0,0,0|1,0,0]=2 307 B15R1.925 CNC(=O)c1cc(ccc1NC(C)C)Br 34a_100000690504_100000210206 [0,1,0,0,0,0|2,0,1]=4 308 B15R1.925 CNC(=O)c1cc(ccc1NC(C)C)Cl 27a_100138425928_200011279454 [0,1,0,0,0,0|2,0,1]=4 309 B15R1.925 CNC(=O)c1cc(ccc1NC(C)C)Cl 34a_100000739363_100000210206 [0,1,0,0,0,0|2,0,1]=4 310 B15R1.925 CNC(=O)c1cc(ccc1NC(C)C)F 27a_100138425928_200000206232 [0,1,0,0,0,0|2,0,1]=4 311 B15R1.925 CNC(=O)c1cc(ccc1OC(=O)C)Br 240690a_100102657272_200009996594 [0,1,0,0,0,0|2,0,0]=3 312 B15R1.925 CNC(=O)c1cc(ccc1OC(=O)C)C 1626a_100102657272_100000047319 [0,1,0,0,0,0|2,0,0]=3 313 B15R1.925 CNC(=O)c1cc(ccc1OC(=O)C)C 240690a_100102657272_100000047319 [0,1,0,0,0,0|2,0,0]=3 314 B15R1.925 CNC(=O)c1cc(ccc1OC(=O)C)Cl 240690a_100102657272_100000058116 [0,1,0,0,0,0|2,0,0]=3 315 B15R1.925 COC(=O)c1cc(ccc1C=C(C)C)Br 271570a_100102525489_100000148213 [0,1,0,0,0,0|2,0,0]=3 316 B15R1.925 COC(=O)c1cc(ccc1C=C(C)C)C 271570a_100102525489_100012339458 [0,1,0,0,0,0|2,0,0]=3 317 B15R1.925 COC(=O)c1cc(ccc1C=C(C)C)Cl 271570a_100102525489_100011294804 [0,1,0,0,0,0|2,0,0]=3 318 B15R1.925 COC(=O)c1cc(ccc1C=C(C)C)F 271570a_100102525489_100000205820 [0,1,0,0,0,0|2,0,0]=3 319 B15R1.925 COC(=O)c1cc(ccc1C=C(C)C)N 271570a_100102525489_100000696289 [0,1,0,0,0,0|2,0,0]=3 320 B15R1.925 COC(=O)c1cc(ccc1C=C(C)C)O 271570a_100102525489_100010230369 [0,1,0,0,0,0|2,0,0]=3 321 B15R1.925 COC(=O)c1cc(ccc1CC(=O)C)Br 1458a_100000070787_100000728005 [0,1,0,0,0,0|1,0,0]=2 322 B15R1.925 COC(=O)c1cc(ccc1CC(=O)C)Cl 1458a_100000070787_100012352085 [0,1,0,0,0,0|1,0,0]=2 323 B15R1.925 COC(=O)c1cc(ccc1CC(=O)C)F 1458a_100000070787_100000751459 [0,1,0,0,0,0|1,0,0]=2 324 B15R1.925 COC(=O)c1cc(ccc1CC(=O)C)I 1458a_100000070787_100011096949 [0,1,0,0,0,0|1,0,0]=2 325 B15R1.925 COC(=O)c1cc(ccc1CN(C)C)Br 2230a_100102631434_100000728005 [0,1,0,0,0,0|3,0,0]=4 326 B15R1.925 COC(=O)c1cc(ccc1CN(C)C)Br 269982a_100102631434_100000728005 [0,1,0,0,0,0|3,0,0]=4 327 B15R1.925 COC(=O)c1cc(ccc1CN(C)C)Cl 2230a_100102631434_100012352085 [0,1,0,0,0,0|3,0,0]=4 328 B15R1.925 COC(=O)c1cc(ccc1CN(C)C)Cl 269982a_100102631434_100012352085 [0,1,0,0,0,0|3,0,0]=4 329 B15R1.925 COC(=O)c1cc(ccc1CN(C)C)F 2230a_100102631434_100000751459 [0,1,0,0,0,0|3,0,0]=4 330 B15R1.925 COC(=O)c1cc(ccc1CN(C)C)F 269982a_100102631434_100000751459 [0,1,0,0,0,0|3,0,0]=4 331 B15R1.925 COC(=O)c1cc(ccc1CN(C)C)I 2230a_100102631434_100011096949 [0,1,0,0,0,0|3,0,0]=4 332 B15R1.925 COC(=O)c1cc(ccc1CN(C)C)I 269982a_100102631434_100011096949 [0,1,0,0,0,0|3,0,0]=4 333 B15R1.925 COC(=O)c1cc(ccc1NC(=O)C)O 271570a_203496583355_200009811626 [0,1,0,0,0,0|0,0,0]=1 334 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)Br 34a_100000149267_100000210206 [0,1,0,0,0,0|2,0,1]=4 335 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)Br 7a_100000149267_100000210206 [0,1,0,0,0,0|2,0,1]=4 336 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)C 34a_100000216618_100000210206 [0,1,0,0,0,0|2,0,1]=4 337 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)C 7a_100000216618_100000210206 [0,1,0,0,0,0|2,0,1]=4 338 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)Cl 34a_100000149278_100000210206 [0,1,0,0,0,0|2,0,1]=4 339 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)Cl 7a_100000149278_100000210206 [0,1,0,0,0,0|2,0,1]=4 340 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)F 34a_100011219540_100000210206 [0,1,0,0,0,0|2,0,1]=4 341 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)F 7a_100011219540_100000210206 [0,1,0,0,0,0|2,0,1]=4 342 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)I 34a_100000149868_100000210206 [0,1,0,0,0,0|2,0,1]=4 343 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)I 7a_100000149868_100000210206 [0,1,0,0,0,0|2,0,1]=4 344 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)N 34a_100011246163_100000210206 [0,1,0,0,0,0|2,0,1]=4 345 B15R1.925 COC(=O)c1cc(ccc1OC(C)C)N 7a_100011246163_100000210206 [0,1,0,0,0,0|2,0,1]=4 346 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)Br 62a_100000148213_100000210206 [0,1,0,0,0,0|2,0,1]=4 347 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)Br 62a_100000210206_100000148213 [0,1,0,0,0,0|2,0,1]=4 348 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)C 62a_100000210206_100012339458 [0,1,0,0,0,0|2,0,1]=4 349 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)C 62a_100012339458_100000210206 [0,1,0,0,0,0|2,0,1]=4 350 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)Cl 62a_100000210206_100011294804 [0,1,0,0,0,0|2,0,1]=4 351 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)Cl 62a_100011294804_100000210206 [0,1,0,0,0,0|2,0,1]=4 352 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)F 62a_100000205820_100000210206 [0,1,0,0,0,0|2,0,1]=4 353 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)F 62a_100000210206_100000205820 [0,1,0,0,0,0|2,0,1]=4 354 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)N 62a_100000210206_100011794239 [0,1,0,0,0,0|2,0,1]=4 355 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)N 62a_100000696289_100000210206 [0,1,0,0,0,0|2,0,1]=4 356 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)O 62a_100000210206_100010230369 [0,1,0,0,0,0|2,0,1]=4 357 B15R1.925 COC(=O)c1cc(ccc1SC(C)C)O 62a_100010230369_100000210206 [0,1,0,0,0,0|2,0,1]=4 358 B15R1.925 COC(=O)c1cc(cnc1C=C(C)C)C 271570a_100102525489_100000085774 [0,1,0,0,0,0|3,0,0]=4 359 B15R1.925 COC(=O)c1cc(cnc1C=C(C)C)F 271570a_100102525489_100012000215 [0,1,0,0,0,0|3,0,0]=4 360 B15R1.925 COC(=O)c1cc(cnc1C=C(C)C)N 271570a_100102525489_200012182668 [0,1,0,0,0,0|3,0,0]=4 361 B15R1.925 COC(=O)c1cc(cnc1NC(C)C)C 27a_100138425928_100000085774 [0,1,0,0,0,0|2,0,1]=4 362 B15R1.925 COC(=O)c1cc(ncc1C=C(C)C)N 271570a_100102525489_100011934820 [0,1,0,0,0,0|3,0,0]=4 363 B15R1.925 COC(=O)c1cc(ncc1C=C(C)C)O 271570a_100102525489_100009816900 [0,1,0,0,0,0|3,0,0]=4 364 B15R1.925 COC(=O)c1nc(ccc1C=C(C)C)N 271570a_100102525489_100009816986 [0,1,0,0,0,0|3,0,0]=4 365 B15R1.925 COC(=O)c1nc(ccc1C=C(C)C)O 271570a_100102525489_100010189638 [0,1,0,0,0,0|3,0,0]=4 366 B15R1.984 CC(=O)N(C)c1ccccc1C(=O)CF 1458a_100000242783_100015361967 [0,1,0,0,0,0|2,0,0]=3 367 B15R1.984 CCC(=O)c1ccccc1N(C)C(=O)C 1458a_100000242783_100000210202 [0,1,0,0,0,0|1,0,0]=2 368 B15R1.984 CNC(=O)c1ccccc1C(=C(C)C)C 271570a_200000049429_100000155073 [0,1,0,0,0,0|3,0,0]=4 369 B15R1.984 CNC(=O)c1ccccc1N(C)C(=O)C 1626a_100102657272_100000242783 [0,1,0,0,0,0|1,0,0]=2 370 B15R1.984 CNC(=O)c1ccccc1N(C)C(=O)C 240690a_100102657272_100000242783 [0,1,0,0,0,0|1,0,0]=2 371 B15R1.984 CNC(=O)c1ccccc1N(C)C(C)C 27a_200000211004_100000155073 [0,1,0,0,0,0|2,0,1]=4 372 B15R1.984 COC(=O)c1ccccc1C(=C(C)C)C 271570a_200000049429_100000148710 [0,1,0,0,0,0|2,0,0]=3 373 B15R1.984 COC(=O)c1ccccc1C(=O)C(C)C 1458a_100011215673_100000210206 [0,1,0,0,0,0|2,0,1]=4 374 B15R1.984 COC(=O)c1ccccc1C(=O)N(C)C 1626a_100102631434_100011215673 [0,1,0,0,0,0|3,0,0]=4 375 B15R1.984 COC(=O)c1ccccc1C(=O)N(C)C 240690a_100102631434_100011215673 [0,1,0,0,0,0|3,0,0]=4 376 B15R1.984 COC(=O)c1ccccc1N(C)C(=O)C 11a_100000170468_100015343762 [0,1,0,0,0,0|0,0,0]=1 377 B15R1.984 COC(=O)c1ccccc1N(C)C(=O)C 1626a_100000170468_100015343762 [0,1,0,0,0,0|0,0,0]=1 378 B15R1.984 COC(=O)c1ccccc1N(C)C(C)C 269982a_100000170468_100000210206 [0,1,0,0,0,0|1,0,1]=3 379 B15R1.984 COC(=O)c1ccccc1N(C)C(C)C 34a_100000170468_100000210206 [0,1,0,0,0,0|1,0,1]=3 380 B15R1.984 COC(=O)c1cccnc1C(=C(C)C)C 271570a_200000049429_100000150852 [0,1,0,0,0,0|3,0,0]=4 381 B15R1.984 COC(=O)c1cccnc1N(C)C(C)C 27a_200000211004_100000150852 [0,1,0,0,0,0|2,0,1]=4 382 B15R1.984 COC(=O)c1ccncc1C(=C(C)C)C 271570a_200000049429_100010008606 [0,1,0,0,0,0|3,0,0]=4 383 B15R1.984 COC(=O)c1cnccc1C(=C(C)C)C 271570a_200000049429_100020629055 [0,1,0,0,0,0|3,0,0]=4 384 B15R1.984 COC(=O)c1ncccc1C(=C(C)C)C 271570a_200000049429_100011935214 [0,1,0,0,0,0|3,0,0]=4 385 B15R1.1086 CC(=C(C)c1ccccc1NC(=O)N)C 271570a_200000049429_100000742221 [0,1,0,0,0,0|3,0,0]=4 386 B15R1.1086 CC(=Cc1ccccc1C(=O)N(C)C)C 271570a_100102525489_100000159526 [0,1,0,0,0,0|3,0,0]=4 387 B15R1.1086 CC(=O)Cc1ccccc1C(=C(C)C)C 271570a_200000049429_100011350739 [0,1,0,0,0,0|3,0,0]=4 388 B15R1.1086 CC(=O)Nc1ccccc1C(=C(C)C)C 271570a_200000049429_100000153524 [0,1,0,0,0,0|2,0,0]=3 389 B15R1.1086 CC(=O)Nc1ccccc1C(=O)N(C)C 11a_100000188421_100015343762 [0,1,0,0,0,0|1,0,0]=2 390 B15R1.1086 CC(=O)Nc1ccccc1C(=O)N(C)C 1626a_100000188421_100015343762 [0,1,0,0,0,0|1,0,0]=2 391 B15R1.1086 CC(=O)Nc1ccccc1C(=O)N(C)C 22a_100000188421_100000070787 [0,1,0,0,0,0|1,0,0]=2 392 B15R1.1086 CC(=O)Nc1ccncc1C(=C(C)C)C 271570a_200000049429_100016132053 [0,1,0,0,0,0|3,0,0]=4 393 B15R1.1086 CC(=O)Oc1ccccc1C(=C(C)C)C 271570a_200000049429_100000051690 [0,1,0,0,0,0|3,0,0]=4 394 B15R1.1086 CC(=O)Oc1ccccc1C(=O)N(C)C 240690a_100102631434_100000210466 [0,1,0,0,0,0|2,0,0]=3 395 B15R1.1086 CC(C)Nc1ccccc1C(=O)N(C)C 34a_100000188421_100000210206 [0,1,0,0,0,0|2,0,1]=4 396 B15R1.3847 C#CC(=O)Cc1ccccc1C(=O)OC 1458a_100000211873_100000744672 [0,1,0,0,0,0|1,0,1]=3 397 B15R1.3847 C#CC(=O)Cc1cccnc1C(=O)OC 1458a_100000211873_100010177730 [0,1,0,0,0,0|2,0,1]=4 398 B15R1.3847 C#CC(=O)Cc1ncccc1C(=O)OC 1458a_100000211873_100000709840 [0,1,0,0,0,0|2,0,1]=4 399 B15R1.3847 C#CC(C)Nc1ccccc1C(=O)NC 27a_100000707721_100000155073 [0,1,0,0,0,0|2,0,1]=4 400 B15R1.3847 C#CC(C)Nc1ccccc1C(=O)NC 34a_100000185696_200000035995 [0,1,0,0,0,0|2,0,1]=4 401 B15R1.3847 C#CC(C)Nc1ncccc1C(=O)OC 27a_100000707721_100000150852 [0,1,0,0,0,0|2,0,1]=4 402 B15R1.3847 C#CC(C)Sc1ccccc1C(=O)OC 62a_200000035995_100000148710 [0,1,0,0,0,0|2,0,1]=4 403 B15R1.3847 C=CC(=O)Cc1ccccc1C(=O)OC 1458a_100000185746_100000744672 [0,1,0,0,0,0|1,0,1]=3 404 B15R1.3847 C=CC(=O)Cc1cccnc1C(=O)OC 1458a_100000185746_100010177730 [0,1,0,0,0,0|2,0,1]=4 405 B15R1.3847 C=CC(=O)Cc1ncccc1C(=O)OC 1458a_100000185746_100000709840 [0,1,0,0,0,0|2,0,1]=4 406 B15R1.3847 C=CC(=O)Nc1ccccc1C(=O)NC 1626a_100000185696_100000185746 [0,1,0,0,0,0|1,0,1]=3 407 B15R1.3847 C=CC(=O)Nc1ccccc1C(=O)NC 22a_100000185696_100000185746 [0,1,0,0,0,0|1,0,1]=3 408 B15R1.3847 C=CC(C)Sc1ccccc1C(=O)OC 62a_100011215867_100000148710 [0,1,0,0,0,0|2,0,1]=4 409 B15R1.3847 CCC(=O)Cc1ccccc1C(=O)OC 1458a_100000210414_100000744672 [0,1,0,0,0,0|1,0,0]=2 410 B15R1.3847 CCC(=O)Cc1ccccc1C(=O)OC 1458a_100000695166_100000210202 [0,1,0,0,0,0|1,0,0]=2 411 B15R1.3847 CCC(=O)Cc1cccnc1C(=O)OC 1458a_100000210414_100010177730 [0,1,0,0,0,0|2,0,0]=3 412 B15R1.3847 CCC(=O)Cc1ncccc1C(=O)OC 1458a_100000210414_100000709840 [0,1,0,0,0,0|2,0,0]=3 413 B15R1.3847 CCC(=O)Nc1ccccc1C(=O)CC 1458a_100000194446_100000210202 [0,1,0,0,0,0|1,0,0]=2 414 B15R1.3847 CCC(=O)Nc1ccccc1C(=O)CF 1458a_100000194446_100015361967 [0,1,0,0,0,0|2,0,0]=3 415 B15R1.3847 CCC(=O)Nc1ccccc1C(=O)NC 11a_100000185696_100000210414 [0,1,0,0,0,0|1,0,0]=2 416 B15R1.3847 CCC(=O)Nc1ccccc1C(=O)NC 1626a_100000185696_100000210414 [0,1,0,0,0,0|1,0,0]=2 417 B15R1.3847 CCC(=O)Nc1ccccc1C(=O)NC 22a_100000185696_100000210414 [0,1,0,0,0,0|1,0,0]=2 418 B15R1.3847 CCC(=O)Nc1ccccc1C(=O)NC 240690a_100102657272_100000194446 [0,1,0,0,0,0|1,0,0]=2 419 B15R1.3847 CCC(=O)Nc1ccccc1C(=O)NC 527a_100102657272_100000194446 [0,1,0,0,0,0|1,0,0]=2 420 B15R1.3847 CCC(=O)Nc1ccccc1C(C)CC 11a_200000211393_100000210414 [0,1,0,0,0,0|2,0,1]=4 421 B15R1.3847 CCC(=O)Nc1ccccc1C(C)CC 1626a_200000211393_100000210414 [0,1,0,0,0,0|2,0,1]=4 422 B15R1.3847 CCC(=O)Nc1ccccc1C(C)CC 22a_200000211393_100000210414 [0,1,0,0,0,0|2,0,1]=4 423 B15R1.3847 CCC(=O)Nc1ccccc1N(C)CC 11a_103437849306_100000210414 [0,1,0,0,0,0|3,0,0]=4 424 B15R1.3847 CCC(=O)Nc1ccccc1N(C)CC 1626a_103437849306_100000210414 [0,1,0,0,0,0|3,0,0]=4 425 B15R1.3847 CCC(=O)Nc1ccccc1N(C)CC 22a_103437849306_100000210414 [0,1,0,0,0,0|3,0,0]=4 426 B15R1.3847 CCC(=O)Nc1ccccc1N(C)CC 527a_103437849306_100000210414 [0,1,0,0,0,0|3,0,0]=4 427 B15R1.3847 CCC(=O)c1ccccc1CC(=O)OC 1458a_100000726341_100000210202 [0,1,0,0,0,0|2,0,0]=3 428 B15R1.3847 CCC(C)Nc1ccccc1C(=O)NC 34a_100000185696_100011215416 [0,1,0,0,0,0|2,0,1]=4 429 B15R1.3847 CCC(C)Oc1ccccc1C(=O)OC 7a_100000150335_100000758301 [0,1,0,0,0,0|2,0,1]=4 430 B15R1.3847 CCC(C)Sc1ccccc1C(=O)OC 62a_100000148710_100000758301 [0,1,0,0,0,0|2,0,1]=4 431 B15R1.3847 CCC(C)Sc1ccccc1C(=O)OC 62a_100000758301_100000148710 [0,1,0,0,0,0|2,0,1]=4 432 B15R1.3847 CCC(C)c1ccccc1NC(=O)CO 22a_200000211393_100000210174 [0,1,0,0,0,0|2,0,1]=4 433 B15R1.3847 CCC(C)c1ccccc1NC(=O)NC 2430a_200000211393_100102657272 [0,1,0,0,0,0|2,0,1]=4 434 B15R1.3847 CCC(C)c1ccccc1NC(=O)NC 512a_200000211393_100102657272 [0,1,0,0,0,0|2,0,1]=4 435 B15R1.3847 CCN(C)Cc1ccccc1C(=O)OC 2230a_100000225621_100000744672 [0,1,0,0,0,0|3,0,0]=4 436 B15R1.3847 CCN(C)Cc1ccccc1C(=O)OC 269982a_100000225621_100000744672 [0,1,0,0,0,0|3,0,0]=4 437 B15R1.3847 CCN(C)c1ccccc1NC(=O)CO 22a_103437849306_100000210174 [0,1,0,0,0,0|3,0,0]=4 438 B15R1.3847 CCN(C)c1ccccc1NC(=O)CO 527a_103437849306_100000210174 [0,1,0,0,0,0|3,0,0]=4 439 B15R1.3847 CCN(C)c1ccccc1NC(=O)NC 2430a_103437849306_100102657272 [0,1,0,0,0,0|3,0,0]=4 440 B15R1.3847 CNC(=O)Cc1ccccc1C(=O)OC 11a_106832991635_100000695166 [0,1,0,0,0,0|1,0,0]=2 441 B15R1.3847 CNC(=O)Cc1ccccc1C(=O)OC 1626a_100102657272_100000695166 [0,1,0,0,0,0|1,0,0]=2 442 B15R1.3847 CNC(=O)Cc1ccccc1C(=O)OC 240690a_100102657272_100000695166 [0,1,0,0,0,0|1,0,0]=2 443 B15R1.3847 CNC(=O)Nc1ccccc1C(=O)NC 2430a_100000185696_100102657272 [0,1,0,0,0,0|1,0,0]=2 444 B15R1.3847 CNC(=O)c1ccccc1CC(=O)OC 1626a_100102657272_100000726341 [0,1,0,0,0,0|2,0,0]=3 445 B15R1.3847 CNC(=O)c1ccccc1CC(=O)OC 240690a_100102657272_100000726341 [0,1,0,0,0,0|2,0,0]=3 446 B15R1.3847 CNC(=O)c1ccccc1NC(=O)CO 22a_100000185696_100000210174 [0,1,0,0,0,0|1,0,0]=2 447 B15R1.3847 CNC(=O)c1ccccc1NC(C)CO 34a_100000185696_100012180447 [0,1,0,0,0,0|1,0,2]=4 448 B15R1.3847 CNC(=O)c1ccccc1N[C@H](C)CF 27a_100102880703_100000155073 [0,1,0,0,0,0|2,0,1]=4 449 B15R1.3847 CNC(=O)c1ccccc1N[C@H](C)CO 27a_100000737577_100000155073 [0,1,0,0,0,0|1,0,2]=4 450 B15R1.3847 COC(=O)Cc1ccccc1C(=O)CF 1458a_100000726341_100015361967 [0,1,0,0,0,0|3,0,0]=4 451 B15R1.3847 COC(=O)c1ccccc1CC(=O)CF 1458a_100000695166_100015361967 [0,1,0,0,0,0|1,0,0]=2 452 B15R1.3847 COC(=O)c1ccccc1CC(=O)CO 1458a_100000210174_100000744672 [0,1,0,0,0,0|1,0,0]=2 453 B15R1.3847 COC(=O)c1ccccc1OC(C)C#N 7a_100000150335_100000703298 [0,1,0,0,0,0|2,0,1]=4 454 B15R1.3847 COC(=O)c1ccccc1OC(C)CO 7a_100000150335_100012180447 [0,1,0,0,0,0|1,0,2]=4 455 B15R1.3847 COC(=O)c1ccccc1SC(C)C#N 62a_100000148710_100000703298 [0,1,0,0,0,0|2,0,1]=4 456 B15R1.3847 COC(=O)c1ccccc1SC(C)C#N 62a_100000703298_100000148710 [0,1,0,0,0,0|2,0,1]=4 457 B15R1.3847 COC(=O)c1ccccc1SC(C)CO 62a_100012180447_100000148710 [0,1,0,0,0,0|1,0,2]=4 458 B15R1.3847 COC(=O)c1ccccc1SC(C)OC 62a_100000148710_100009879195 [0,1,0,0,0,0|1,0,2]=4 459 B15R1.3847 COC(=O)c1ccccc1SC(C)OC 62a_100009879195_100000148710 [0,1,0,0,0,0|1,0,2]=4 460 B15R1.3847 COC(=O)c1ccccc1S[C@H](C)CO 62a_100000148710_100016084084 [0,1,0,0,0,0|1,0,2]=4 461 B15R1.3847 COC(=O)c1ccccc1S[C@H](C)CO 62a_100016084084_100000148710 [0,1,0,0,0,0|1,0,2]=4 462 B15R1.3847 COC(=O)c1cccnc1CC(=O)CO 1458a_100000210174_100000709840 [0,1,0,0,0,0|2,0,0]=3 463 B15R1.3847 COC(=O)c1cccnc1N[C@H](C)CF 27a_100102880703_100000150852 [0,1,0,0,0,0|2,0,1]=4 464 B15R1.3847 COC(=O)c1cccnc1N[C@H](C)CO 27a_100000737577_100000150852 [0,1,0,0,0,0|1,0,2]=4 465 B15R1.3847 COC(=O)c1ncccc1CC(=O)CO 1458a_100000210174_100010177730 [0,1,0,0,0,0|2,0,0]=3 466 B15R1.11372 CCC(=O)c1ccccc1NS(=O)(=O)C 1458a_100000169588_100000210202 [0,1,0,0,0,0|2,0,0]=3 467 B15R1.11372 CNC(=O)c1ccccc1NC(C)(C)C 34a_100000185696_100000210625 [0,1,0,0,0,0|2,0,1]=4 468 B15R1.11372 CNC(=O)c1ccccc1NS(=O)(=O)C 240690a_100102657272_100000169588 [0,1,0,0,0,0|2,0,0]=3 469 B15R1.11372 CNC(=O)c1ccccc1NS(=O)(=O)C 527a_100102657272_100000169588 [0,1,0,0,0,0|2,0,0]=3 470 B15R1.11372 COC(=O)c1ccccc1SC(C)(C)C 62a_100000148710_100000211941 [0,1,0,0,0,0|2,0,1]=4 471 B15R1.11372 COC(=O)c1ccccc1SC(C)(C)C 62a_100000211941_100000148710 [0,1,0,0,0,0|2,0,1]=4 472 B15R1.11372 CS(=O)(=O)Nc1ccccc1C(=O)CF 1458a_100000169588_100015361967 [0,1,0,0,0,0|3,0,0]=4 473 B15R1.11677 CC(=O)Nc1cc(ccc1C(=O)CF)Br 1458a_100000747254_100015361967 [0,1,0,0,0,0|2,0,0]=3 474 B15R1.11677 CC(=O)Nc1cc(ccc1C(=O)CF)Cl 1458a_100000195377_100015361967 [0,1,0,0,0,0|2,0,0]=3 475 B15R1.11677 CC(=O)Nc1cc(ccc1C(=O)CF)F 1458a_100000222213_100015361967 [0,1,0,0,0,0|2,0,0]=3 476 B15R1.11677 CCC(=O)c1ccc(cc1C=C(C)C)C 271570a_100102525489_200012349623 [0,1,0,0,0,0|3,0,0]=4 477 B15R1.11677 CCC(=O)c1ccc(cc1NC(=O)C)Br 1458a_100000747254_100000210202 [0,1,0,0,0,0|1,0,0]=2 478 B15R1.11677 CCC(=O)c1ccc(cc1NC(=O)C)Cl 1458a_100000195377_100000210202 [0,1,0,0,0,0|1,0,0]=2 479 B15R1.11677 CCC(=O)c1ccc(cc1NC(=O)C)F 1458a_100000222213_100000210202 [0,1,0,0,0,0|1,0,0]=2 480 B15R1.11677 CCC(=O)c1ccc(cc1NC(C)C)C 27a_100138425928_200012349623 [0,1,0,0,0,0|2,0,1]=4 481 B15R1.11677 CNC(=O)c1ccc(cc1C=C(C)C)F 271570a_100102525489_200000206206 [0,1,0,0,0,0|3,0,0]=4 482 B15R1.11677 CNC(=O)c1ccc(cc1NC(=O)C)Br 240690a_100102657272_100000747254 [0,1,0,0,0,0|1,0,0]=2 483 B15R1.11677 CNC(=O)c1ccc(cc1NC(=O)C)Cl 11a_100000742614_100015343762 [0,1,0,0,0,0|1,0,0]=2 484 B15R1.11677 CNC(=O)c1ccc(cc1NC(=O)C)Cl 1626a_100000742614_100015343762 [0,1,0,0,0,0|1,0,0]=2 485 B15R1.11677 CNC(=O)c1ccc(cc1NC(=O)C)Cl 240690a_100102657272_100000195377 [0,1,0,0,0,0|1,0,0]=2 486 B15R1.11677 CNC(=O)c1ccc(cc1NC(=O)C)F 240690a_100102657272_100000222213 [0,1,0,0,0,0|1,0,0]=2 487 B15R1.11677 CNC(=O)c1ccc(cc1NC(C)C)Cl 34a_100000742614_100000210206 [0,1,0,0,0,0|2,0,1]=4 488 B15R1.11677 CNC(=O)c1ccc(cc1NC(C)C)F 27a_100138425928_200000206206 [0,1,0,0,0,0|2,0,1]=4 489 B15R1.11677 COC(=O)c1ccc(cc1C=C(C)C)Br 271570a_100102525489_100000701758 [0,1,0,0,0,0|2,0,0]=3 490 B15R1.11677 COC(=O)c1ccc(cc1C=C(C)C)C 271570a_100102525489_100012340597 [0,1,0,0,0,0|2,0,0]=3 491 B15R1.11677 COC(=O)c1ccc(cc1C=C(C)C)Cl 271570a_100102525489_100000047510 [0,1,0,0,0,0|2,0,0]=3 492 B15R1.11677 COC(=O)c1ccc(cc1C=C(C)C)F 271570a_100102525489_100000204356 [0,1,0,0,0,0|2,0,0]=3 493 B15R1.11677 COC(=O)c1ccc(cc1C=C(C)C)N 271570a_100102525489_100009998378 [0,1,0,0,0,0|2,0,0]=3 494 B15R1.11677 COC(=O)c1ccc(cc1C=C(C)C)O 271570a_100102525489_100010150825 [0,1,0,0,0,0|2,0,0]=3 495 B15R1.11677 COC(=O)c1ccc(cc1CC(=O)C)Br 1458a_100000070787_100000693193 [0,1,0,0,0,0|1,0,0]=2 496 B15R1.11677 COC(=O)c1ccc(cc1CC(=O)C)Cl 1458a_100000070787_100010239717 [0,1,0,0,0,0|1,0,0]=2 497 B15R1.11677 COC(=O)c1ccc(cc1CC(=O)C)F 1458a_100000070787_100000700702 [0,1,0,0,0,0|1,0,0]=2 498 B15R1.11677 COC(=O)c1ccc(cc1CN(C)C)Br 2230a_100102631434_100000693193 [0,1,0,0,0,0|3,0,0]=4 499 B15R1.11677 COC(=O)c1ccc(cc1CN(C)C)Br 269982a_100102631434_100000693193 [0,1,0,0,0,0|3,0,0]=4 500 B15R1.11677 COC(=O)c1ccc(cc1CN(C)C)Br 270004a_100102631434_100000708894 [0,1,0,0,0,0|3,0,0]=4 501 B15R1.11677 COC(=O)c1ccc(cc1CN(C)C)Cl 2230a_100102631434_100010239717 [0,1,0,0,0,0|3,0,0]=4 502 B15R1.11677 COC(=O)c1ccc(cc1CN(C)C)Cl 269982a_100102631434_100010239717 [0,1,0,0,0,0|3,0,0]=4 503 B15R1.11677 COC(=O)c1ccc(cc1CN(C)C)F 2230a_100102631434_100000700702 [0,1,0,0,0,0|3,0,0]=4 504 B15R1.11677 COC(=O)c1ccc(cc1CN(C)C)F 269982a_100102631434_100000700702 [0,1,0,0,0,0|3,0,0]=4 505 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)Br 34a_100000699699_100000210206 [0,1,0,0,0,0|2,0,1]=4 506 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)Br 7a_100000699699_100000210206 [0,1,0,0,0,0|2,0,1]=4 507 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)C 34a_100000148187_100000210206 [0,1,0,0,0,0|2,0,1]=4 508 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)C 7a_100000148187_100000210206 [0,1,0,0,0,0|2,0,1]=4 509 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)Cl 34a_100000151441_100000210206 [0,1,0,0,0,0|2,0,1]=4 510 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)Cl 7a_100000151441_100000210206 [0,1,0,0,0,0|2,0,1]=4 511 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)F 34a_100011216117_100000210206 [0,1,0,0,0,0|2,0,1]=4 512 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)F 7a_100011216117_100000210206 [0,1,0,0,0,0|2,0,1]=4 513 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)I 7a_100000062286_100000210206 [0,1,0,0,0,0|2,0,1]=4 514 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)N 34a_100000718744_100000210206 [0,1,0,0,0,0|2,0,1]=4 515 B15R1.11677 COC(=O)c1ccc(cc1OC(C)C)N 7a_100000718744_100000210206 [0,1,0,0,0,0|2,0,1]=4 516 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)Br 62a_100000701758_100000210206 [0,1,0,0,0,0|2,0,1]=4 517 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)C 62a_100000210206_100012340597 [0,1,0,0,0,0|2,0,1]=4 518 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)C 62a_100012340597_100000210206 [0,1,0,0,0,0|2,0,1]=4 519 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)Cl 62a_100000047510_100000210206 [0,1,0,0,0,0|2,0,1]=4 520 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)Cl 62a_100000210206_100000047510 [0,1,0,0,0,0|2,0,1]=4 521 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)F 62a_100000204356_100000210206 [0,1,0,0,0,0|2,0,1]=4 522 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)F 62a_100000210206_100000204356 [0,1,0,0,0,0|2,0,1]=4 523 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)N 62a_100000210206_100010150747 [0,1,0,0,0,0|2,0,1]=4 524 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)N 62a_100009998378_100000210206 [0,1,0,0,0,0|2,0,1]=4 525 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)O 62a_100000210206_100010150825 [0,1,0,0,0,0|2,0,1]=4 526 B15R1.11677 COC(=O)c1ccc(cc1SC(C)C)O 62a_100010150825_100000210206 [0,1,0,0,0,0|2,0,1]=4 527 B15R1.11677 COC(=O)c1ccc(nc1C=C(C)C)C 271570a_100102525489_100000054099 [0,1,0,0,0,0|3,0,0]=4 528 B15R1.11677 COC(=O)c1ccc(nc1C=C(C)C)N 271570a_100102525489_100009865240 [0,1,0,0,0,0|3,0,0]=4 529 B15R1.11677 COC(=O)c1ccc(nc1C=C(C)C)O 271570a_100102525489_100016008356 [0,1,0,0,0,0|3,0,0]=4 530 B15R1.11677 COC(=O)c1cnc(cc1C=C(C)C)C 271570a_100102525489_100011998247 [0,1,0,0,0,0|3,0,0]=4 531 B15R1.11677 COC(=O)c1cnc(cc1NC(C)C)C 27a_100138425928_100011998247 [0,1,0,0,0,0|2,0,1]=4 532 B15R1.11677 COC(=O)c1ncc(cc1C=C(C)C)C 271570a_100102525489_100010167497 [0,1,0,0,0,0|3,0,0]=4 533 B15R1.11677 COC(=O)c1ncc(cc1C=C(C)C)F 271570a_100102525489_100010189631 [0,1,0,0,0,0|3,0,0]=4 534 B15R1.11746 CC(=O)Nc1cccc(c1C(=O)CF)Cl 1458a_200011219801_100015361967 [0,1,0,0,0,0|2,0,0]=3 535 B15R1.11746 CC(=O)Nc1cccc(c1C(=O)CF)F 1458a_100000756107_100015361967 [0,1,0,0,0,0|2,0,0]=3 536 B15R1.11746 CCC(=O)c1c(cccc1NC(=O)C)Cl 1458a_200011219801_100000210202 [0,1,0,0,0,0|1,0,0]=2 537 B15R1.11746 CCC(=O)c1c(cccc1NC(=O)C)F 1458a_100000756107_100000210202 [0,1,0,0,0,0|1,0,0]=2 538 B15R1.11746 CNC(=O)c1c(cccc1C=C(C)C)F 271570a_100102525489_100012642803 [0,1,0,0,0,0|3,0,0]=4 539 B15R1.11746 CNC(=O)c1c(cccc1NC(=O)C)Cl 240690a_100102657272_200011219801 [0,1,0,0,0,0|1,0,0]=2 540 B15R1.11746 CNC(=O)c1c(cccc1NC(=O)C)F 240690a_100102657272_100000756107 [0,1,0,0,0,0|1,0,0]=2 541 B15R1.11746 CNC(=O)c1c(cccc1NC(C)C)F 27a_100138425928_100012642803 [0,1,0,0,0,0|2,0,1]=4 542 B15R1.11746 COC(=O)c1c(cccc1C=C(C)C)Br 271570a_100102525489_100010247157 [0,1,0,0,0,0|2,0,0]=3 543 B15R1.11746 COC(=O)c1c(cccc1C=C(C)C)C 271570a_100102525489_100010204206 [0,1,0,0,0,0|2,0,0]=3 544 B15R1.11746 COC(=O)c1c(cccc1C=C(C)C)Cl 271570a_100102525489_100010150959 [0,1,0,0,0,0|2,0,0]=3 545 B15R1.11746 COC(=O)c1c(cccc1C=C(C)C)F 271570a_100102525489_100000150693 [0,1,0,0,0,0|2,0,0]=3 546 B15R1.11746 COC(=O)c1c(cccc1C=C(C)C)N 271570a_100102525489_100010253892 [0,1,0,0,0,0|2,0,0]=3 547 B15R1.11746 COC(=O)c1c(cccc1CC(=O)C)I 1458a_100000070787_200010272806 [0,1,0,0,0,0|1,0,0]=2 548 B15R1.11746 COC(=O)c1c(cccc1CN(C)C)I 2230a_100102631434_200010272806 [0,1,0,0,0,0|3,0,0]=4 549 B15R1.11746 COC(=O)c1c(cccc1CN(C)C)I 269982a_100102631434_200010272806 [0,1,0,0,0,0|3,0,0]=4 550 B15R1.11746 COC(=O)c1c(cccc1OC(C)C)C 34a_100000084604_100000210206 [0,1,0,0,0,0|2,0,1]=4 551 B15R1.11746 COC(=O)c1c(cccc1OC(C)C)C 7a_100000084604_100000210206 [0,1,0,0,0,0|2,0,1]=4 552 B15R1.11746 COC(=O)c1c(cccc1OC(C)C)Cl 34a_200000055445_100000210206 [0,1,0,0,0,0|2,0,1]=4 553 B15R1.11746 COC(=O)c1c(cccc1OC(C)C)Cl 7a_200000055445_100000210206 [0,1,0,0,0,0|2,0,1]=4 554 B15R1.11746 COC(=O)c1c(cccc1OC(C)C)F 34a_100011216559_100000210206 [0,1,0,0,0,0|2,0,1]=4 555 B15R1.11746 COC(=O)c1c(cccc1OC(C)C)F 7a_100011216559_100000210206 [0,1,0,0,0,0|2,0,1]=4 556 B15R1.11746 COC(=O)c1c(cccc1SC(C)C)Br 62a_100000210206_100010247157 [0,1,0,0,0,0|2,0,1]=4 557 B15R1.11746 COC(=O)c1c(cccc1SC(C)C)Br 62a_100010247157_100000210206 [0,1,0,0,0,0|2,0,1]=4 558 B15R1.11746 COC(=O)c1c(cccc1SC(C)C)C 62a_100000210206_100010204206 [0,1,0,0,0,0|2,0,1]=4 559 B15R1.11746 COC(=O)c1c(cccc1SC(C)C)C 62a_100010204206_100000210206 [0,1,0,0,0,0|2,0,1]=4 560 B15R1.11746 COC(=O)c1c(cccc1SC(C)C)Cl 62a_100000210206_100010150959 [0,1,0,0,0,0|2,0,1]=4 561 B15R1.11746 COC(=O)c1c(cccc1SC(C)C)Cl 62a_100010150959_100000210206 [0,1,0,0,0,0|2,0,1]=4 562 B15R1.11746 COC(=O)c1c(cccc1SC(C)C)F 62a_100000150693_100000210206 [0,1,0,0,0,0|2,0,1]=4 563 B15R1.11746 COC(=O)c1c(cccc1SC(C)C)F 62a_100000210206_100000150693 [0,1,0,0,0,0|2,0,1]=4 564 B15R1.11746 COC(=O)c1c(cccc1SC(C)C)N 62a_100010253892_100000210206 [0,1,0,0,0,0|2,0,1]=4 565 B15R1.11746 COC(=O)c1c(ccnc1C=C(C)C)F 271570a_100102525489_100015560809 [0,1,0,0,0,0|3,0,0]=4 566 B15R1.11746 COC(=O)c1c(ccnc1C=C(C)C)N 271570a_100102525489_100009985557 [0,1,0,0,0,0|3,0,0]=4 567 B15R1.11746 COC(=O)c1c(ccnc1Cl)C=C(C)C 271570a_100102525489_100010138530 [0,1,0,0,0,0|3,0,0]=4 568 B15R1.11746 COC(=O)c1c(ccnc1F)C=C(C)C 271570a_100102525489_100010150474 [0,1,0,0,0,0|3,0,0]=4 569 B15R1.11746 COC(=O)c1c(cncc1C=C(C)C)F 271570a_100102525489_100010189632 [0,1,0,0,0,0|3,0,0]=4 570 B15R1.38499 CNC(=O)c1cccc(c1NC(=O)C)C 11a_100000223168_100015343762 [0,1,0,0,0,0|1,0,0]=2 571 B15R1.38499 CNC(=O)c1cccc(c1NC(=O)C)C 1626a_100000223168_100015343762 [0,1,0,0,0,0|1,0,0]=2 572 B15R1.38499 CNC(=O)c1cccc(c1NC(=O)C)Cl 1626a_200012181065_100015343762 [0,1,0,0,0,0|1,0,0]=2 573 B15R1.38499 CNC(=O)c1cccc(c1NC(C)C)C 34a_100000223168_100000210206 [0,1,0,0,0,0|2,0,1]=4 574 B15R1.38499 CNC(=O)c1cccc(c1NC(C)C)Cl 34a_200012181065_100000210206 [0,1,0,0,0,0|2,0,1]=4 575 B15R1.38499 COC(=O)c1cccc(c1C=C(C)C)Br 271570a_100102525489_100010150843 [0,1,0,0,0,0|2,0,0]=3 576 B15R1.38499 COC(=O)c1cccc(c1C=C(C)C)C 271570a_100102525489_100012002529 [0,1,0,0,0,0|2,0,0]=3 577 B15R1.38499 COC(=O)c1cccc(c1C=C(C)C)F 271570a_100102525489_100012357630 [0,1,0,0,0,0|2,0,0]=3 578 B15R1.38499 COC(=O)c1cccc(c1C=C(C)C)N 271570a_100102525489_100000719424 [0,1,0,0,0,0|2,0,0]=3 579 B15R1.38499 COC(=O)c1cccc(c1C=C(C)C)O 271570a_100102525489_200010230364 [0,1,0,0,0,0|2,0,0]=3 580 B15R1.38499 COC(=O)c1cccc(c1CC(=O)C)Br 1458a_100000070787_100012352084 [0,1,0,0,0,0|1,0,0]=2 581 B15R1.38499 COC(=O)c1cccc(c1CC(=O)C)Cl 1458a_100000070787_100000725332 [0,1,0,0,0,0|1,0,0]=2 582 B15R1.38499 COC(=O)c1cccc(c1CC(=O)C)F 1458a_100000070787_100010239718 [0,1,0,0,0,0|1,0,0]=2 583 B15R1.38499 COC(=O)c1cccc(c1CC(=O)C)I 1458a_100000070787_100011003723 [0,1,0,0,0,0|1,0,0]=2 584 B15R1.38499 COC(=O)c1cccc(c1CN(C)C)Br 2230a_100102631434_100012352084 [0,1,0,0,0,0|3,0,0]=4 585 B15R1.38499 COC(=O)c1cccc(c1CN(C)C)Br 269982a_100102631434_100012352084 [0,1,0,0,0,0|3,0,0]=4 586 B15R1.38499 COC(=O)c1cccc(c1CN(C)C)Cl 2230a_100102631434_100000725332 [0,1,0,0,0,0|3,0,0]=4 587 B15R1.38499 COC(=O)c1cccc(c1CN(C)C)Cl 269982a_100102631434_100000725332 [0,1,0,0,0,0|3,0,0]=4 588 B15R1.38499 COC(=O)c1cccc(c1CN(C)C)F 2230a_100102631434_100010239718 [0,1,0,0,0,0|3,0,0]=4 589 B15R1.38499 COC(=O)c1cccc(c1CN(C)C)F 269982a_100102631434_100010239718 [0,1,0,0,0,0|3,0,0]=4 590 B15R1.38499 COC(=O)c1cccc(c1CN(C)C)I 2230a_100102631434_100011003723 [0,1,0,0,0,0|3,0,0]=4 591 B15R1.38499 COC(=O)c1cccc(c1CN(C)C)I 269982a_100102631434_100011003723 [0,1,0,0,0,0|3,0,0]=4 592 B15R1.38499 COC(=O)c1cccc(c1NC(=O)C)C 188690a_100000741038_100015343762 [0,1,0,0,0,0|0,0,0]=1 593 B15R1.38499 COC(=O)c1cccc(c1OC(C)C)Br 34a_100009816214_100000210206 [0,1,0,0,0,0|2,0,1]=4 594 B15R1.38499 COC(=O)c1cccc(c1OC(C)C)C 34a_100000149854_100000210206 [0,1,0,0,0,0|2,0,1]=4 595 B15R1.38499 COC(=O)c1cccc(c1OC(C)C)C 7a_100000149854_100000210206 [0,1,0,0,0,0|2,0,1]=4 596 B15R1.38499 COC(=O)c1cccc(c1OC(C)C)Cl 34a_100000074923_100000210206 [0,1,0,0,0,0|2,0,1]=4 597 B15R1.38499 COC(=O)c1cccc(c1OC(C)C)Cl 7a_100000074923_100000210206 [0,1,0,0,0,0|2,0,1]=4 598 B15R1.38499 COC(=O)c1cccc(c1OC(C)C)F 34a_100000082593_100000210206 [0,1,0,0,0,0|2,0,1]=4 599 B15R1.38499 COC(=O)c1cccc(c1OC(C)C)F 7a_100000082593_100000210206 [0,1,0,0,0,0|2,0,1]=4 600 B15R1.38499 COC(=O)c1cccc(c1OC(C)C)N 34a_100000750886_100000210206 [0,1,0,0,0,0|2,0,1]=4 601 B15R1.38499 COC(=O)c1cccc(c1SC(C)C)Br 62a_100000210206_100010150843 [0,1,0,0,0,0|2,0,1]=4 602 B15R1.38499 COC(=O)c1cccc(c1SC(C)C)Br 62a_100010150843_100000210206 [0,1,0,0,0,0|2,0,1]=4 603 B15R1.38499 COC(=O)c1cccc(c1SC(C)C)C 62a_100000210206_100012002529 [0,1,0,0,0,0|2,0,1]=4 604 B15R1.38499 COC(=O)c1cccc(c1SC(C)C)C 62a_100012002529_100000210206 [0,1,0,0,0,0|2,0,1]=4 605 B15R1.38499 COC(=O)c1cccc(c1SC(C)C)F 62a_100000210206_100012357630 [0,1,0,0,0,0|2,0,1]=4 606 B15R1.38499 COC(=O)c1cccc(c1SC(C)C)F 62a_100012357630_100000210206 [0,1,0,0,0,0|2,0,1]=4 607 B15R1.38499 COC(=O)c1cccc(c1SC(C)C)N 62a_100000719424_100000210206 [0,1,0,0,0,0|2,0,1]=4 608 B15R1.38499 COC(=O)c1cccc(c1SC(C)C)O 62a_100000210206_200010230364 [0,1,0,0,0,0|2,0,1]=4 609 B15R1.38499 COC(=O)c1cccc(c1SC(C)C)O 62a_200010230364_100000210206 [0,1,0,0,0,0|2,0,1]=4 610 B15R2.19309 CCC(=O)c1cccc2c1oc(n2)C 1458a_100011934341_100000210202 [0,0,0,1,0,0|3,0,0]=4 611 B15R2.19309 CNC(=O)c1cccc2c1CC(=O)N2 240690a_100102657272_100000098511 [0,0,0,1,0,0|3,0,0]=4 612 B15R2.19309 CNC(=O)c1cccc2c1CC(=O)N2 527a_100102657272_100000098511 [0,0,0,1,0,0|3,0,0]=4 613 B15R2.19309 CNC(=O)c1cccc2c1NC(=O)C2 240690a_100102657272_100000082743 [0,0,0,1,0,0|1,0,0]=2 614 B15R2.19309 CNC(=O)c1cccc2c1oc(n2)C 11a_106832991635_100011934341 [0,0,0,1,0,0|3,0,0]=4 615 B15R2.19309 CNC(=O)c1cccc2c1oc(n2)C 1626a_100102657272_100011934341 [0,0,0,1,0,0|3,0,0]=4 616 B15R2.19309 CNC(=O)c1cccc2c1oc(n2)C 527a_100102657272_100011934341 [0,0,0,1,0,0|3,0,0]=4 617 B15R2.19309 COC(=O)c1cccc2c1CN(C2)C 2230a_100016997665_200000210301 [0,0,0,1,0,0|3,0,0]=4 618 B15R2.19309 COC(=O)c1cccc2c1CN(C2)C 269982a_100016997665_200000210301 [0,0,0,1,0,0|3,0,0]=4 619 B15R2.19309 COC(=O)c1cccc2c1CN(C2)[13CH3] 2230a_100016997665_200025704644 [0,0,0,1,0,0|3,0,0]=4 620 B15R2.19309 COC(=O)c1cccc2c1CN(C2)[13CH3] 269982a_100016997665_200025704644 [0,0,0,1,0,0|3,0,0]=4 621 B15R2.19309 COC(=O)c1cccc2c1nc(s2)O 271570a_203496583355_100010739869 [0,0,0,1,0,0|1,0,2]=4 622 B15R2.19335 CNC(=O)c1ccccc1NC2CC2 27a_100000212008_100000155073 [0,0,0,1,0,0|2,0,1]=4 623 B15R2.19335 CNC(=O)c1ccccc1NC2CC2 34a_100000185696_100000211595 [0,0,0,1,0,0|2,0,1]=4 624 B15R2.19335 COC(=O)c1ccccc1SC2CC2 62a_100000148710_100000211595 [0,0,0,1,0,0|2,0,1]=4 625 B15R2.19335 COC(=O)c1cccnc1NC2CC2 27a_100000212008_100000150852 [0,0,0,1,0,0|2,0,1]=4 626 B15R2.39201 C=Cc1cn(c2c1cccc2)C(=O)C 271570a_100011290941_100010365038 [0,0,0,1,0,0|2,0,1]=4 627 B15R2.49945 CC(=Cc1cccc2c1C(=O)CC2)C 271570a_100102525489_100009816781 [0,0,0,1,0,0|3,0,0]=4 628 B15R2.49945 CC(=Cc1cccc2c1C(=O)NC2)C 271570a_100102525489_100000724024 [0,0,0,1,0,0|3,0,0]=4 629 B15R2.49945 CC(=Cc1cccc2c1C(=O)OC2)C 271570a_100102525489_100010132333 [0,0,0,1,0,0|2,0,0]=3 630 B15R2.49945 CC(=O)Nc1cccc2c1C(=O)NC2 11a_100000026006_100015343762 [0,0,0,1,0,0|1,0,0]=2 631 B15R2.49945 CC(=O)Nc1cccc2c1C(=O)NC2 1626a_100000026006_100015343762 [0,0,0,1,0,0|1,0,0]=2 632 B15R2.49945 CC(=O)Nc1cccc2c1c(n[nH]2)Br 527a_100010186038_100103153847 [0,0,0,1,0,0|3,0,0]=4 633 B15R2.49945 CC(=O)Nc1cccc2c1c(n[nH]2)I 527a_100000049729_100103153847 [0,0,0,1,0,0|3,0,0]=4 634 B15R2.49945 CC(C)Sc1cccc2c1C(=O)OC2 62a_100010132333_100000210206 [0,0,0,1,0,0|2,0,1]=4 635 B13R1.547 C=C(C)c1ccccc1C(=O)NC 271570a_100000694244_100000155073 [0,0,0,0,1,0|2,0,0]=3 636 B13R1.547 C=C(C)c1ccccc1C(=O)NN 271570a_100000694244_100000190081 [0,0,0,0,1,0|3,0,0]=4 637 B13R1.547 C=C(C)c1ccccc1C(=O)OC 271570a_100000694244_100000148710 [0,0,0,0,1,0|1,0,0]=2 638 B13R1.547 C=C(C)c1cccnc1C(=O)OC 271570a_100000694244_100011935214 [0,0,0,0,1,0|2,0,0]=3 639 B13R1.547 C=C(C)c1ccncc1C(=O)OC 271570a_100000694244_100020629055 [0,0,0,0,1,0|2,0,0]=3 640 B13R1.547 C=C(C)c1cnccc1C(=O)OC 271570a_100000694244_100010008606 [0,0,0,0,1,0|2,0,0]=3 641 B13R1.547 C=C(C)c1cncnc1C(=O)OC 271570a_100000694244_100012360100 [0,0,0,0,1,0|3,0,0]=4 642 B13R1.547 C=C(C)c1ncccc1C(=O)NC 271570a_100000694244_100000159833 [0,0,0,0,1,0|3,0,0]=4 643 B13R1.547 C=C(C)c1ncccc1C(=O)OC 271570a_100000694244_100000150852 [0,0,0,0,1,0|2,0,0]=3 644 B13R1.547 C=C(C)c1nccnc1C(=O)OC 271570a_100000694244_100000688410 [0,0,0,0,1,0|3,0,0]=4 645 B13R1.547 C=C(C)c1ncncc1C(=O)OC 271570a_100000694244_100000726419 [0,0,0,0,1,0|3,0,0]=4 646 B13R1.547 CCC(=O)c1ccccc1C(C)C 1458a_100011941426_100000210202 [0,0,0,0,1,0|2,0,1]=4 647 B13R1.547 CCC(=O)c1ccccc1I(=O)=O 1458a_100000061294_100000210202 [0,0,0,0,1,0|3,0,0]=4 648 B13R1.547 CCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000210202 [0,0,0,0,1,0|3,0,0]=4 649 B13R1.547 CCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100000210202 [0,0,0,0,1,0|2,0,0]=3 650 B13R1.547 CCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210202 [0,0,0,0,1,0|3,0,0]=4 651 B13R1.547 CNC(=O)c1ccccc1C(C)C 11a_106832991635_100011941426 [0,0,0,0,1,0|2,0,1]=4 652 B13R1.547 CNC(=O)c1ccccc1C(C)C 1626a_100102657272_100011941426 [0,0,0,0,1,0|2,0,1]=4 653 B13R1.547 CNC(=O)c1ccccc1C(C)C 240690a_100102657272_100011941426 [0,0,0,0,1,0|2,0,1]=4 654 B13R1.547 CNC(=O)c1ccccc1C(C)C 527a_100102657272_100011941426 [0,0,0,0,1,0|2,0,1]=4 655 B13R1.547 CNC(=O)c1ccccc1I(=O)=O 1626a_100102657272_100000061294 [0,0,0,0,1,0|3,0,0]=4 656 B13R1.547 CNC(=O)c1ccccc1I(=O)=O 240690a_100102657272_100000061294 [0,0,0,0,1,0|3,0,0]=4 657 B13R1.547 CNC(=O)c1ccccc1N(C)C 11a_106832991635_100011218752 [0,0,0,0,1,0|3,0,0]=4 658 B13R1.547 CNC(=O)c1ccccc1N(C)C 1626a_100102657272_100011218752 [0,0,0,0,1,0|3,0,0]=4 659 B13R1.547 CNC(=O)c1ccccc1N(C)C 240690a_100102657272_100011218752 [0,0,0,0,1,0|3,0,0]=4 660 B13R1.547 CNC(=O)c1ccccc1N(C)C 27a_100102631434_100000155073 [0,0,0,0,1,0|3,0,0]=4 661 B13R1.547 CNC(=O)c1ccccc1N(C)C 527a_100102657272_100011218752 [0,0,0,0,1,0|3,0,0]=4 662 B13R1.547 CNC(=O)c1ccccc1S(=O)C 1626a_100102657272_100000204632 [0,0,0,0,1,0|2,0,0]=3 663 B13R1.547 CNC(=O)c1ccccc1S(=O)C 240690a_100102657272_100000204632 [0,0,0,0,1,0|2,0,0]=3 664 B13R1.547 CNC(=O)c1ccccc1[N+](=O)[O-] 11a_106832991635_100000188706 [0,0,0,0,1,0|3,0,0]=4 665 B13R1.547 CNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100102657272_100000188706 [0,0,0,0,1,0|3,0,0]=4 666 B13R1.547 CNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100102657272_100000188706 [0,0,0,0,1,0|3,0,0]=4 667 B13R1.547 CNC(=O)c1ccccc1[N+](=O)[O-] 527a_100102657272_100000188706 [0,0,0,0,1,0|3,0,0]=4 668 B13R1.547 COC(=O)c1ccccc1C(=O)C 1458a_100011215673_200000210301 [0,0,0,0,1,0|0,0,0]=1 669 B13R1.547 COC(=O)c1ccccc1C(=O)[13CH3] 1458a_100011215673_200025704644 [0,0,0,0,1,0|0,0,0]=1 670 B13R1.547 COC(=O)c1ccccc1N(C)C 269982a_100000170468_200000210301 [0,0,0,0,1,0|2,0,0]=3 671 B13R1.547 COC(=O)c1ccccc1N(C)C 34a_100000170468_200000210301 [0,0,0,0,1,0|2,0,0]=3 672 B13R1.547 COC(=O)c1ccccc1N(C)[13CH3] 269982a_100000170468_200025704644 [0,0,0,0,1,0|2,0,0]=3 673 B13R1.547 COC(=O)c1ccccc1N(C)[13CH3] 34a_100000170468_200025704644 [0,0,0,0,1,0|2,0,0]=3 674 B13R1.547 COC(=O)c1cccnc1N(C)C 27a_100102631434_100000150852 [0,0,0,0,1,0|3,0,0]=4 675 B13R1.547 CS(=O)c1ccccc1C(=O)CF 1458a_100000204632_100015361967 [0,0,0,0,1,0|3,0,0]=4 676 B13R1.551 COC(=O)c1[nH]ccc1C=C(C)C 271570a_100102525489_100102525103 [0,0,0,0,1,0|3,0,0]=4 677 B13R1.551 COC(=O)c1ccoc1C=C(C)C 271570a_100102525489_100011935261 [0,0,0,0,1,0|3,0,0]=4 678 B13R1.551 COC(=O)c1ccoc1CC(=O)C 1458a_100000070787_100009813464 [0,0,0,0,1,0|2,0,0]=3 679 B13R1.551 COC(=O)c1ccsc1C=C(C)C 271570a_100102525489_100009822520 [0,0,0,0,1,0|3,0,0]=4 680 B13R1.551 COC(=O)c1cscc1C=C(C)C 271570a_100102525489_100012351140 [0,0,0,0,1,0|3,0,0]=4 681 B13R1.551 COC(=O)c1occc1C=C(C)C 271570a_100102525489_100012676306 [0,0,0,0,1,0|3,0,0]=4 682 B13R1.551 COC(=O)c1occc1CC(=O)C 1458a_100000070787_100000734845 [0,0,0,0,1,0|2,0,0]=3 683 B13R1.551 COC(=O)c1sccc1C=C(C)C 271570a_100102525489_100000730364 [0,0,0,0,1,0|3,0,0]=4 684 B15R1.985 C=C(C)CNc1ccccc1C(=O)NC 27a_100000765925_100000155073 [0,0,0,0,0,1|2,0,0]=3 685 B15R1.985 C=C(C)CNc1ccccc1C(=O)NC 34a_100000185696_100000748629 [0,0,0,0,0,1|2,0,0]=3 686 B15R1.985 C=C(C)CNc1ncccc1C(=O)NC 27a_100000765925_100000159833 [0,0,0,0,0,1|3,0,0]=4 687 B15R1.985 C=C(C)CNc1ncccc1C(=O)OC 27a_100000765925_100000150852 [0,0,0,0,0,1|2,0,0]=3 688 B15R1.985 C=C(C)CNc1nccnc1C(=O)OC 27a_100000765925_100000079898 [0,0,0,0,0,1|3,0,0]=4 689 B15R1.985 C=C(C)CNc1ncncc1C(=O)OC 27a_100000765925_100000726419 [0,0,0,0,0,1|3,0,0]=4 690 B15R1.985 C=C(C)COc1ccccc1C(=O)CC 1458a_100000217157_100000210202 [0,0,0,0,0,1|3,0,0]=4 691 B15R1.985 C=C(C)COc1ccccc1C(=O)CC 7a_100000184720_100000748629 [0,0,0,0,0,1|3,0,0]=4 692 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 11a_106832991635_100000217157 [0,0,0,0,0,1|3,0,0]=4 693 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 1626a_100102657272_100000217157 [0,0,0,0,0,1|3,0,0]=4 694 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 240690a_100102657272_100000217157 [0,0,0,0,0,1|3,0,0]=4 695 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 34a_100000185920_100000748629 [0,0,0,0,0,1|3,0,0]=4 696 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 527a_100102657272_100000217157 [0,0,0,0,0,1|3,0,0]=4 697 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 7a_100000185920_100000748629 [0,0,0,0,0,1|3,0,0]=4 698 B15R1.985 C=C(C)COc1ccccc1C(=O)OC 7a_100000150335_100000748629 [0,0,0,0,0,1|2,0,0]=3 699 B15R1.985 C=C(C)COc1cccnc1C(=O)OC 34a_100000744052_100000748629 [0,0,0,0,0,1|3,0,0]=4 700 B15R1.985 C=C(C)COc1cccnc1C(=O)OC 7a_100000744052_100000748629 [0,0,0,0,0,1|3,0,0]=4 701 B15R1.985 C=C(C)CSc1ccccc1C(=O)NC 62a_100000155073_100000211660 [0,0,0,0,0,1|3,0,0]=4 702 B15R1.985 C=C(C)CSc1ccccc1C(=O)NC 62a_100000748629_100000155073 [0,0,0,0,0,1|3,0,0]=4 703 B15R1.985 C=C(C)CSc1ccccc1C(=O)OC 62a_100000148710_100000211660 [0,0,0,0,0,1|2,0,0]=3 704 B15R1.985 C=C(C)CSc1ccccc1C(=O)OC 62a_100000748629_100000148710 [0,0,0,0,0,1|2,0,0]=3 705 B15R1.985 C=C(C)CSc1ccccc1C(=O)O[Na] 62a_100000748629_114855342371 [0,0,0,0,0,1|3,0,0]=4 706 B15R1.985 C=C(C)CSc1cccnc1C(=O)OC 62a_100000748629_100011935214 [0,0,0,0,0,1|3,0,0]=4 707 B15R1.985 C=C(C)CSc1cccnc1C(=O)OC 62a_100011935214_100000211660 [0,0,0,0,0,1|3,0,0]=4 708 B15R1.985 C=C(C)CSc1ccncc1C(=O)OC 62a_100000748629_100020629055 [0,0,0,0,0,1|3,0,0]=4 709 B15R1.985 C=C(C)CSc1ccncc1C(=O)OC 62a_100020629055_100000211660 [0,0,0,0,0,1|3,0,0]=4 710 B15R1.985 C=C(C)CSc1cnccc1C(=O)OC 62a_100000748629_100010008606 [0,0,0,0,0,1|3,0,0]=4 711 B15R1.985 C=C(C)CSc1cnccc1C(=O)OC 62a_100010008606_100000211660 [0,0,0,0,0,1|3,0,0]=4 712 B15R1.985 C=C(C)CSc1ncccc1C(=O)OC 62a_100000748629_100000150852 [0,0,0,0,0,1|3,0,0]=4 713 B15R1.985 C=C(C)CSc1ncccc1C(=O)OC 62a_100011587185_100000211660 [0,0,0,0,0,1|3,0,0]=4 714 B15R1.985 C=C(F)CNc1ccccc1C(=O)NC 34a_100000185696_100009893438 [0,0,0,0,0,1|2,0,1]=4 715 B15R1.985 C=C(F)COc1ccccc1C(=O)OC 7a_100000150335_100000042424 [0,0,0,0,0,1|2,0,1]=4 716 B15R1.985 C=C(F)CSc1ccccc1C(=O)OC 62a_100000042424_100000148710 [0,0,0,0,0,1|2,0,1]=4 717 B15R1.985 C=C(F)CSc1ccccc1C(=O)OC 62a_100000148710_100000042424 [0,0,0,0,0,1|2,0,1]=4 718 B15R1.985 CCC(=O)c1ccccc1OCC(=O)N 7a_100000184720_100000187820 [0,0,0,0,0,1|3,0,0]=4 719 B15R1.985 CCC(=O)c1ccccc1SCC(=O)N 1458a_100000180052_100000210202 [0,0,0,0,0,1|3,0,0]=4 720 B15R1.985 CNC(=O)c1ccccc1NCC(=O)N 34a_100000185696_100000187820 [0,0,0,0,0,1|2,0,0]=3 721 B15R1.985 CNC(=O)c1ccccc1NCC(=O)[O-] 34a_100000185696_100020667443 [0,0,0,0,0,1|2,0,0]=3 722 B15R1.985 CNC(=O)c1ccccc1NCC(C)C 27a_100000210953_100000155073 [0,0,0,0,0,1|2,0,1]=4 723 B15R1.985 CNC(=O)c1ccccc1NCC(C)C 34a_100000185696_100000210624 [0,0,0,0,0,1|2,0,1]=4 724 B15R1.985 CNC(=O)c1ccccc1NCC(C)O 27a_100000210904_100000155073 [0,0,0,0,0,1|1,0,2]=4 725 B15R1.985 CNC(=O)c1ccccc1NCC(C)O 34a_100000185696_100011218427 [0,0,0,0,0,1|1,0,2]=4 726 B15R1.985 CNC(=O)c1ccccc1NC[C@@H](C)O 34a_100000185696_100009817552 [0,0,0,0,0,1|1,0,2]=4 727 B15R1.985 CNC(=O)c1ccccc1NC[N+](=O)[O-] 34a_100000185696_100000761209 [0,0,0,0,0,1|3,0,0]=4 728 B15R1.985 CNC(=O)c1ccccc1OCC(=O)N 34a_100000185920_100000187820 [0,0,0,0,0,1|3,0,0]=4 729 B15R1.985 CNC(=O)c1ccccc1OCC(=O)N 7a_100000185920_100000187820 [0,0,0,0,0,1|3,0,0]=4 730 B15R1.985 CNC(=O)c1ccccc1OCC(=O)[O-] 34a_100000185920_100020667443 [0,0,0,0,0,1|3,0,0]=4 731 B15R1.985 CNC(=O)c1ccccc1SCC(=O)N 11a_106832991635_100000180052 [0,0,0,0,0,1|3,0,0]=4 732 B15R1.985 CNC(=O)c1ccccc1SCC(=O)N 240690a_100102657272_100000180052 [0,0,0,0,0,1|3,0,0]=4 733 B15R1.985 CNC(=O)c1ccccc1SCC(=O)N 527a_100102657272_100000180052 [0,0,0,0,0,1|3,0,0]=4 734 B15R1.985 CNC(=O)c1ccccc1SCC(=O)N 62a_100000155073_100000747473 [0,0,0,0,0,1|3,0,0]=4 735 B15R1.985 CNC(=O)c1ccccc1SCC(=O)N 62a_100000747473_100000155073 [0,0,0,0,0,1|3,0,0]=4 736 B15R1.985 CNC(=O)c1ccccc1SCC(=O)[O-] 62a_100000155073_100020667443 [0,0,0,0,0,1|3,0,0]=4 737 B15R1.985 CNC(=O)c1ccccc1SCC(=O)[O-] 62a_100020667443_100000155073 [0,0,0,0,0,1|3,0,0]=4 738 B15R1.985 COC(=O)c1ccccc1C=CC(C)C 271570a_100016257149_100000148710 [0,0,0,0,0,1|2,0,1]=4 739 B15R1.985 COC(=O)c1ccccc1C=CC(C)O 271570a_200011019289_100000148710 [0,0,0,0,0,1|1,0,2]=4 740 B15R1.985 COC(=O)c1ccccc1CCC(=O)C 1458a_100000070787_200010284099 [0,0,0,0,0,1|1,0,0]=2 741 B15R1.985 COC(=O)c1ccccc1CCC(=O)C 1458a_100000694103_200000210301 [0,0,0,0,0,1|1,0,0]=2 742 B15R1.985 COC(=O)c1ccccc1CCC(=O)[13CH3] 1458a_100000694103_200025704644 [0,0,0,0,0,1|1,0,0]=2 743 B15R1.985 COC(=O)c1ccccc1CCN(C)C 2230a_100102631434_200010284099 [0,0,0,0,0,1|3,0,0]=4 744 B15R1.985 COC(=O)c1ccccc1CCN(C)C 269982a_100102631434_200010284099 [0,0,0,0,0,1|3,0,0]=4 745 B15R1.985 COC(=O)c1ccccc1CNC(=O)C 188690a_100000726750_100015343762 [0,0,0,0,0,1|0,0,0]=1 746 B15R1.985 COC(=O)c1ccccc1CNC(C)C 2230a_100138425928_100000744672 [0,0,0,0,0,1|1,0,1]=3 747 B15R1.985 COC(=O)c1ccccc1CNC(C)C 34a_100138425928_100000744672 [0,0,0,0,0,1|1,0,1]=3 748 B15R1.985 COC(=O)c1ccccc1COC(C)C 34a_100000212225_100000744672 [0,0,0,0,0,1|2,0,1]=4 749 B15R1.985 COC(=O)c1ccccc1CSC(C)C 62a_100000210206_100000744672 [0,0,0,0,0,1|2,0,1]=4 750 B15R1.985 COC(=O)c1ccccc1CSC(C)C 62a_100000744672_100000210206 [0,0,0,0,0,1|2,0,1]=4 751 B15R1.985 COC(=O)c1ccccc1OCC(=O)N 7a_100000150335_100000187820 [0,0,0,0,0,1|2,0,0]=3 752 B15R1.985 COC(=O)c1ccccc1OCC(C)C 7a_100000150335_100000210760 [0,0,0,0,0,1|2,0,1]=4 753 B15R1.985 COC(=O)c1ccccc1OCC(C)O 7a_100000150335_100011218427 [0,0,0,0,0,1|1,0,2]=4 754 B15R1.985 COC(=O)c1ccccc1OC[C@@H](C)O 7a_100000150335_100009817552 [0,0,0,0,0,1|1,0,2]=4 755 B15R1.985 COC(=O)c1ccccc1SCC(=O)N 62a_100000148710_100000747473 [0,0,0,0,0,1|2,0,0]=3 756 B15R1.985 COC(=O)c1ccccc1SCC(=O)N 62a_100000747473_100000148710 [0,0,0,0,0,1|2,0,0]=3 757 B15R1.985 COC(=O)c1ccccc1SCC(=O)[O-] 62a_100000148710_100020667443 [0,0,0,0,0,1|2,0,0]=3 758 B15R1.985 COC(=O)c1ccccc1SCC(=O)[O-] 62a_100020667443_100000148710 [0,0,0,0,0,1|2,0,0]=3 759 B15R1.985 COC(=O)c1ccccc1SCC(C)C 62a_100000148710_100000210760 [0,0,0,0,0,1|2,0,1]=4 760 B15R1.985 COC(=O)c1ccccc1SCC(C)C 62a_100000210624_100000148710 [0,0,0,0,0,1|2,0,1]=4 761 B15R1.985 COC(=O)c1ccccc1SCC(C)O 62a_100000148710_100011218427 [0,0,0,0,0,1|1,0,2]=4 762 B15R1.985 COC(=O)c1ccccc1SCC(C)O 62a_100011218427_100000148710 [0,0,0,0,0,1|1,0,2]=4 763 B15R1.985 COC(=O)c1ccccc1SC[C@@H](C)O 62a_100000148710_100009817552 [0,0,0,0,0,1|1,0,2]=4 764 B15R1.985 COC(=O)c1ccccc1SC[C@@H](C)O 62a_100009817552_100000148710 [0,0,0,0,0,1|1,0,2]=4 765 B15R1.985 COC(=O)c1ccccc1SC[N+](=O)[O-] 62a_100000148710_100000761209 [0,0,0,0,0,1|3,0,0]=4 766 B15R1.985 COC(=O)c1cccnc1CNC(=O)C 188690a_100016994483_100015343762 [0,0,0,0,0,1|1,0,0]=2 767 B15R1.985 COC(=O)c1cccnc1CNC(C)C 2230a_100138425928_100000709840 [0,0,0,0,0,1|2,0,1]=4 768 B15R1.985 COC(=O)c1cccnc1CNC(C)C 34a_100138425928_100012347567 [0,0,0,0,0,1|2,0,1]=4 769 B15R1.985 COC(=O)c1cccnc1NCC(C)C 27a_100000210953_100000150852 [0,0,0,0,0,1|2,0,1]=4 770 B15R1.985 COC(=O)c1cccnc1NCC(C)O 27a_100000210904_100000150852 [0,0,0,0,0,1|1,0,2]=4 771 B15R1.985 COC(=O)c1cccnc1SCC(=O)N 62a_100000747473_100000150852 [0,0,0,0,0,1|3,0,0]=4 772 B15R1.985 COC(=O)c1cccnc1SCC(=O)N 62a_100011587185_100000747473 [0,0,0,0,0,1|3,0,0]=4 773 B15R1.985 COC(=O)c1cccnc1SCC(=O)[O-] 62a_100011587185_100020667443 [0,0,0,0,0,1|3,0,0]=4 774 B15R1.985 COC(=O)c1cccnc1SCC(=O)[O-] 62a_100020667443_100000150852 [0,0,0,0,0,1|3,0,0]=4 775 B15R1.985 COC(=O)c1ccncc1SCC(=O)N 62a_100000747473_100010008606 [0,0,0,0,0,1|3,0,0]=4 776 B15R1.985 COC(=O)c1ccncc1SCC(=O)N 62a_100010008606_100000747473 [0,0,0,0,0,1|3,0,0]=4 777 B15R1.985 COC(=O)c1ccncc1SCC(=O)[O-] 62a_100010008606_100020667443 [0,0,0,0,0,1|3,0,0]=4 778 B15R1.985 COC(=O)c1ccncc1SCC(=O)[O-] 62a_100020667443_100010008606 [0,0,0,0,0,1|3,0,0]=4 779 B15R1.985 COC(=O)c1cnccc1SCC(=O)N 62a_100000747473_100020629055 [0,0,0,0,0,1|3,0,0]=4 780 B15R1.985 COC(=O)c1cnccc1SCC(=O)N 62a_100020629055_100000747473 [0,0,0,0,0,1|3,0,0]=4 781 B15R1.985 COC(=O)c1cnccc1SCC(=O)[O-] 62a_100020629055_100020667443 [0,0,0,0,0,1|3,0,0]=4 782 B15R1.985 COC(=O)c1cnccc1SCC(=O)[O-] 62a_100020667443_100020629055 [0,0,0,0,0,1|3,0,0]=4 783 B15R1.985 COC(=O)c1ncccc1CNC(C)C 2230a_100138425928_100010177730 [0,0,0,0,0,1|2,0,1]=4 784 B15R1.985 COC(=O)c1ncccc1CNC(C)C 34a_100138425928_100010177730 [0,0,0,0,0,1|2,0,1]=4 785 B15R1.985 COC(=O)c1ncccc1OCC(=O)N 34a_100000744052_100000187820 [0,0,0,0,0,1|3,0,0]=4 786 B15R1.985 COC(=O)c1ncccc1OCC(=O)N 7a_100000744052_100000187820 [0,0,0,0,0,1|3,0,0]=4 787 B15R1.985 COC(=O)c1ncccc1OCC(=O)[O-] 34a_100000744052_100020667443 [0,0,0,0,0,1|3,0,0]=4 788 B15R1.985 COC(=O)c1ncccc1SCC(=O)N 62a_100000747473_100011935214 [0,0,0,0,0,1|3,0,0]=4 789 B15R1.985 COC(=O)c1ncccc1SCC(=O)N 62a_100011935214_100000747473 [0,0,0,0,0,1|3,0,0]=4 790 B15R1.985 COC(=O)c1ncccc1SCC(=O)[O-] 62a_100011935214_100020667443 [0,0,0,0,0,1|3,0,0]=4 791 B15R1.985 COC(=O)c1ncccc1SCC(=O)[O-] 62a_100020667443_100011935214 [0,0,0,0,0,1|3,0,0]=4 792 B15R1.985 NC(=O)CSc1ccccc1C(=O)O[Na] 62a_100000747473_114855342371 [0,0,0,0,0,1|3,0,0]=4 793 B15R1.985 O=C([O-])CSc1ccccc1C(=O)O[Na] 62a_100020667443_114855342371 [0,0,0,0,0,1|3,0,0]=4 794 B15R1.3845 C=CC(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100000185746 [0,0,0,0,0,1|1,0,1]=3 795 B15R1.3845 C=CC(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000185746 [0,0,0,0,0,1|1,0,1]=3 796 B15R1.3845 CC(=O)Nc1ccccc1NC(=O)CO 22a_100011193560_100000210174 [0,0,0,0,0,1|2,0,0]=3 797 B15R1.3845 CCC(=O)Nc1ccccc1C=C(C)C 271570a_100102525489_100000153536 [0,0,0,0,0,1|3,0,0]=4 798 B15R1.3845 CCC(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100000210414 [0,0,0,0,0,1|1,0,0]=2 799 B15R1.3845 CCC(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100000210414 [0,0,0,0,0,1|1,0,0]=2 800 B15R1.3845 CCC(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000210414 [0,0,0,0,0,1|1,0,0]=2 801 B15R1.3845 CCC(C)Nc1ccccc1NC(=O)C 34a_100011193560_100011215416 [0,0,0,0,0,1|2,0,1]=4 802 B15R1.3845 CCC(C)Oc1ccccc1NC(=O)C 11a_100011202597_100015343762 [0,0,0,0,0,1|2,0,1]=4 803 B15R1.3845 CCC(C)Oc1ccccc1NC(=O)C 1626a_100011202597_100015343762 [0,0,0,0,0,1|2,0,1]=4 804 B15R1.3845 CCC(C)Oc1ccccc1NC(=O)C 22a_100011202597_100000070787 [0,0,0,0,0,1|2,0,1]=4 805 B15R1.3845 CCC(C)Oc1ccccc1NC(=O)C 34a_100000185124_100011215416 [0,0,0,0,0,1|2,0,1]=4 806 B15R1.3845 CCC(C)Oc1ccccc1NC(=O)C 527a_100011202597_100103153847 [0,0,0,0,0,1|2,0,1]=4 807 B15R1.3845 CCC(C)Oc1ccccc1NC(=O)C 7a_100000185124_100000758301 [0,0,0,0,0,1|2,0,1]=4 808 B15R1.3845 CCC(C)Sc1ccccc1NC(=O)C 62a_100000758301_100000153524 [0,0,0,0,0,1|2,0,1]=4 809 B15R1.3845 CNC(=O)Cc1ccccc1C=C(C)C 271570a_100102525489_200009816160 [0,0,0,0,0,1|3,0,0]=4 810 B15R1.3845 CNC(=O)Cc1ccccc1NC(=O)C 11a_100000738506_100015343762 [0,0,0,0,0,1|1,0,0]=2 811 B15R1.3845 CNC(=O)Cc1ccccc1NC(=O)C 1626a_100000738506_100015343762 [0,0,0,0,0,1|1,0,0]=2 812 B15R1.3845 CNC(=O)Cc1ccccc1NC(=O)C 22a_100000738506_100000070787 [0,0,0,0,0,1|1,0,0]=2 813 B15R1.3845 CNC(=O)Cc1ccccc1NC(=O)C 527a_100000738506_100103153847 [0,0,0,0,0,1|1,0,0]=2 814 B15R1.3845 CNC(=O)Cc1ccccc1NC(C)C 2230a_100000738506_100000210206 [0,0,0,0,0,1|2,0,1]=4 815 B15R1.3845 CNC(=O)Cc1ccccc1NC(C)C 34a_100000738506_100000210206 [0,0,0,0,0,1|2,0,1]=4 816 B15R1.3845 CNC(=O)Nc1ccccc1NC(=O)C 2430a_100011193560_100102657272 [0,0,0,0,0,1|1,0,0]=2 817 B15R1.3845 COC(=O)Cc1ccccc1C=C(C)C 271570a_100102525489_100000699816 [0,0,0,0,0,1|2,0,0]=3 818 B15R1.3845 COC(=O)Cc1ccccc1CC(=O)C 1458a_100000070787_100000094086 [0,0,0,0,0,1|1,0,0]=2 819 B15R1.3845 COC(=O)Cc1ccccc1CN(C)C 2230a_100102631434_100000094086 [0,0,0,0,0,1|3,0,0]=4 820 B15R1.3845 COC(=O)Cc1ccccc1CN(C)C 269982a_100102631434_100000094086 [0,0,0,0,0,1|3,0,0]=4 821 B15R1.3845 COC(=O)Cc1ccccc1NC(=O)C 188690a_100000766173_100015343762 [0,0,0,0,0,1|0,0,0]=1 822 B15R1.3845 COC(=O)Cc1ccccc1OC(C)C 7a_100000758901_100000210206 [0,0,0,0,0,1|2,0,1]=4 823 B15R1.3845 COC(=O)Cc1ccccc1SC(C)C 62a_100000210206_100000699816 [0,0,0,0,0,1|2,0,1]=4 824 B15R1.3845 COC(=O)Cc1ccccc1SC(C)C 62a_100000699816_100000210206 [0,0,0,0,0,1|2,0,1]=4 825 B15R1.3845 COC(=O)Cc1cccnc1C=C(C)C 271570a_100102525489_100010293180 [0,0,0,0,0,1|3,0,0]=4 826 B15R1.3845 COC(=O)Cc1ncccc1C=C(C)C 271570a_100102525489_100012347948 [0,0,0,0,0,1|3,0,0]=4 827 B15R1.3845 COC(=O)Nc1ccccc1C=C(C)C 271570a_100102525489_100000216184 [0,0,0,0,0,1|2,0,0]=3 828 B15R1.3845 COC(=O)Nc1ccccc1SC(C)C 62a_100000210206_100000216184 [0,0,0,0,0,1|2,0,1]=4 829 B15R1.3845 COC(C)Sc1ccccc1CC(=O)C 62a_100009879195_100011350739 [0,0,0,0,0,1|2,0,1]=4 830 B15R1.3845 COC(C)Sc1ccccc1CC(=O)C 62a_100011350739_100009879195 [0,0,0,0,0,1|2,0,1]=4 831 B15R1.3845 COC(C)Sc1ccccc1NC(=O)C 62a_100009879195_100000153524 [0,0,0,0,0,1|1,0,1]=3 832 B15R1.3845 COC(C)Sc1ccccc1NC(=O)N 62a_100009879195_100000742221 [0,0,0,0,0,1|2,0,1]=4 833 B15R1.3845 COC(C)Sc1ccccc1OC(=O)C 62a_100000051690_100009879195 [0,0,0,0,0,1|2,0,1]=4 834 B15R1.3845 COC(C)Sc1ccccc1OC(=O)C 62a_100009879195_100000051690 [0,0,0,0,0,1|2,0,1]=4 835 B15R1.3845 COC(C)Sc1cnccc1NC(=O)C 62a_100009879195_100016132053 [0,0,0,0,0,1|2,0,1]=4 836 B12R1.75 C#Cc1ccccc1NC(=O)C 11a_100011470550_100015343762 [2,0,0,0,0,0|0,0,2]=4 837 B12R1.75 C#Cc1ccccc1NC(=O)C 1626a_100011470550_100015343762 [2,0,0,0,0,0|0,0,2]=4 838 B12R1.75 C#Cc1ccccc1NC(=O)C 22a_100011470550_100000070787 [2,0,0,0,0,0|0,0,2]=4 839 B12R1.75 C=Cc1ccccc1CC(=O)C 271570a_100011290941_100011350739 [2,0,0,0,0,0|1,0,1]=4 840 B12R1.75 C=Cc1ccccc1NC(=O)C 11a_100012022501_100015343762 [2,0,0,0,0,0|0,0,1]=3 841 B12R1.75 C=Cc1ccccc1NC(=O)C 1626a_100012022501_100015343762 [2,0,0,0,0,0|0,0,1]=3 842 B12R1.75 C=Cc1ccccc1NC(=O)C 22a_100012022501_100000070787 [2,0,0,0,0,0|0,0,1]=3 843 B12R1.75 C=Cc1ccccc1NC(=O)C 271570a_100011290941_100000153524 [2,0,0,0,0,0|0,0,1]=3 844 B12R1.75 C=Cc1ccccc1NC(=O)N 271570a_100011290941_100000742221 [2,0,0,0,0,0|1,0,1]=4 845 B12R1.75 C=Cc1ccccc1OC(=O)C 271570a_100011290941_100000051690 [2,0,0,0,0,0|1,0,1]=4 846 B12R1.75 C=Cc1cnccc1NC(=O)C 271570a_100011290941_100016132053 [2,0,0,0,0,0|1,0,1]=4 847 B12R1.75 CC(=Cc1ccccc1C=O)C 271570a_100102525489_100000211189 [2,0,0,0,0,0|2,0,0]=4 848 B12R1.75 CC(=O)Cc1ccccc1C=O 1458a_100000070787_200009853537 [2,0,0,0,0,0|1,0,0]=3 849 B12R1.75 CC(=O)Cc1ccccc1CO 1458a_100000070787_100009816955 [2,0,0,0,0,0|1,0,1]=4 850 B12R1.75 CC(=O)Cc1ccccc1S[13CH3] 62a_100011350739_200025704644 [2,0,0,0,0,0|1,1,0]=4 851 B12R1.75 CC(=O)Cc1ccccc1S[13CH3] 62a_200025704644_100011350739 [2,0,0,0,0,0|1,1,0]=4 852 B12R1.75 CC(=O)Nc1ccccc1C#N 11a_100000211148_100015343762 [2,0,0,0,0,0|1,0,1]=4 853 B12R1.75 CC(=O)Nc1ccccc1C#N 1626a_100000211148_100015343762 [2,0,0,0,0,0|1,0,1]=4 854 B12R1.75 CC(=O)Nc1ccccc1CO 22a_100000212039_100000070787 [2,0,0,0,0,0|0,0,1]=3 855 B12R1.75 CC(=O)Nc1ccccc1N[13CH3] 34a_100011193560_200025704644 [2,0,0,0,0,0|1,0,0]=3 856 B12R1.75 CC(=O)Nc1ccccc1O[13CH3] 34a_100000185124_200025704644 [2,0,0,0,0,0|0,0,0]=2 857 B12R1.75 CC(=O)Nc1ccccc1O[13CH3] 7a_100000185124_200025704644 [2,0,0,0,0,0|0,0,0]=2 858 B12R1.75 CC(=O)Nc1ccccc1S[13CH3] 62a_200025704644_100000153524 [2,0,0,0,0,0|0,1,0]=3 859 B12R1.75 CC(=O)Nc1ccncc1S[13CH3] 62a_200025704644_100016132053 [2,0,0,0,0,0|1,1,0]=4 860 B12R1.75 CC(=O)Nc1ncccc1O[13CH3] 34a_200000022013_200025704644 [2,0,0,0,0,0|1,0,0]=3 861 B12R1.75 CC(=O)Nc1ncccc1O[13CH3] 7a_200000022013_200025704644 [2,0,0,0,0,0|1,0,0]=3 862 B12R1.75 CC(=O)Oc1ccccc1S[13CH3] 62a_100000051690_200025704644 [2,0,0,0,0,0|1,1,0]=4 863 B12R1.75 CC(=O)Oc1ccccc1S[13CH3] 62a_200025704644_100000051690 [2,0,0,0,0,0|1,1,0]=4 864 B12R1.75 CCc1ccccc1NC(=O)C 11a_100000212081_100015343762 [2,0,0,0,0,0|0,0,1]=3 865 B12R1.75 CCc1ccccc1NC(=O)C 1626a_100000212081_100015343762 [2,0,0,0,0,0|0,0,1]=3 866 B12R1.75 CCc1ccccc1NC(=O)C 22a_100000212081_100000070787 [2,0,0,0,0,0|0,0,1]=3 867 B12R1.75 CCc1ccccc1NC(=O)C 527a_100000212081_100103153847 [2,0,0,0,0,0|0,0,1]=3 868 B12R1.75 CNc1ccccc1NC(=O)C 34a_100011193560_200000210301 [2,0,0,0,0,0|1,0,0]=3 869 B12R1.75 COc1ccccc1C=C(C)C 271570a_100102525489_100000174000 [2,0,0,0,0,0|2,0,0]=4 870 B12R1.75 COc1ccccc1CC(=O)C 1458a_100000070787_100000210004 [2,0,0,0,0,0|1,0,0]=3 871 B12R1.75 COc1ccccc1CC(=O)C 1458a_100000211604_200000210301 [2,0,0,0,0,0|1,0,0]=3 872 B12R1.75 COc1ccccc1CC(=O)[13CH3] 1458a_100000211604_200025704644 [2,0,0,0,0,0|1,0,0]=3 873 B12R1.75 COc1ccccc1NC(=O)C 11a_100000210025_100015343762 [2,0,0,0,0,0|0,0,0]=2 874 B12R1.75 COc1ccccc1NC(=O)C 1626a_100000210025_100015343762 [2,0,0,0,0,0|0,0,0]=2 875 B12R1.75 COc1ccccc1NC(=O)C 22a_100000210025_100000070787 [2,0,0,0,0,0|0,0,0]=2 876 B12R1.75 COc1ccccc1NC(=O)C 34a_100000185124_200000210301 [2,0,0,0,0,0|0,0,0]=2 877 B12R1.75 COc1ccccc1NC(=O)C 527a_100000210025_100103153847 [2,0,0,0,0,0|0,0,0]=2 878 B12R1.75 COc1ccccc1NC(=O)C 7a_100000185124_200000210301 [2,0,0,0,0,0|0,0,0]=2 879 B12R1.75 COc1ccccc1NC(=S)N 7a_200000011649_200000210301 [2,0,0,0,0,0|1,1,0]=4 880 B12R1.75 COc1ccccc1NC(C)C 34a_100000210025_100000210206 [2,0,0,0,0,0|1,0,1]=4 881 B12R1.75 COc1cccnc1NC(=O)C 34a_200000022013_200000210301 [2,0,0,0,0,0|1,0,0]=3 882 B12R1.75 COc1cccnc1NC(=O)C 7a_200000022013_200000210301 [2,0,0,0,0,0|1,0,0]=3 883 B12R1.75 COc1cnccc1CC(=O)C 1458a_100000070787_100020635607 [2,0,0,0,0,0|2,0,0]=4 884 B12R1.75 COc1ncccc1CC(=O)C 1458a_100000070787_100020631285 [2,0,0,0,0,0|2,0,0]=4 885 B12R1.75 CSc1ccccc1CC(=O)C 1458a_100000070787_100000699184 [2,0,0,0,0,0|1,1,0]=4 886 B12R1.75 CSc1ccccc1CC(=O)C 62a_100011350739_200000210301 [2,0,0,0,0,0|1,1,0]=4 887 B12R1.75 CSc1ccccc1CC(=O)C 62a_200000210301_100011350739 [2,0,0,0,0,0|1,1,0]=4 888 B12R1.75 CSc1ccccc1NC(=O)C 11a_100000211160_100015343762 [2,0,0,0,0,0|0,1,0]=3 889 B12R1.75 CSc1ccccc1NC(=O)C 22a_100000211160_100000070787 [2,0,0,0,0,0|0,1,0]=3 890 B12R1.75 CSc1ccccc1NC(=O)C 62a_200000210301_100000153524 [2,0,0,0,0,0|0,1,0]=3 891 B12R1.75 CSc1ccccc1NC(=O)N 62a_200000210301_100000742221 [2,0,0,0,0,0|1,1,0]=4 892 B12R1.75 CSc1ccccc1OC(=O)C 62a_100000051690_200000210301 [2,0,0,0,0,0|1,1,0]=4 893 B12R1.75 CSc1ccccc1OC(=O)C 62a_200000210301_100000051690 [2,0,0,0,0,0|1,1,0]=4 894 B12R1.75 CSc1cnccc1NC(=O)C 62a_200000210301_100016132053 [2,0,0,0,0,0|1,1,0]=4 895 B12R1.75 [13CH3]Oc1ccccc1NC(=S)N 7a_200000011649_200025704644 [2,0,0,0,0,0|1,1,0]=4 896 B12R1.75 [13CH3]Sc1ccccc1NC(=O)N 62a_200025704644_100000742221 [2,0,0,0,0,0|1,1,0]=4 897 B12R1.169 CC=Cc1ccccc1COC 271570a_100016259895_100011493684 [2,0,0,0,0,0|1,0,1]=4 898 B12R1.169 CC=Cc1ccccc1NCC 271570a_100016259895_114873767003 [2,0,0,0,0,0|1,0,1]=4 899 B12R1.169 CCSc1ccccc1NC=O 62a_100000210202_200020615051 [2,0,0,0,0,0|2,0,0]=4 900 B12R1.169 CCSc1ccccc1NC=O 62a_200020615051_100000210202 [2,0,0,0,0,0|2,0,0]=4 901 B12R1.77 C=Cc1ccccc1C(=O)CC 1458a_100011830265_100000210202 [2,0,0,0,0,0|1,0,1]=4 902 B12R1.77 C=Cc1ccccc1C(=O)NC 1626a_100102657272_100011830265 [2,0,0,0,0,0|1,0,1]=4 903 B12R1.77 C=Cc1ccccc1C(=O)NC 271570a_100011290941_100000155073 [2,0,0,0,0,0|1,0,1]=4 904 B12R1.77 C=Cc1ccccc1C(=O)OC 271570a_100011290941_100000148710 [2,0,0,0,0,0|0,0,1]=3 905 B12R1.77 C=Cc1cccnc1C(=O)OC 271570a_100011290941_100011935214 [2,0,0,0,0,0|1,0,1]=4 906 B12R1.77 C=Cc1ccncc1C(=O)OC 271570a_100011290941_100020629055 [2,0,0,0,0,0|1,0,1]=4 907 B12R1.77 C=Cc1cnccc1C(=O)OC 271570a_100011290941_100010008606 [2,0,0,0,0,0|1,0,1]=4 908 B12R1.77 C=Cc1ncccc1C(=O)OC 271570a_100011290941_100000150852 [2,0,0,0,0,0|1,0,1]=4 909 B12R1.77 CCC(=O)c1ccccc1CC 1458a_100000689120_100000210202 [2,0,0,0,0,0|1,0,1]=4 910 B12R1.77 CCC(=O)c1ccccc1I=O 1458a_100000032414_100000210202 [2,0,0,0,0,0|2,0,0]=4 911 B12R1.77 CCC(=O)c1ccccc1OC 1458a_100000185835_100000210202 [2,0,0,0,0,0|2,0,0]=4 912 B12R1.77 CCC(=O)c1ccccc1OC 7a_100000184720_200000210301 [2,0,0,0,0,0|2,0,0]=4 913 B12R1.77 CCC(=O)c1ccccc1O[13CH3] 7a_100000184720_200025704644 [2,0,0,0,0,0|2,0,0]=4 914 B12R1.77 CCC(=O)c1ccccc1SC 1458a_100000183967_100000210202 [2,0,0,0,0,0|2,0,0]=4 915 B12R1.77 CCc1ccccc1C(=O)NC 11a_106832991635_100000689120 [2,0,0,0,0,0|1,0,1]=4 916 B12R1.77 CCc1ccccc1C(=O)NC 1626a_100102657272_100000689120 [2,0,0,0,0,0|1,0,1]=4 917 B12R1.77 CCc1ccccc1C(=O)NC 240690a_100102657272_100000689120 [2,0,0,0,0,0|1,0,1]=4 918 B12R1.77 CCc1ccccc1C(=O)NC 527a_100102657272_100000689120 [2,0,0,0,0,0|1,0,1]=4 919 B12R1.77 CNC(=O)c1ccccc1I=O 1626a_100102657272_100000032414 [2,0,0,0,0,0|2,0,0]=4 920 B12R1.77 CNC(=O)c1ccccc1I=O 240690a_100102657272_100000032414 [2,0,0,0,0,0|2,0,0]=4 921 B12R1.77 CNC(=O)c1ccccc1I=O 527a_100102657272_100000032414 [2,0,0,0,0,0|2,0,0]=4 922 B12R1.77 CNC(=O)c1ccccc1NC 27a_100102657272_100000155073 [2,0,0,0,0,0|1,0,0]=3 923 B12R1.77 CNC(=O)c1ccccc1NC 34a_100000185696_200000210301 [2,0,0,0,0,0|1,0,0]=3 924 B12R1.77 CNC(=O)c1ccccc1N[13CH3] 34a_100000185696_200025704644 [2,0,0,0,0,0|1,0,0]=3 925 B12R1.77 CNC(=O)c1ccccc1OC 11a_106832991635_100000185835 [2,0,0,0,0,0|2,0,0]=4 926 B12R1.77 CNC(=O)c1ccccc1OC 1626a_100102657272_100000185835 [2,0,0,0,0,0|2,0,0]=4 927 B12R1.77 CNC(=O)c1ccccc1OC 240690a_100102657272_100000185835 [2,0,0,0,0,0|2,0,0]=4 928 B12R1.77 CNC(=O)c1ccccc1OC 34a_100000185920_200000210301 [2,0,0,0,0,0|2,0,0]=4 929 B12R1.77 CNC(=O)c1ccccc1OC 527a_100102657272_100000185835 [2,0,0,0,0,0|2,0,0]=4 930 B12R1.77 CNC(=O)c1ccccc1OC 7a_100000185920_200000210301 [2,0,0,0,0,0|2,0,0]=4 931 B12R1.77 CNC(=O)c1ccccc1O[13CH3] 34a_100000185920_200025704644 [2,0,0,0,0,0|2,0,0]=4 932 B12R1.77 CNC(=O)c1ccccc1O[13CH3] 7a_100000185920_200025704644 [2,0,0,0,0,0|2,0,0]=4 933 B12R1.77 CNC(=O)c1ccccc1SC 11a_106832991635_100000183967 [2,0,0,0,0,0|2,0,0]=4 934 B12R1.77 CNC(=O)c1ccccc1SC 1626a_100102657272_100000183967 [2,0,0,0,0,0|2,0,0]=4 935 B12R1.77 CNC(=O)c1ccccc1SC 240690a_100102657272_100000183967 [2,0,0,0,0,0|2,0,0]=4 936 B12R1.77 CNC(=O)c1ccccc1SC 527a_100102657272_100000183967 [2,0,0,0,0,0|2,0,0]=4 937 B12R1.77 CNC(=O)c1ccccc1SC 62a_100000155073_200000210301 [2,0,0,0,0,0|2,0,0]=4 938 B12R1.77 CNC(=O)c1ccccc1SC 62a_200000210301_100000155073 [2,0,0,0,0,0|2,0,0]=4 939 B12R1.77 CNC(=O)c1ccccc1S[13CH3] 62a_100000155073_200025704644 [2,0,0,0,0,0|2,0,0]=4 940 B12R1.77 CNC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000155073 [2,0,0,0,0,0|2,0,0]=4 941 B12R1.77 CNC(=O)c1cccnc1NC 27a_100102657272_100000159833 [2,0,0,0,0,0|2,0,0]=4 942 B12R1.77 CNc1ncccc1C(=O)OC 27a_100102657272_100000150852 [2,0,0,0,0,0|1,0,0]=3 943 B12R1.77 CNc1nccnc1C(=O)OC 27a_100102657272_100000079898 [2,0,0,0,0,0|2,0,0]=4 944 B12R1.77 CNc1ncncc1C(=O)OC 27a_100102657272_100000726419 [2,0,0,0,0,0|2,0,0]=4 945 B12R1.77 COC(=O)c1ccccc1OC 7a_100000150335_200000210301 [2,0,0,0,0,0|1,0,0]=3 946 B12R1.77 COC(=O)c1ccccc1O[13CH3] 7a_100000150335_200025704644 [2,0,0,0,0,0|1,0,0]=3 947 B12R1.77 COC(=O)c1ccccc1SC 62a_100000148710_200000210301 [2,0,0,0,0,0|1,0,0]=3 948 B12R1.77 COC(=O)c1ccccc1SC 62a_200000210301_100000148710 [2,0,0,0,0,0|1,0,0]=3 949 B12R1.77 COC(=O)c1ccccc1S[13CH3] 62a_100000148710_200025704644 [2,0,0,0,0,0|1,0,0]=3 950 B12R1.77 COC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000148710 [2,0,0,0,0,0|1,0,0]=3 951 B12R1.77 COC(=O)c1cccnc1SC 62a_100011587185_200000210301 [2,0,0,0,0,0|2,0,0]=4 952 B12R1.77 COC(=O)c1cccnc1SC 62a_200000210301_100000150852 [2,0,0,0,0,0|2,0,0]=4 953 B12R1.77 COC(=O)c1cccnc1S[13CH3] 62a_100011587185_200025704644 [2,0,0,0,0,0|2,0,0]=4 954 B12R1.77 COC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000150852 [2,0,0,0,0,0|2,0,0]=4 955 B12R1.77 COC(=O)c1ccncc1SC 62a_100010008606_200000210301 [2,0,0,0,0,0|2,0,0]=4 956 B12R1.77 COC(=O)c1ccncc1SC 62a_200000210301_100010008606 [2,0,0,0,0,0|2,0,0]=4 957 B12R1.77 COC(=O)c1ccncc1S[13CH3] 62a_100010008606_200025704644 [2,0,0,0,0,0|2,0,0]=4 958 B12R1.77 COC(=O)c1ccncc1S[13CH3] 62a_200025704644_100010008606 [2,0,0,0,0,0|2,0,0]=4 959 B12R1.77 COC(=O)c1cnccc1SC 62a_100020629055_200000210301 [2,0,0,0,0,0|2,0,0]=4 960 B12R1.77 COC(=O)c1cnccc1SC 62a_200000210301_100020629055 [2,0,0,0,0,0|2,0,0]=4 961 B12R1.77 COC(=O)c1cnccc1S[13CH3] 62a_100020629055_200025704644 [2,0,0,0,0,0|2,0,0]=4 962 B12R1.77 COC(=O)c1cnccc1S[13CH3] 62a_200025704644_100020629055 [2,0,0,0,0,0|2,0,0]=4 963 B12R1.77 COC(=O)c1ncccc1OC 34a_100000744052_200000210301 [2,0,0,0,0,0|2,0,0]=4 964 B12R1.77 COC(=O)c1ncccc1OC 7a_100000744052_200000210301 [2,0,0,0,0,0|2,0,0]=4 965 B12R1.77 COC(=O)c1ncccc1O[13CH3] 34a_100000744052_200025704644 [2,0,0,0,0,0|2,0,0]=4 966 B12R1.77 COC(=O)c1ncccc1O[13CH3] 7a_100000744052_200025704644 [2,0,0,0,0,0|2,0,0]=4 967 B12R1.77 COC(=O)c1ncccc1SC 62a_100011935214_200000210301 [2,0,0,0,0,0|2,0,0]=4 968 B12R1.77 COC(=O)c1ncccc1SC 62a_200000210301_100011935214 [2,0,0,0,0,0|2,0,0]=4 969 B12R1.77 COC(=O)c1ncccc1S[13CH3] 62a_100011935214_200025704644 [2,0,0,0,0,0|2,0,0]=4 970 B12R1.77 COC(=O)c1ncccc1S[13CH3] 62a_200025704644_100011935214 [2,0,0,0,0,0|2,0,0]=4 971 B12R1.77 CSc1ccccc1C(=O)O[Na] 62a_200000210301_114855342371 [2,0,0,0,0,0|2,0,0]=4 972 B12R1.77 [13CH3]Sc1ccccc1C(=O)O[Na] 62a_200025704644_114855342371 [2,0,0,0,0,0|2,0,0]=4 973 B12R1.283 C=C(C)c1ccccc1NCC 271570a_100000694244_114873767003 [2,0,0,0,0,0|1,0,1]=4 974 B12R1.283 C=C(C)c1ccccc1NCC 34a_100000037685_100000210202 [2,0,0,0,0,0|1,0,1]=4 975 B12R1.283 CC=Cc1ccccc1C(=O)C 271570a_100016259895_100000751169 [2,0,0,0,0,0|1,0,0]=3 976 B12R1.283 CC=Cc1ccccc1C(=O)N 271570a_100016259895_100000162227 [2,0,0,0,0,0|2,0,0]=4 977 B12R1.283 CC=Cc1ccccc1S(=O)C 271570a_100016259895_100000734199 [2,0,0,0,0,0|2,0,0]=4 978 B12R1.283 CC=Cc1cccnc1C(=O)C 271570a_100016259895_100012348690 [2,0,0,0,0,0|2,0,0]=4 979 B12R1.283 CC=Cc1ccncc1C(=O)C 271570a_100016259895_100160469449 [2,0,0,0,0,0|2,0,0]=4 980 B12R1.283 CC=Cc1cnccc1C(=O)C 271570a_100016259895_100009993184 [2,0,0,0,0,0|2,0,0]=4 981 B12R1.283 CC=Cc1ncccc1C(=O)C 271570a_100016259895_100000753718 [2,0,0,0,0,0|2,0,0]=4 982 B12R1.283 CCNc1ccccc1C(=O)N 34a_100000185089_100000210202 [2,0,0,0,0,0|1,0,1]=4 983 B12R1.283 CCNc1ccncc1C(=O)C 27a_100015525214_100160469449 [2,0,0,0,0,0|1,0,1]=4 984 B12R1.283 CCNc1ncccc1C(=O)C 27a_100015525214_100009816689 [2,0,0,0,0,0|1,0,1]=4 985 B12R1.283 CCOc1ccccc1C(=O)C 1458a_100000211144_200000210301 [2,0,0,0,0,0|1,0,1]=4 986 B12R1.283 CCOc1ccccc1C(=O)[13CH3] 1458a_100000211144_200025704644 [2,0,0,0,0,0|1,0,1]=4 987 B12R1.283 CCSc1ccccc1C(=O)C 1458a_100000195471_200000210301 [2,0,0,0,0,0|1,0,1]=4 988 B12R1.283 CCSc1ccccc1C(=O)C 62a_100000751169_100000210202 [2,0,0,0,0,0|1,0,1]=4 989 B12R1.283 CCSc1ccccc1C(=O)O 62a_100000210202_100000734275 [2,0,0,0,0,0|1,0,1]=4 990 B12R1.283 CCSc1ccccc1C(=O)O 62a_202125556159_100000210202 [2,0,0,0,0,0|1,0,1]=4 991 B12R1.283 CCSc1ccccc1C(=O)[13CH3] 1458a_100000195471_200025704644 [2,0,0,0,0,0|1,0,1]=4 992 B12R1.283 CNCc1ccccc1C(=O)O 269956a_100015183376_200000210301 [2,0,0,0,0,0|2,0,0]=4 993 B12R1.283 COCc1ccccc1C(=O)C 1458a_100000737999_200000210301 [2,0,0,0,0,0|2,0,0]=4 994 B12R1.283 COCc1ccccc1C(=O)[13CH3] 1458a_100000737999_200025704644 [2,0,0,0,0,0|2,0,0]=4 995 B12R1.283 [13CH3]NCc1ccccc1C(=O)O 269956a_100015183376_200025704644 [2,0,0,0,0,0|2,0,0]=4 996 B14R1.262 CC=Cc1ccccc1NS(=O)(=O)C 271570a_100016259895_100000165598 [1,1,0,0,0,0|2,0,0]=4 997 B14R1.438 C=C=Cc1cc(ccc1NC(=O)C)Br 271570a_100015277604_100009813020 [1,1,0,0,0,0|1,0,1]=4 998 B14R1.438 C=C=Cc1cc(ccc1NC(=O)C)C 271570a_100015277604_100000152032 [1,1,0,0,0,0|1,0,1]=4 999 B14R1.438 C=C=Cc1cc(ccc1NC(=O)C)F 271570a_100015277604_100011215554 [1,1,0,0,0,0|1,0,1]=4 1000 B14R1.438 CC=Cc1cc(ccc1NC(=O)C)Br 271570a_100016259895_100009813020 [1,1,0,0,0,0|1,0,0]=3 1001 B14R1.438 CC=Cc1cc(ccc1NC(=O)C)C 271570a_100016259895_100000152032 [1,1,0,0,0,0|1,0,0]=3 1002 B14R1.438 CC=Cc1cc(ccc1NC(=O)C)F 271570a_100016259895_100011215554 [1,1,0,0,0,0|1,0,0]=3 1003 B14R1.438 CC=Cc1cc(cnc1NC(=O)C)C 271570a_100016259895_200009816786 [1,1,0,0,0,0|2,0,0]=4 1004 B14R1.438 CCNc1cc(ccc1NC(=O)C)Br 34a_100000749274_100000210202 [1,1,0,0,0,0|2,0,0]=4 1005 B14R1.438 CCNc1cc(ccc1NC(=O)C)Br 7a_100000749274_100000210202 [1,1,0,0,0,0|2,0,0]=4 1006 B14R1.438 CCNc1cc(ccc1NC(=O)C)C 2230a_100000750913_100000210202 [1,1,0,0,0,0|2,0,0]=4 1007 B14R1.438 CCNc1cc(ccc1NC(=O)C)C 34a_100000750913_100000210202 [1,1,0,0,0,0|2,0,0]=4 1008 B14R1.438 CCNc1cc(ccc1NC(=O)C)C 7a_100000750913_100000210202 [1,1,0,0,0,0|2,0,0]=4 1009 B14R1.438 CCNc1cc(ccc1NC(=O)C)Cl 34a_100000747302_100000210202 [1,1,0,0,0,0|2,0,0]=4 1010 B14R1.438 CCNc1cc(ccc1NC(=O)C)Cl 7a_100000747302_100000210202 [1,1,0,0,0,0|2,0,0]=4 1011 B14R1.438 CCOc1cc(ccc1NC(=O)C)Br 11a_100000688918_100015343762 [1,1,0,0,0,0|2,0,0]=4 1012 B14R1.438 CCOc1cc(ccc1NC(=O)C)Br 1626a_100000688918_100015343762 [1,1,0,0,0,0|2,0,0]=4 1013 B14R1.438 CCOc1cc(ccc1NC(=O)C)Br 22a_100000688918_100000070787 [1,1,0,0,0,0|2,0,0]=4 1014 B14R1.438 CCOc1cc(ccc1NC(=O)C)C 11a_100000742043_100015343762 [1,1,0,0,0,0|2,0,0]=4 1015 B14R1.438 CCOc1cc(ccc1NC(=O)C)C 1626a_100000742043_100015343762 [1,1,0,0,0,0|2,0,0]=4 1016 B14R1.438 CCOc1cc(ccc1NC(=O)C)C 22a_100000742043_100000070787 [1,1,0,0,0,0|2,0,0]=4 1017 B14R1.438 CCOc1cc(ccc1NC(=O)C)C 34a_100000161862_100000210202 [1,1,0,0,0,0|2,0,0]=4 1018 B14R1.438 CCOc1cc(ccc1NC(=O)C)C 527a_100000742043_100103153847 [1,1,0,0,0,0|2,0,0]=4 1019 B14R1.438 CCOc1cc(ccc1NC(=O)C)C 7a_100000161862_100000210202 [1,1,0,0,0,0|2,0,0]=4 1020 B14R1.438 CCOc1cc(ccc1NC(=O)C)Cl 11a_100000687649_100015343762 [1,1,0,0,0,0|2,0,0]=4 1021 B14R1.438 CCOc1cc(ccc1NC(=O)C)Cl 1626a_100000687649_100015343762 [1,1,0,0,0,0|2,0,0]=4 1022 B14R1.438 CCOc1cc(ccc1NC(=O)C)Cl 22a_100000687649_100000070787 [1,1,0,0,0,0|2,0,0]=4 1023 B14R1.438 CCOc1cc(ccc1NC(=O)C)F 11a_100000741351_100015343762 [1,1,0,0,0,0|2,0,0]=4 1024 B14R1.438 CCOc1cc(ccc1NC(=O)C)F 1626a_100000741351_100015343762 [1,1,0,0,0,0|2,0,0]=4 1025 B14R1.438 CCOc1cc(ccc1NC(=O)C)F 22a_100000741351_100000070787 [1,1,0,0,0,0|2,0,0]=4 1026 B14R1.438 CCSc1cc(ccc1NC(=O)C)Br 62a_100009813020_100000210202 [1,1,0,0,0,0|2,0,0]=4 1027 B14R1.438 CCSc1cc(ccc1NC(=O)C)C 62a_100000210202_100000152032 [1,1,0,0,0,0|2,0,0]=4 1028 B14R1.438 CCSc1cc(ccc1NC(=O)C)F 62a_100000210202_100011215554 [1,1,0,0,0,0|2,0,0]=4 1029 B14R1.483 C=C=Cc1ccccc1NC(=O)CC 271570a_100015277604_100000153536 [1,1,0,0,0,0|1,0,1]=4 1030 B14R1.483 C=C=Cc1ccccc1NC(=O)OC 271570a_100015277604_100000216184 [1,1,0,0,0,0|1,0,1]=4 1031 B14R1.483 CC=Cc1ccccc1CC(=O)NC 271570a_100016259895_200009816160 [1,1,0,0,0,0|2,0,0]=4 1032 B14R1.483 CC=Cc1ccccc1CC(=O)OC 271570a_100016259895_100000699816 [1,1,0,0,0,0|2,0,0]=4 1033 B14R1.483 CC=Cc1ccccc1NC(=O)CC 271570a_100016259895_100000153536 [1,1,0,0,0,0|1,0,0]=3 1034 B14R1.483 CC=Cc1ccccc1NC(=O)OC 271570a_100016259895_100000216184 [1,1,0,0,0,0|1,0,0]=3 1035 B14R1.483 CCCc1ccccc1NC(=O)CC 11a_100000737634_100000210414 [1,1,0,0,0,0|1,0,1]=4 1036 B14R1.483 CCCc1ccccc1NC(=O)CC 1626a_100000737634_100000210414 [1,1,0,0,0,0|1,0,1]=4 1037 B14R1.483 CCCc1ccccc1NC(=O)CC 22a_100000737634_100000210414 [1,1,0,0,0,0|1,0,1]=4 1038 B14R1.483 CCCc1ccccc1NC(=O)CC 527a_100000737634_100000210414 [1,1,0,0,0,0|1,0,1]=4 1039 B14R1.483 CCCc1ccccc1NC(=O)CO 22a_100000737634_100000210174 [1,1,0,0,0,0|1,0,1]=4 1040 B14R1.483 CCCc1ccccc1NC(=O)CO 527a_100000737634_100000210174 [1,1,0,0,0,0|1,0,1]=4 1041 B14R1.483 CCCc1ccccc1NC(=O)NC 2430a_100000737634_100102657272 [1,1,0,0,0,0|1,0,1]=4 1042 B14R1.483 CCCc1ccccc1NC(=O)NC 512a_100000737634_100102657272 [1,1,0,0,0,0|1,0,1]=4 1043 B14R1.483 CCOc1ccccc1NC(=O)CC 11a_100000211218_100000210414 [1,1,0,0,0,0|2,0,0]=4 1044 B14R1.483 CCOc1ccccc1NC(=O)CC 1626a_100000211218_100000210414 [1,1,0,0,0,0|2,0,0]=4 1045 B14R1.483 CCOc1ccccc1NC(=O)CC 22a_100000211218_100000210414 [1,1,0,0,0,0|2,0,0]=4 1046 B14R1.483 CCOc1ccccc1NC(=O)CCl 7a_100000014494_100000210202 [1,1,0,0,0,0|2,0,0]=4 1047 B14R1.483 CCOc1ccccc1NC(=O)CO 22a_100000211218_100000210174 [1,1,0,0,0,0|2,0,0]=4 1048 B14R1.483 CCOc1ccccc1NC(=O)NC 2430a_100000211218_100102657272 [1,1,0,0,0,0|2,0,0]=4 1049 B14R1.483 CCSc1ccccc1NC(=O)CC 11a_100011223125_100000210414 [1,1,0,0,0,0|2,0,0]=4 1050 B14R1.483 CCSc1ccccc1NC(=O)CC 1626a_100011223125_100000210414 [1,1,0,0,0,0|2,0,0]=4 1051 B14R1.483 CCSc1ccccc1NC(=O)CC 22a_100011223125_100000210414 [1,1,0,0,0,0|2,0,0]=4 1052 B14R1.483 CCSc1ccccc1NC(=O)CC 62a_100000210202_100000153536 [1,1,0,0,0,0|2,0,0]=4 1053 B14R1.483 CCSc1ccccc1NC(=O)CN 62a_100000210202_100000683505 [1,1,0,0,0,0|2,0,0]=4 1054 B14R1.483 CCSc1ccccc1NC(=O)CO 22a_100011223125_100000210174 [1,1,0,0,0,0|2,0,0]=4 1055 B14R1.483 CCSc1ccccc1NC(=O)NC 2430a_100011223125_100102657272 [1,1,0,0,0,0|2,0,0]=4 1056 B14R1.483 CCSc1ccccc1NC(=O)NC 512a_100011223125_100102657272 [1,1,0,0,0,0|2,0,0]=4 1057 B14R1.483 CCSc1ccccc1NC(=O)OC 62a_100000210202_100000216184 [1,1,0,0,0,0|2,0,0]=4 1058 B14R1.483 COCc1ccccc1CC(=O)OC 34a_100138415774_100000094086 [1,1,0,0,0,0|1,0,1]=4 1059 B14R1.786 CC(=O)Nc1ccccc1COCF 34a_100000192217_100015361967 [1,1,0,0,0,0|0,0,1]=3 1060 B14R1.786 CC(=O)Nc1ccccc1COCF 7a_100000192217_100015361967 [1,1,0,0,0,0|0,0,1]=3 1061 B14R1.786 CC(=O)Nc1ccccc1NCCF 34a_100011193560_100011217306 [1,1,0,0,0,0|2,0,0]=4 1062 B14R1.786 CC(=O)Nc1ccccc1NCCO 34a_100011193560_100000211926 [1,1,0,0,0,0|2,0,0]=4 1063 B14R1.786 CC(=O)Nc1ccccc1OCCF 11a_100012000959_100015343762 [1,1,0,0,0,0|2,0,0]=4 1064 B14R1.786 CC(=O)Nc1ccccc1OCCF 1626a_100012000959_100015343762 [1,1,0,0,0,0|2,0,0]=4 1065 B14R1.786 CC(=O)Nc1ccccc1OCCF 22a_100012000959_100000070787 [1,1,0,0,0,0|2,0,0]=4 1066 B14R1.786 CC(=O)Nc1ccccc1OCCF 34a_100000185124_100011217306 [1,1,0,0,0,0|2,0,0]=4 1067 B14R1.786 CC(=O)Nc1ccccc1OCCF 527a_100012000959_100103153847 [1,1,0,0,0,0|2,0,0]=4 1068 B14R1.786 CC(=O)Nc1ccccc1OCCF 7a_100000185124_100011217306 [1,1,0,0,0,0|2,0,0]=4 1069 B14R1.786 CC(=O)Nc1ccccc1OCCO 22a_100132302172_100000070787 [1,1,0,0,0,0|2,0,0]=4 1070 B14R1.786 CC(=O)Nc1ccccc1OCCO 34a_100000185124_100000211926 [1,1,0,0,0,0|2,0,0]=4 1071 B14R1.786 CC(=O)Nc1ccccc1OCCO 7a_100000185124_100000211926 [1,1,0,0,0,0|2,0,0]=4 1072 B14R1.786 CC(=O)Nc1ccccc1SCCF 62a_100011217306_100000153524 [1,1,0,0,0,0|2,0,0]=4 1073 B14R1.786 CC(=O)Nc1ccccc1SCCO 62a_100000211926_100000153524 [1,1,0,0,0,0|2,0,0]=4 1074 B14R1.786 CCCCc1ccccc1NC(=O)C 11a_200011217597_100015343762 [1,1,0,0,0,0|1,0,1]=4 1075 B14R1.786 CCCCc1ccccc1NC(=O)C 1626a_200011217597_100015343762 [1,1,0,0,0,0|1,0,1]=4 1076 B14R1.786 CCCCc1ccccc1NC(=O)C 22a_200011217597_100000070787 [1,1,0,0,0,0|1,0,1]=4 1077 B14R1.786 CCCCc1ccccc1NC(=O)C 271570a_100020621405_100000153524 [1,1,0,0,0,0|1,0,1]=4 1078 B14R1.786 CCCCc1ccccc1NC(=O)C 527a_200011217597_100103153847 [1,1,0,0,0,0|1,0,1]=4 1079 B14R1.786 CCCNc1ccccc1NC(=O)C 34a_100011193560_100000210303 [1,1,0,0,0,0|1,0,1]=4 1080 B14R1.786 CCCOc1ccccc1NC(=O)C 11a_100000683936_100015343762 [1,1,0,0,0,0|1,0,1]=4 1081 B14R1.786 CCCOc1ccccc1NC(=O)C 1626a_100000683936_100015343762 [1,1,0,0,0,0|1,0,1]=4 1082 B14R1.786 CCCOc1ccccc1NC(=O)C 22a_100000683936_100000070787 [1,1,0,0,0,0|1,0,1]=4 1083 B14R1.786 CCCOc1ccccc1NC(=O)C 34a_100000185124_100000210303 [1,1,0,0,0,0|1,0,1]=4 1084 B14R1.786 CCCOc1ccccc1NC(=O)C 527a_100000683936_100103153847 [1,1,0,0,0,0|1,0,1]=4 1085 B14R1.786 CCCOc1ccccc1NC(=O)C 7a_100000185124_100000210303 [1,1,0,0,0,0|1,0,1]=4 1086 B14R1.786 CCCSc1ccccc1NC(=O)C 11a_100015184514_100015343762 [1,1,0,0,0,0|1,0,1]=4 1087 B14R1.786 CCCSc1ccccc1NC(=O)C 22a_100015184514_100000070787 [1,1,0,0,0,0|1,0,1]=4 1088 B14R1.786 CCCSc1ccccc1NC(=O)C 62a_100000210303_100000153524 [1,1,0,0,0,0|1,0,1]=4 1089 B14R1.786 CCOCc1ccccc1NC(=O)C 34a_100000192217_100000210202 [1,1,0,0,0,0|0,0,1]=3 1090 B14R1.786 CCOCc1ccccc1NC(=O)C 7a_100000192217_100000210202 [1,1,0,0,0,0|0,0,1]=3 1091 B14R1.786 COCSc1ccccc1CC(=O)C 62a_100000766300_100011350739 [1,1,0,0,0,0|1,0,1]=4 1092 B14R1.786 COCSc1ccccc1CC(=O)C 62a_100011350739_100000766300 [1,1,0,0,0,0|1,0,1]=4 1093 B14R1.786 COCSc1ccccc1NC(=O)C 62a_100000766300_100000153524 [1,1,0,0,0,0|0,0,1]=3 1094 B14R1.786 COCSc1ccccc1NC(=O)N 62a_100000766300_100000742221 [1,1,0,0,0,0|1,0,1]=4 1095 B14R1.786 COCSc1ccccc1OC(=O)C 62a_100000051690_100000766300 [1,1,0,0,0,0|1,0,1]=4 1096 B14R1.786 COCSc1ccccc1OC(=O)C 62a_100000766300_100000051690 [1,1,0,0,0,0|1,0,1]=4 1097 B14R1.786 COCSc1cnccc1NC(=O)C 62a_100000766300_100016132053 [1,1,0,0,0,0|1,0,1]=4 1098 B14R1.786 CSCNc1ccccc1NC(=O)C 34a_100011193560_100011218213 [1,1,0,0,0,0|0,1,1]=4 1099 B14R1.786 CSCOc1ccccc1NC(=O)C 34a_100000185124_100011218213 [1,1,0,0,0,0|0,1,1]=4 1100 B14R1.786 CSCSc1ccccc1NC(=O)C 62a_100011218213_100000153524 [1,1,0,0,0,0|0,1,1]=4 1101 B14R1.814 CC(=Cc1ccccc1NC(=O)N)C 271570a_100102525489_100000742221 [1,1,0,0,0,0|2,0,0]=4 1102 B14R1.814 CC(=O)Cc1ccccc1C=C(C)C 271570a_100102525489_100011350739 [1,1,0,0,0,0|2,0,0]=4 1103 B14R1.814 CC(=O)Nc1ccccc1C=C(C)C 271570a_100102525489_100000153524 [1,1,0,0,0,0|1,0,0]=3 1104 B14R1.814 CC(=O)Nc1ccccc1CN(C)C 11a_100015196887_100015343762 [1,1,0,0,0,0|1,0,1]=4 1105 B14R1.814 CC(=O)Nc1ccccc1CN(C)C 22a_100015196887_100000070787 [1,1,0,0,0,0|1,0,1]=4 1106 B14R1.814 CC(=O)Nc1ccccc1CN(C)C 527a_100015196887_100103153847 [1,1,0,0,0,0|1,0,1]=4 1107 B14R1.814 CC(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100015343762 [1,1,0,0,0,0|2,0,0]=4 1108 B14R1.814 CC(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100015343762 [1,1,0,0,0,0|2,0,0]=4 1109 B14R1.814 CC(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000070787 [1,1,0,0,0,0|2,0,0]=4 1110 B14R1.814 CC(=O)Nc1ccccc1NC(C)C 34a_100011193560_100000210206 [1,1,0,0,0,0|2,0,0]=4 1111 B14R1.814 CC(=O)Nc1ccccc1OC(C)C 11a_100000739276_100015343762 [1,1,0,0,0,0|2,0,0]=4 1112 B14R1.814 CC(=O)Nc1ccccc1OC(C)C 1626a_100000739276_100015343762 [1,1,0,0,0,0|2,0,0]=4 1113 B14R1.814 CC(=O)Nc1ccccc1OC(C)C 22a_100000739276_100000070787 [1,1,0,0,0,0|2,0,0]=4 1114 B14R1.814 CC(=O)Nc1ccccc1OC(C)C 34a_100000185124_100000210206 [1,1,0,0,0,0|2,0,0]=4 1115 B14R1.814 CC(=O)Nc1ccccc1OC(C)C 527a_100000739276_100103153847 [1,1,0,0,0,0|2,0,0]=4 1116 B14R1.814 CC(=O)Nc1ccccc1OC(C)C 7a_100000185124_100000210206 [1,1,0,0,0,0|2,0,0]=4 1117 B14R1.814 CC(=O)Nc1ccccc1SC(C)C 11a_100000688217_100015343762 [1,1,0,0,0,0|2,0,0]=4 1118 B14R1.814 CC(=O)Nc1ccccc1SC(C)C 1626a_100000688217_100015343762 [1,1,0,0,0,0|2,0,0]=4 1119 B14R1.814 CC(=O)Nc1ccccc1SC(C)C 22a_100000688217_100000070787 [1,1,0,0,0,0|2,0,0]=4 1120 B14R1.814 CC(=O)Nc1ccccc1SC(C)C 62a_100000210206_100000153524 [1,1,0,0,0,0|2,0,0]=4 1121 B14R1.814 CC(=O)Nc1ccncc1C=C(C)C 271570a_100102525489_100016132053 [1,1,0,0,0,0|2,0,0]=4 1122 B14R1.814 CC(=O)Oc1ccccc1C=C(C)C 271570a_100102525489_100000051690 [1,1,0,0,0,0|2,0,0]=4 1123 B14R1.5090 CCOc1c(cccc1NC(=O)C)Cl 11a_100000744310_100015343762 [1,1,0,0,0,0|2,0,0]=4 1124 B14R1.5090 CCOc1c(cccc1NC(=O)C)Cl 1626a_100000744310_100015343762 [1,1,0,0,0,0|2,0,0]=4 1125 B14R1.5090 CCOc1c(cccc1NC(=O)C)Cl 22a_100000744310_100000070787 [1,1,0,0,0,0|2,0,0]=4 1126 B14R1.5090 CCOc1c(cccc1NC(=O)C)Cl 527a_100000744310_100103153847 [1,1,0,0,0,0|2,0,0]=4 1127 B14R1.5098 CCOc1cccc(c1NC(=O)C)Br 11a_200103155331_100015343762 [1,1,0,0,0,0|2,0,0]=4 1128 B14R1.5098 CCOc1cccc(c1NC(=O)C)Br 1626a_200103155331_100015343762 [1,1,0,0,0,0|2,0,0]=4 1129 B14R1.5098 CCOc1cccc(c1NC(=O)C)C 34a_100000103797_100000210202 [1,1,0,0,0,0|2,0,0]=4 1130 B14R1.5098 CCOc1cccc(c1NC(=O)C)C 7a_100000103797_100000210202 [1,1,0,0,0,0|2,0,0]=4 1131 B14R1.5098 CCOc1cccc(c1NC(=O)C)Cl 11a_100012284057_100015343762 [1,1,0,0,0,0|2,0,0]=4 1132 B14R1.5098 CCOc1cccc(c1NC(=O)C)Cl 1626a_100012284057_100015343762 [1,1,0,0,0,0|2,0,0]=4 1133 B14R1.5098 CCOc1cccc(c1NC(=O)C)Cl 22a_100012284057_100000070787 [1,1,0,0,0,0|2,0,0]=4 1134 B14R1.6721 C=C=Cc1ccc(cc1NC(=O)C)C 271570a_100015277604_100000182586 [1,1,0,0,0,0|1,0,1]=4 1135 B14R1.6721 C=C=Cc1ccc(cc1NC(=O)C)F 271570a_100015277604_100012558231 [1,1,0,0,0,0|1,0,1]=4 1136 B14R1.6721 CC=Cc1ccc(cc1NC(=O)C)C 271570a_100016259895_100000182586 [1,1,0,0,0,0|1,0,0]=3 1137 B14R1.6721 CC=Cc1ccc(cc1NC(=O)C)F 271570a_100016259895_100012558231 [1,1,0,0,0,0|1,0,0]=3 1138 B14R1.6721 CC=Cc1ccc(cc1OC(=O)C)F 271570a_100016259895_200015685721 [1,1,0,0,0,0|2,0,0]=4 1139 B14R1.6721 CCNc1ccc(cc1NC(=O)C)Cl 34a_100000749253_100000210202 [1,1,0,0,0,0|2,0,0]=4 1140 B14R1.6721 CCNc1ccc(cc1NC(=O)C)Cl 7a_100000749253_100000210202 [1,1,0,0,0,0|2,0,0]=4 1141 B14R1.6721 CCOc1ccc(cc1NC(=O)C)Br 11a_100000751366_100015343762 [1,1,0,0,0,0|2,0,0]=4 1142 B14R1.6721 CCOc1ccc(cc1NC(=O)C)Br 1626a_100000751366_100015343762 [1,1,0,0,0,0|2,0,0]=4 1143 B14R1.6721 CCOc1ccc(cc1NC(=O)C)Br 22a_100000751366_100000070787 [1,1,0,0,0,0|2,0,0]=4 1144 B14R1.6721 CCOc1ccc(cc1NC(=O)C)C 11a_100011202655_100015343762 [1,1,0,0,0,0|2,0,0]=4 1145 B14R1.6721 CCOc1ccc(cc1NC(=O)C)C 1626a_100011202655_100015343762 [1,1,0,0,0,0|2,0,0]=4 1146 B14R1.6721 CCOc1ccc(cc1NC(=O)C)C 22a_100011202655_100000070787 [1,1,0,0,0,0|2,0,0]=4 1147 B14R1.6721 CCOc1ccc(cc1NC(=O)C)C 34a_100000035807_100000210202 [1,1,0,0,0,0|2,0,0]=4 1148 B14R1.6721 CCOc1ccc(cc1NC(=O)C)C 7a_100000035807_100000210202 [1,1,0,0,0,0|2,0,0]=4 1149 B14R1.6721 CCOc1ccc(cc1NC(=O)C)Cl 11a_100000742605_100015343762 [1,1,0,0,0,0|2,0,0]=4 1150 B14R1.6721 CCOc1ccc(cc1NC(=O)C)Cl 1626a_100000742605_100015343762 [1,1,0,0,0,0|2,0,0]=4 1151 B14R1.6721 CCOc1ccc(cc1NC(=O)C)Cl 22a_100000742605_100000070787 [1,1,0,0,0,0|2,0,0]=4 1152 B14R1.6721 CCOc1ccc(cc1NC(=O)C)Cl 34a_100000012038_100000210202 [1,1,0,0,0,0|2,0,0]=4 1153 B14R1.6721 CCOc1ccc(cc1NC(=O)C)Cl 7a_100000012038_100000210202 [1,1,0,0,0,0|2,0,0]=4 1154 B14R1.6721 CCOc1ccc(cc1NC(=O)C)N 34a_100000070259_100000210202 [1,1,0,0,0,0|2,0,0]=4 1155 B14R1.6721 CCOc1ccc(cc1NC(=O)C)N 7a_100000070259_100000210202 [1,1,0,0,0,0|2,0,0]=4 1156 B14R1.6721 CCSc1ccc(cc1NC(=O)C)C 62a_100000210202_100000182586 [1,1,0,0,0,0|2,0,0]=4 1157 B14R1.6721 CCSc1ccc(cc1NC(=O)C)Cl 11a_100000752208_100015343762 [1,1,0,0,0,0|2,0,0]=4 1158 B14R1.6721 CCSc1ccc(cc1NC(=O)C)Cl 1626a_100000752208_100015343762 [1,1,0,0,0,0|2,0,0]=4 1159 B14R1.6721 CCSc1ccc(cc1NC(=O)C)Cl 22a_100000752208_100000070787 [1,1,0,0,0,0|2,0,0]=4 1160 B14R1.6721 CCSc1ccc(cc1NC(=O)C)F 62a_100000210202_100012558231 [1,1,0,0,0,0|2,0,0]=4 1161 B14R1.6721 COCc1ccc(cc1NC(=O)C)Br 11a_100013084866_100015343762 [1,1,0,0,0,0|0,0,1]=3 1162 B14R1.6721 COCc1ccc(cc1NC(=O)C)Br 1626a_100013084866_100015343762 [1,1,0,0,0,0|0,0,1]=3 1163 B14R1.6721 COCc1ccc(cc1NC(=O)C)Br 22a_100013084866_100000070787 [1,1,0,0,0,0|0,0,1]=3 1164 B14R1.6721 COCc1ccc(cc1NC(=O)C)Br 527a_100013084866_100103153847 [1,1,0,0,0,0|0,0,1]=3 1165 B14R1.263 CC=Cc1ccccc1C(=O)NCC 271570a_100016259895_200000155173 [1,1,0,0,0,0|2,0,0]=4 1166 B14R1.263 CC=Cc1ccccc1C(=O)OCC 271570a_100016259895_100000169879 [1,1,0,0,0,0|1,0,0]=3 1167 B14R1.263 CC=Cc1cccnc1C(=O)OCC 271570a_100016259895_100012351660 [1,1,0,0,0,0|2,0,0]=4 1168 B14R1.263 CC=Cc1ccncc1C(=O)OCC 271570a_100016259895_100016987518 [1,1,0,0,0,0|2,0,0]=4 1169 B14R1.263 CC=Cc1cnccc1C(=O)OCC 271570a_100016259895_100010238393 [1,1,0,0,0,0|2,0,0]=4 1170 B14R1.263 CC=Cc1ncccc1C(=O)OCC 271570a_100016259895_100000170124 [1,1,0,0,0,0|2,0,0]=4 1171 B14R1.263 CCNC(=O)c1ccccc1NCC 27a_100015525214_200000155173 [1,1,0,0,0,0|1,0,1]=4 1172 B14R1.263 CCNC(=O)c1ccccc1NCC 34a_100000205978_100000210202 [1,1,0,0,0,0|1,0,1]=4 1173 B14R1.263 CCNc1ccccc1C(=O)NOC 34a_100011599994_100000210202 [1,1,0,0,0,0|0,0,1]=3 1174 B14R1.263 CCNc1ccncc1C(=O)OCC 27a_100015525214_100016987518 [1,1,0,0,0,0|1,0,1]=4 1175 B14R1.263 CCNc1ncccc1C(=O)OCC 27a_100015525214_100000170124 [1,1,0,0,0,0|1,0,1]=4 1176 B14R1.263 CCOC(=O)c1ccccc1CNC 2230a_106832991635_100009816840 [1,1,0,0,0,0|2,0,0]=4 1177 B14R1.263 CCOC(=O)c1ccccc1CNC 270004a_106832991635_200000006220 [1,1,0,0,0,0|2,0,0]=4 1178 B14R1.263 CCOC(=O)c1ccccc1CNC 34a_100102657272_100009816840 [1,1,0,0,0,0|2,0,0]=4 1179 B14R1.263 CCOC(=O)c1ccccc1CNC 7a_106832991635_100009816840 [1,1,0,0,0,0|2,0,0]=4 1180 B14R1.263 CCOC(=O)c1ccccc1COC 34a_100138415774_100009816840 [1,1,0,0,0,0|2,0,0]=4 1181 B14R1.263 CCOC(=O)c1ccccc1CSC 62a_100009816840_200000210301 [1,1,0,0,0,0|2,0,0]=4 1182 B14R1.263 CCOC(=O)c1ccccc1CSC 62a_200000210301_100009816840 [1,1,0,0,0,0|2,0,0]=4 1183 B14R1.263 CCOC(=O)c1ccccc1CS[13CH3] 62a_100009816840_200025704644 [1,1,0,0,0,0|2,0,0]=4 1184 B14R1.263 CCOC(=O)c1ccccc1CS[13CH3] 62a_200025704644_100009816840 [1,1,0,0,0,0|2,0,0]=4 1185 B14R1.263 CCOC(=O)c1ccccc1OCC 7a_100000169922_100000210202 [1,1,0,0,0,0|1,0,1]=4 1186 B14R1.263 CCOC(=O)c1ccccc1SCC 62a_100000169876_100000210202 [1,1,0,0,0,0|1,0,1]=4 1187 B14R1.263 CCOC(=O)c1ccccc1SCC 62a_100000210202_100000169879 [1,1,0,0,0,0|1,0,1]=4 1188 B14R1.263 CONC(=O)c1ccccc1NCF 34a_100011599994_100015361967 [1,1,0,0,0,0|1,0,1]=4 1189 B14R1.746 CCC(=O)c1ccccc1C(=O)OC 1458a_100011215673_100000210202 [1,1,0,0,0,0|1,0,1]=4 1190 B14R1.746 CCN(C)c1ccccc1C(=O)OC 269982a_100000170468_100000204670 [1,1,0,0,0,0|0,0,1]=3 1191 B14R1.746 CCN(C)c1ccccc1C(=O)OC 34a_100000170468_100000210202 [1,1,0,0,0,0|0,0,1]=3 1192 B14R1.746 CNC(=O)c1ccccc1C(=O)OC 1626a_100102657272_100011215673 [1,1,0,0,0,0|2,0,0]=4 1193 B14R1.746 CNC(=O)c1ccccc1C(=O)OC 240690a_100102657272_100011215673 [1,1,0,0,0,0|2,0,0]=4 1194 B14R1.746 COC(=O)c1ccccc1N(C)CF 269982a_100000170468_100015361967 [1,1,0,0,0,0|1,0,1]=4 1195 B14R1.746 COC(=O)c1ccccc1N(C)CF 34a_100000170468_100015361967 [1,1,0,0,0,0|1,0,1]=4 1196 B14R1.789 C=CCNc1ccccc1C(=O)NC 27a_100020586998_100000155073 [1,1,0,0,0,0|1,0,1]=4 1197 B14R1.789 C=CCNc1ccccc1C(=O)NC 34a_100000185696_100015514636 [1,1,0,0,0,0|1,0,1]=4 1198 B14R1.789 C=CCNc1ncccc1C(=O)OC 27a_100020586998_100000150852 [1,1,0,0,0,0|1,0,1]=4 1199 B14R1.789 C=CCOc1ccccc1C(=O)OC 7a_100000150335_100015514636 [1,1,0,0,0,0|1,0,1]=4 1200 B14R1.789 C=CCSc1ccccc1C(=O)OC 62a_100000148710_100000210623 [1,1,0,0,0,0|1,0,1]=4 1201 B14R1.789 C=CCSc1ccccc1C(=O)OC 62a_100000210623_100000148710 [1,1,0,0,0,0|1,0,1]=4 1202 B14R1.789 CCC(=O)c1ccccc1OCC=O 7a_100000184720_200015260668 [1,1,0,0,0,0|2,0,0]=4 1203 B14R1.789 CCCCc1ccccc1C(=O)OC 271570a_100020621405_100000148710 [1,1,0,0,0,0|1,0,1]=4 1204 B14R1.789 CCCNc1ccccc1C(=O)NC 34a_100000185696_100000210303 [1,1,0,0,0,0|1,0,1]=4 1205 B14R1.789 CCCOc1ccccc1C(=O)OC 7a_100000150335_100000210303 [1,1,0,0,0,0|1,0,1]=4 1206 B14R1.789 CCCSc1ccccc1C(=O)OC 62a_100000148710_100000210303 [1,1,0,0,0,0|1,0,1]=4 1207 B14R1.789 CCCSc1ccccc1C(=O)OC 62a_100000210303_100000148710 [1,1,0,0,0,0|1,0,1]=4 1208 B14R1.789 CCNCc1ccccc1C(=O)OC 2230a_100015525214_100000744672 [1,1,0,0,0,0|0,0,1]=3 1209 B14R1.789 CCNCc1cccnc1C(=O)OC 2230a_100015525214_100010177730 [1,1,0,0,0,0|1,0,1]=4 1210 B14R1.789 CCNCc1ncccc1C(=O)OC 2230a_100015525214_100000709840 [1,1,0,0,0,0|1,0,1]=4 1211 B14R1.789 CCOCc1ccccc1C(=O)OC 34a_100121572206_100000744672 [1,1,0,0,0,0|1,0,1]=4 1212 B14R1.789 CCSCc1ccccc1C(=O)OC 62a_100000210202_100000744672 [1,1,0,0,0,0|1,0,1]=4 1213 B14R1.789 CCSCc1ccccc1C(=O)OC 62a_100000744672_100000210202 [1,1,0,0,0,0|1,0,1]=4 1214 B14R1.789 CNC(=O)c1ccccc1NCC=O 34a_100000185696_200009817547 [1,1,0,0,0,0|1,0,0]=3 1215 B14R1.789 CNC(=O)c1ccccc1NCCF 34a_100000185696_100011217306 [1,1,0,0,0,0|1,0,1]=4 1216 B14R1.789 CNC(=O)c1ccccc1NCCO 27a_100000210304_100000155073 [1,1,0,0,0,0|1,0,1]=4 1217 B14R1.789 CNC(=O)c1ccccc1NCCO 34a_100000185696_100000211926 [1,1,0,0,0,0|1,0,1]=4 1218 B14R1.789 CNC(=O)c1ccccc1NCSC 34a_100000185696_100011218213 [1,1,0,0,0,0|1,0,1]=4 1219 B14R1.789 CNC(=O)c1ccccc1OCC=O 34a_100000185920_200009817547 [1,1,0,0,0,0|2,0,0]=4 1220 B14R1.789 CNC(=O)c1ccccc1OCC=O 7a_100000185920_200015260668 [1,1,0,0,0,0|2,0,0]=4 1221 B14R1.789 CNC(=O)c1ccccc1SCC=O 62a_100000155073_200015260668 [1,1,0,0,0,0|2,0,0]=4 1222 B14R1.789 CNC(=O)c1ccccc1SCC=O 62a_200015260668_100000155073 [1,1,0,0,0,0|2,0,0]=4 1223 B14R1.789 CNCCc1ccccc1C(=O)OC 2230a_106832991635_200010284099 [1,1,0,0,0,0|1,0,1]=4 1224 B14R1.789 CNCCc1ccccc1C(=O)OC 34a_100102657272_200010284099 [1,1,0,0,0,0|1,0,1]=4 1225 B14R1.789 CNCCc1ccccc1C(=O)OC 7a_106832991635_200010284099 [1,1,0,0,0,0|1,0,1]=4 1226 B14R1.789 COC(=O)c1ccccc1CCSC 62a_200000210301_200010284099 [1,1,0,0,0,0|1,0,1]=4 1227 B14R1.789 COC(=O)c1ccccc1CCSC 62a_200010284099_200000210301 [1,1,0,0,0,0|1,0,1]=4 1228 B14R1.789 COC(=O)c1ccccc1CCS[13CH3] 62a_200010284099_200025704644 [1,1,0,0,0,0|1,0,1]=4 1229 B14R1.789 COC(=O)c1ccccc1CCS[13CH3] 62a_200025704644_200010284099 [1,1,0,0,0,0|1,0,1]=4 1230 B14R1.789 COC(=O)c1ccccc1CSCF 62a_100000744672_100015361967 [1,1,0,0,0,0|2,0,0]=4 1231 B14R1.789 COC(=O)c1ccccc1CSCF 62a_100015361967_100000744672 [1,1,0,0,0,0|2,0,0]=4 1232 B14R1.789 COC(=O)c1ccccc1OCC=O 7a_100000150335_200015260668 [1,1,0,0,0,0|1,0,0]=3 1233 B14R1.789 COC(=O)c1ccccc1OCCF 7a_100000150335_100011217306 [1,1,0,0,0,0|1,0,1]=4 1234 B14R1.789 COC(=O)c1ccccc1OCCO 7a_100000150335_100000211926 [1,1,0,0,0,0|1,0,1]=4 1235 B14R1.789 COC(=O)c1ccccc1SCC=O 62a_100000148710_200015260668 [1,1,0,0,0,0|1,0,0]=3 1236 B14R1.789 COC(=O)c1ccccc1SCC=O 62a_200015260668_100000148710 [1,1,0,0,0,0|1,0,0]=3 1237 B14R1.789 COC(=O)c1ccccc1SCCF 62a_100000148710_100011217306 [1,1,0,0,0,0|1,0,1]=4 1238 B14R1.789 COC(=O)c1ccccc1SCCF 62a_100011217306_100000148710 [1,1,0,0,0,0|1,0,1]=4 1239 B14R1.789 COC(=O)c1ccccc1SCCO 62a_100000148710_100000211926 [1,1,0,0,0,0|1,0,1]=4 1240 B14R1.789 COC(=O)c1ccccc1SCCO 62a_100000211926_100000148710 [1,1,0,0,0,0|1,0,1]=4 1241 B14R1.789 COC(=O)c1ccccc1SCSC 62a_100000148710_100011218213 [1,1,0,0,0,0|1,0,1]=4 1242 B14R1.789 COC(=O)c1ccccc1SCSC 62a_100011218213_100000148710 [1,1,0,0,0,0|1,0,1]=4 1243 B14R1.789 COC(=O)c1cccnc1NCCO 27a_100000210304_100000150852 [1,1,0,0,0,0|1,0,1]=4 1244 B14R1.789 COC(=O)c1cccnc1SCC=O 62a_100011587185_200015260668 [1,1,0,0,0,0|2,0,0]=4 1245 B14R1.789 COC(=O)c1cccnc1SCC=O 62a_200015260668_100000150852 [1,1,0,0,0,0|2,0,0]=4 1246 B14R1.789 COC(=O)c1ccncc1SCC=O 62a_100010008606_200015260668 [1,1,0,0,0,0|2,0,0]=4 1247 B14R1.789 COC(=O)c1ccncc1SCC=O 62a_200015260668_100010008606 [1,1,0,0,0,0|2,0,0]=4 1248 B14R1.789 COC(=O)c1cnccc1SCC=O 62a_100020629055_200015260668 [1,1,0,0,0,0|2,0,0]=4 1249 B14R1.789 COC(=O)c1cnccc1SCC=O 62a_200015260668_100020629055 [1,1,0,0,0,0|2,0,0]=4 1250 B14R1.789 COC(=O)c1ncccc1OCC=O 34a_100000744052_200009817547 [1,1,0,0,0,0|2,0,0]=4 1251 B14R1.789 COC(=O)c1ncccc1OCC=O 7a_100000744052_200015260668 [1,1,0,0,0,0|2,0,0]=4 1252 B14R1.789 COC(=O)c1ncccc1SCC=O 62a_100011935214_200015260668 [1,1,0,0,0,0|2,0,0]=4 1253 B14R1.789 COC(=O)c1ncccc1SCC=O 62a_200015260668_100011935214 [1,1,0,0,0,0|2,0,0]=4 1254 B14R1.789 COCCc1ccccc1C(=O)OC 34a_100138415774_200010284099 [1,1,0,0,0,0|1,0,1]=4 1255 B14R1.789 COCSc1ccccc1C(=O)OC 62a_100000148710_100000766300 [1,1,0,0,0,0|1,0,1]=4 1256 B14R1.789 COCSc1ccccc1C(=O)OC 62a_100000766300_100000148710 [1,1,0,0,0,0|1,0,1]=4 1257 B14R1.789 O=CCSc1ccccc1C(=O)O[Na] 62a_200015260668_114855342371 [1,1,0,0,0,0|2,0,0]=4 1258 B14R1.3101 CC=Cc1c(cccc1C(=O)OC)Br 271570a_100016259895_100010150843 [1,1,0,0,0,0|1,0,0]=3 1259 B14R1.3101 CC=Cc1c(cccc1C(=O)OC)C 271570a_100016259895_100012002529 [1,1,0,0,0,0|1,0,0]=3 1260 B14R1.3101 CC=Cc1c(cccc1C(=O)OC)F 271570a_100016259895_100012357630 [1,1,0,0,0,0|1,0,0]=3 1261 B14R1.3101 CC=Cc1c(cccc1C(=O)OC)N 271570a_100016259895_100000719424 [1,1,0,0,0,0|1,0,0]=3 1262 B14R1.3101 CC=Cc1c(cccc1C(=O)OC)O 271570a_100016259895_200010230364 [1,1,0,0,0,0|1,0,0]=3 1263 B14R1.3101 CCNc1c(cccc1C(=O)NC)C 34a_100000223168_100000210202 [1,1,0,0,0,0|1,0,1]=4 1264 B14R1.3101 CCNc1c(cccc1C(=O)NC)Cl 34a_200012181065_100000210202 [1,1,0,0,0,0|1,0,1]=4 1265 B14R1.3101 CCOc1c(cccc1C(=O)OC)Br 34a_100009816214_100000210202 [1,1,0,0,0,0|1,0,1]=4 1266 B14R1.3101 CCOc1c(cccc1C(=O)OC)C 34a_100000149854_100000210202 [1,1,0,0,0,0|1,0,1]=4 1267 B14R1.3101 CCOc1c(cccc1C(=O)OC)C 7a_100000149854_100000210202 [1,1,0,0,0,0|1,0,1]=4 1268 B14R1.3101 CCOc1c(cccc1C(=O)OC)Cl 34a_100000074923_100000210202 [1,1,0,0,0,0|1,0,1]=4 1269 B14R1.3101 CCOc1c(cccc1C(=O)OC)Cl 7a_100000074923_100000210202 [1,1,0,0,0,0|1,0,1]=4 1270 B14R1.3101 CCOc1c(cccc1C(=O)OC)F 34a_100000082593_100000210202 [1,1,0,0,0,0|1,0,1]=4 1271 B14R1.3101 CCOc1c(cccc1C(=O)OC)F 7a_100000082593_100000210202 [1,1,0,0,0,0|1,0,1]=4 1272 B14R1.3101 CCOc1c(cccc1C(=O)OC)N 34a_100000750886_100000210202 [1,1,0,0,0,0|1,0,1]=4 1273 B14R1.3101 CCSc1c(cccc1C(=O)OC)Br 62a_100000210202_100010150843 [1,1,0,0,0,0|1,0,1]=4 1274 B14R1.3101 CCSc1c(cccc1C(=O)OC)Br 62a_100010150843_100000210202 [1,1,0,0,0,0|1,0,1]=4 1275 B14R1.3101 CCSc1c(cccc1C(=O)OC)C 62a_100000210202_100012002529 [1,1,0,0,0,0|1,0,1]=4 1276 B14R1.3101 CCSc1c(cccc1C(=O)OC)C 62a_100012002529_100000210202 [1,1,0,0,0,0|1,0,1]=4 1277 B14R1.3101 CCSc1c(cccc1C(=O)OC)F 62a_100000210202_100012357630 [1,1,0,0,0,0|1,0,1]=4 1278 B14R1.3101 CCSc1c(cccc1C(=O)OC)F 62a_100012357630_100000210202 [1,1,0,0,0,0|1,0,1]=4 1279 B14R1.3101 CCSc1c(cccc1C(=O)OC)N 62a_100000719424_100000210202 [1,1,0,0,0,0|1,0,1]=4 1280 B14R1.3101 CCSc1c(cccc1C(=O)OC)O 62a_100000210202_200010230364 [1,1,0,0,0,0|1,0,1]=4 1281 B14R1.3101 CCSc1c(cccc1C(=O)OC)O 62a_200010230364_100000210202 [1,1,0,0,0,0|1,0,1]=4 1282 B14R1.3101 CNCc1c(cccc1C(=O)OC)Br 2230a_106832991635_100012352084 [1,1,0,0,0,0|2,0,0]=4 1283 B14R1.3101 CNCc1c(cccc1C(=O)OC)Br 26a_100102657272_100009816214 [1,1,0,0,0,0|2,0,0]=4 1284 B14R1.3101 CNCc1c(cccc1C(=O)OC)Br 34a_100102657272_100012352084 [1,1,0,0,0,0|2,0,0]=4 1285 B14R1.3101 CNCc1c(cccc1C(=O)OC)Br 7a_106832991635_100012352084 [1,1,0,0,0,0|2,0,0]=4 1286 B14R1.3101 CNCc1c(cccc1C(=O)OC)Cl 2230a_106832991635_100000725332 [1,1,0,0,0,0|2,0,0]=4 1287 B14R1.3101 CNCc1c(cccc1C(=O)OC)Cl 34a_100102657272_100000725332 [1,1,0,0,0,0|2,0,0]=4 1288 B14R1.3101 CNCc1c(cccc1C(=O)OC)Cl 7a_106832991635_100000725332 [1,1,0,0,0,0|2,0,0]=4 1289 B14R1.3101 CNCc1c(cccc1C(=O)OC)F 2230a_106832991635_100010239718 [1,1,0,0,0,0|2,0,0]=4 1290 B14R1.3101 CNCc1c(cccc1C(=O)OC)F 34a_100102657272_100010239718 [1,1,0,0,0,0|2,0,0]=4 1291 B14R1.3101 CNCc1c(cccc1C(=O)OC)F 7a_106832991635_100010239718 [1,1,0,0,0,0|2,0,0]=4 1292 B14R1.3101 CNCc1c(cccc1C(=O)OC)I 2230a_106832991635_100011003723 [1,1,0,0,0,0|2,0,0]=4 1293 B14R1.3101 CNCc1c(cccc1C(=O)OC)I 34a_100102657272_100011003723 [1,1,0,0,0,0|2,0,0]=4 1294 B14R1.3101 CNCc1c(cccc1C(=O)OC)I 7a_106832991635_100011003723 [1,1,0,0,0,0|2,0,0]=4 1295 B14R1.3101 COC(=O)c1cccc(c1CSC)Br 62a_100012352084_200000210301 [1,1,0,0,0,0|2,0,0]=4 1296 B14R1.3101 COC(=O)c1cccc(c1CSC)Cl 62a_100000725332_200000210301 [1,1,0,0,0,0|2,0,0]=4 1297 B14R1.3101 COC(=O)c1cccc(c1CSC)F 62a_100010239718_200000210301 [1,1,0,0,0,0|2,0,0]=4 1298 B14R1.3101 COC(=O)c1cccc(c1CSC)F 62a_200000210301_100010239718 [1,1,0,0,0,0|2,0,0]=4 1299 B14R1.3101 COC(=O)c1cccc(c1CSC)I 62a_100011003723_200000210301 [1,1,0,0,0,0|2,0,0]=4 1300 B14R1.3101 COC(=O)c1cccc(c1CSC)I 62a_200000210301_100011003723 [1,1,0,0,0,0|2,0,0]=4 1301 B14R1.3101 COC(=O)c1cccc(c1CS[13CH3])Br 62a_100012352084_200025704644 [1,1,0,0,0,0|2,0,0]=4 1302 B14R1.3101 COC(=O)c1cccc(c1CS[13CH3])Cl 62a_100000725332_200025704644 [1,1,0,0,0,0|2,0,0]=4 1303 B14R1.3101 COC(=O)c1cccc(c1CS[13CH3])F 62a_100010239718_200025704644 [1,1,0,0,0,0|2,0,0]=4 1304 B14R1.3101 COC(=O)c1cccc(c1CS[13CH3])F 62a_200025704644_100010239718 [1,1,0,0,0,0|2,0,0]=4 1305 B14R1.3101 COC(=O)c1cccc(c1CS[13CH3])I 62a_100011003723_200025704644 [1,1,0,0,0,0|2,0,0]=4 1306 B14R1.3101 COC(=O)c1cccc(c1CS[13CH3])I 62a_200025704644_100011003723 [1,1,0,0,0,0|2,0,0]=4 1307 B14R1.3101 COCc1c(cccc1C(=O)OC)Br 34a_100138415774_100012352084 [1,1,0,0,0,0|2,0,0]=4 1308 B14R1.3101 COCc1c(cccc1C(=O)OC)Cl 34a_100138415774_100000725332 [1,1,0,0,0,0|2,0,0]=4 1309 B14R1.3101 COCc1c(cccc1C(=O)OC)F 34a_100138415774_100010239718 [1,1,0,0,0,0|2,0,0]=4 1310 B14R1.3101 COCc1c(cccc1C(=O)OC)I 34a_100138415774_100011003723 [1,1,0,0,0,0|2,0,0]=4 1311 B14R1.5122 CC=Cc1cc(ccc1C(=O)CC)C 271570a_100016259895_200012349623 [1,1,0,0,0,0|2,0,0]=4 1312 B14R1.5122 CC=Cc1cc(ccc1C(=O)NC)F 271570a_100016259895_200000206206 [1,1,0,0,0,0|2,0,0]=4 1313 B14R1.5122 CC=Cc1cc(ccc1C(=O)OC)Br 271570a_100016259895_100000701758 [1,1,0,0,0,0|1,0,0]=3 1314 B14R1.5122 CC=Cc1cc(ccc1C(=O)OC)C 271570a_100016259895_100012340597 [1,1,0,0,0,0|1,0,0]=3 1315 B14R1.5122 CC=Cc1cc(ccc1C(=O)OC)Cl 271570a_100016259895_100000047510 [1,1,0,0,0,0|1,0,0]=3 1316 B14R1.5122 CC=Cc1cc(ccc1C(=O)OC)F 271570a_100016259895_100000204356 [1,1,0,0,0,0|1,0,0]=3 1317 B14R1.5122 CC=Cc1cc(ccc1C(=O)OC)N 271570a_100016259895_100009998378 [1,1,0,0,0,0|1,0,0]=3 1318 B14R1.5122 CC=Cc1cc(ccc1C(=O)OC)O 271570a_100016259895_100010150825 [1,1,0,0,0,0|1,0,0]=3 1319 B14R1.5122 CC=Cc1cc(cnc1C(=O)OC)C 271570a_100016259895_100010167497 [1,1,0,0,0,0|2,0,0]=4 1320 B14R1.5122 CC=Cc1cc(cnc1C(=O)OC)F 271570a_100016259895_100010189631 [1,1,0,0,0,0|2,0,0]=4 1321 B14R1.5122 CC=Cc1cc(ncc1C(=O)OC)C 271570a_100016259895_100011998247 [1,1,0,0,0,0|2,0,0]=4 1322 B14R1.5122 CC=Cc1nc(ccc1C(=O)OC)C 271570a_100016259895_100000054099 [1,1,0,0,0,0|2,0,0]=4 1323 B14R1.5122 CC=Cc1nc(ccc1C(=O)OC)N 271570a_100016259895_100009865240 [1,1,0,0,0,0|2,0,0]=4 1324 B14R1.5122 CC=Cc1nc(ccc1C(=O)OC)O 271570a_100016259895_100016008356 [1,1,0,0,0,0|2,0,0]=4 1325 B14R1.5122 CCNc1cc(ccc1C(=O)CC)C 27a_100015525214_200012349623 [1,1,0,0,0,0|1,0,1]=4 1326 B14R1.5122 CCNc1cc(ccc1C(=O)NC)Cl 34a_100000742614_100000210202 [1,1,0,0,0,0|1,0,1]=4 1327 B14R1.5122 CCNc1cc(ccc1C(=O)NC)F 27a_100015525214_200000206206 [1,1,0,0,0,0|1,0,1]=4 1328 B14R1.5122 CCNc1cc(ncc1C(=O)OC)C 27a_100015525214_100011998247 [1,1,0,0,0,0|1,0,1]=4 1329 B14R1.5122 CCOc1cc(ccc1C(=O)OC)Br 34a_100000699699_100000210202 [1,1,0,0,0,0|1,0,1]=4 1330 B14R1.5122 CCOc1cc(ccc1C(=O)OC)Br 7a_100000699699_100000210202 [1,1,0,0,0,0|1,0,1]=4 1331 B14R1.5122 CCOc1cc(ccc1C(=O)OC)C 34a_100000148187_100000210202 [1,1,0,0,0,0|1,0,1]=4 1332 B14R1.5122 CCOc1cc(ccc1C(=O)OC)C 7a_100000148187_100000210202 [1,1,0,0,0,0|1,0,1]=4 1333 B14R1.5122 CCOc1cc(ccc1C(=O)OC)Cl 34a_100000151441_100000210202 [1,1,0,0,0,0|1,0,1]=4 1334 B14R1.5122 CCOc1cc(ccc1C(=O)OC)Cl 7a_100000151441_100000210202 [1,1,0,0,0,0|1,0,1]=4 1335 B14R1.5122 CCOc1cc(ccc1C(=O)OC)F 34a_100011216117_100000210202 [1,1,0,0,0,0|1,0,1]=4 1336 B14R1.5122 CCOc1cc(ccc1C(=O)OC)F 7a_100011216117_100000210202 [1,1,0,0,0,0|1,0,1]=4 1337 B14R1.5122 CCOc1cc(ccc1C(=O)OC)I 7a_100000062286_100000210202 [1,1,0,0,0,0|1,0,1]=4 1338 B14R1.5122 CCOc1cc(ccc1C(=O)OC)N 34a_100000718744_100000210202 [1,1,0,0,0,0|1,0,1]=4 1339 B14R1.5122 CCOc1cc(ccc1C(=O)OC)N 7a_100000718744_100000210202 [1,1,0,0,0,0|1,0,1]=4 1340 B14R1.5122 CCSc1cc(ccc1C(=O)OC)Br 62a_100000701758_100000210202 [1,1,0,0,0,0|1,0,1]=4 1341 B14R1.5122 CCSc1cc(ccc1C(=O)OC)C 62a_100000210202_100012340597 [1,1,0,0,0,0|1,0,1]=4 1342 B14R1.5122 CCSc1cc(ccc1C(=O)OC)C 62a_100012340597_100000210202 [1,1,0,0,0,0|1,0,1]=4 1343 B14R1.5122 CCSc1cc(ccc1C(=O)OC)Cl 62a_100000047510_100000210202 [1,1,0,0,0,0|1,0,1]=4 1344 B14R1.5122 CCSc1cc(ccc1C(=O)OC)Cl 62a_100000210202_100000047510 [1,1,0,0,0,0|1,0,1]=4 1345 B14R1.5122 CCSc1cc(ccc1C(=O)OC)F 62a_100000204356_100000210202 [1,1,0,0,0,0|1,0,1]=4 1346 B14R1.5122 CCSc1cc(ccc1C(=O)OC)F 62a_100000210202_100000204356 [1,1,0,0,0,0|1,0,1]=4 1347 B14R1.5122 CCSc1cc(ccc1C(=O)OC)N 62a_100000210202_100010150747 [1,1,0,0,0,0|1,0,1]=4 1348 B14R1.5122 CCSc1cc(ccc1C(=O)OC)N 62a_100009998378_100000210202 [1,1,0,0,0,0|1,0,1]=4 1349 B14R1.5122 CCSc1cc(ccc1C(=O)OC)O 62a_100000210202_100010150825 [1,1,0,0,0,0|1,0,1]=4 1350 B14R1.5122 CCSc1cc(ccc1C(=O)OC)O 62a_100010150825_100000210202 [1,1,0,0,0,0|1,0,1]=4 1351 B14R1.5122 CNCc1cc(ccc1C(=O)OC)Br 2230a_106832991635_100000693193 [1,1,0,0,0,0|2,0,0]=4 1352 B14R1.5122 CNCc1cc(ccc1C(=O)OC)Br 26a_100102657272_100000699699 [1,1,0,0,0,0|2,0,0]=4 1353 B14R1.5122 CNCc1cc(ccc1C(=O)OC)Br 270004a_106832991635_100000708894 [1,1,0,0,0,0|2,0,0]=4 1354 B14R1.5122 CNCc1cc(ccc1C(=O)OC)Br 34a_100102657272_100000693193 [1,1,0,0,0,0|2,0,0]=4 1355 B14R1.5122 CNCc1cc(ccc1C(=O)OC)Br 7a_106832991635_100000693193 [1,1,0,0,0,0|2,0,0]=4 1356 B14R1.5122 CNCc1cc(ccc1C(=O)OC)Cl 2230a_106832991635_100010239717 [1,1,0,0,0,0|2,0,0]=4 1357 B14R1.5122 CNCc1cc(ccc1C(=O)OC)Cl 34a_100102657272_100010239717 [1,1,0,0,0,0|2,0,0]=4 1358 B14R1.5122 CNCc1cc(ccc1C(=O)OC)Cl 7a_106832991635_100010239717 [1,1,0,0,0,0|2,0,0]=4 1359 B14R1.5122 CNCc1cc(ccc1C(=O)OC)F 2230a_106832991635_100000700702 [1,1,0,0,0,0|2,0,0]=4 1360 B14R1.5122 CNCc1cc(ccc1C(=O)OC)F 34a_100102657272_100000700702 [1,1,0,0,0,0|2,0,0]=4 1361 B14R1.5122 CNCc1cc(ccc1C(=O)OC)F 7a_106832991635_100000700702 [1,1,0,0,0,0|2,0,0]=4 1362 B14R1.5122 COC(=O)c1ccc(cc1CSC)Br 62a_100000693193_200000210301 [1,1,0,0,0,0|2,0,0]=4 1363 B14R1.5122 COC(=O)c1ccc(cc1CSC)Cl 62a_100010239717_200000210301 [1,1,0,0,0,0|2,0,0]=4 1364 B14R1.5122 COC(=O)c1ccc(cc1CSC)Cl 62a_200000210301_100010239717 [1,1,0,0,0,0|2,0,0]=4 1365 B14R1.5122 COC(=O)c1ccc(cc1CSC)F 62a_100000700702_200000210301 [1,1,0,0,0,0|2,0,0]=4 1366 B14R1.5122 COC(=O)c1ccc(cc1CSC)F 62a_200000210301_100000700702 [1,1,0,0,0,0|2,0,0]=4 1367 B14R1.5122 COC(=O)c1ccc(cc1CS[13CH3])Br 62a_100000693193_200025704644 [1,1,0,0,0,0|2,0,0]=4 1368 B14R1.5122 COC(=O)c1ccc(cc1CS[13CH3])Cl 62a_100010239717_200025704644 [1,1,0,0,0,0|2,0,0]=4 1369 B14R1.5122 COC(=O)c1ccc(cc1CS[13CH3])Cl 62a_200025704644_100010239717 [1,1,0,0,0,0|2,0,0]=4 1370 B14R1.5122 COC(=O)c1ccc(cc1CS[13CH3])F 62a_100000700702_200025704644 [1,1,0,0,0,0|2,0,0]=4 1371 B14R1.5122 COC(=O)c1ccc(cc1CS[13CH3])F 62a_200025704644_100000700702 [1,1,0,0,0,0|2,0,0]=4 1372 B14R1.5122 COCc1cc(ccc1C(=O)OC)Br 34a_100138415774_100000693193 [1,1,0,0,0,0|2,0,0]=4 1373 B14R1.5122 COCc1cc(ccc1C(=O)OC)Cl 34a_100138415774_100010239717 [1,1,0,0,0,0|2,0,0]=4 1374 B14R1.5122 COCc1cc(ccc1C(=O)OC)F 34a_100138415774_100000700702 [1,1,0,0,0,0|2,0,0]=4 1375 B14R1.5238 CC=Cc1ccc(cc1C(=O)NC)Cl 271570a_100016259895_200011279454 [1,1,0,0,0,0|2,0,0]=4 1376 B14R1.5238 CC=Cc1ccc(cc1C(=O)NC)F 271570a_100016259895_200000206232 [1,1,0,0,0,0|2,0,0]=4 1377 B14R1.5238 CC=Cc1ccc(cc1C(=O)OC)Br 271570a_100016259895_100000148213 [1,1,0,0,0,0|1,0,0]=3 1378 B14R1.5238 CC=Cc1ccc(cc1C(=O)OC)C 271570a_100016259895_100012339458 [1,1,0,0,0,0|1,0,0]=3 1379 B14R1.5238 CC=Cc1ccc(cc1C(=O)OC)Cl 271570a_100016259895_100011294804 [1,1,0,0,0,0|1,0,0]=3 1380 B14R1.5238 CC=Cc1ccc(cc1C(=O)OC)F 271570a_100016259895_100000205820 [1,1,0,0,0,0|1,0,0]=3 1381 B14R1.5238 CC=Cc1ccc(cc1C(=O)OC)N 271570a_100016259895_100000696289 [1,1,0,0,0,0|1,0,0]=3 1382 B14R1.5238 CC=Cc1ccc(cc1C(=O)OC)O 271570a_100016259895_100010230369 [1,1,0,0,0,0|1,0,0]=3 1383 B14R1.5238 CC=Cc1ccc(nc1C(=O)OC)N 271570a_100016259895_100009816986 [1,1,0,0,0,0|2,0,0]=4 1384 B14R1.5238 CC=Cc1ccc(nc1C(=O)OC)O 271570a_100016259895_100010189638 [1,1,0,0,0,0|2,0,0]=4 1385 B14R1.5238 CC=Cc1cnc(cc1C(=O)OC)N 271570a_100016259895_100011934820 [1,1,0,0,0,0|2,0,0]=4 1386 B14R1.5238 CC=Cc1cnc(cc1C(=O)OC)O 271570a_100016259895_100009816900 [1,1,0,0,0,0|2,0,0]=4 1387 B14R1.5238 CC=Cc1ncc(cc1C(=O)OC)C 271570a_100016259895_100000085774 [1,1,0,0,0,0|2,0,0]=4 1388 B14R1.5238 CC=Cc1ncc(cc1C(=O)OC)F 271570a_100016259895_100012000215 [1,1,0,0,0,0|2,0,0]=4 1389 B14R1.5238 CC=Cc1ncc(cc1C(=O)OC)N 271570a_100016259895_200012182668 [1,1,0,0,0,0|2,0,0]=4 1390 B14R1.5238 CCNc1ccc(cc1C(=O)NC)Br 34a_100000690504_100000210202 [1,1,0,0,0,0|1,0,1]=4 1391 B14R1.5238 CCNc1ccc(cc1C(=O)NC)Cl 27a_100015525214_200011279454 [1,1,0,0,0,0|1,0,1]=4 1392 B14R1.5238 CCNc1ccc(cc1C(=O)NC)Cl 34a_100000739363_100000210202 [1,1,0,0,0,0|1,0,1]=4 1393 B14R1.5238 CCNc1ccc(cc1C(=O)NC)F 27a_100015525214_200000206232 [1,1,0,0,0,0|1,0,1]=4 1394 B14R1.5238 CCNc1ncc(cc1C(=O)OC)C 27a_100015525214_100000085774 [1,1,0,0,0,0|1,0,1]=4 1395 B14R1.5238 CCOc1ccc(cc1C(=O)OC)Br 34a_100000149267_100000210202 [1,1,0,0,0,0|1,0,1]=4 1396 B14R1.5238 CCOc1ccc(cc1C(=O)OC)Br 7a_100000149267_100000210202 [1,1,0,0,0,0|1,0,1]=4 1397 B14R1.5238 CCOc1ccc(cc1C(=O)OC)C 34a_100000216618_100000210202 [1,1,0,0,0,0|1,0,1]=4 1398 B14R1.5238 CCOc1ccc(cc1C(=O)OC)C 7a_100000216618_100000210202 [1,1,0,0,0,0|1,0,1]=4 1399 B14R1.5238 CCOc1ccc(cc1C(=O)OC)Cl 34a_100000149278_100000210202 [1,1,0,0,0,0|1,0,1]=4 1400 B14R1.5238 CCOc1ccc(cc1C(=O)OC)Cl 7a_100000149278_100000210202 [1,1,0,0,0,0|1,0,1]=4 1401 B14R1.5238 CCOc1ccc(cc1C(=O)OC)F 34a_100011219540_100000210202 [1,1,0,0,0,0|1,0,1]=4 1402 B14R1.5238 CCOc1ccc(cc1C(=O)OC)F 7a_100011219540_100000210202 [1,1,0,0,0,0|1,0,1]=4 1403 B14R1.5238 CCOc1ccc(cc1C(=O)OC)I 34a_100000149868_100000210202 [1,1,0,0,0,0|1,0,1]=4 1404 B14R1.5238 CCOc1ccc(cc1C(=O)OC)I 7a_100000149868_100000210202 [1,1,0,0,0,0|1,0,1]=4 1405 B14R1.5238 CCOc1ccc(cc1C(=O)OC)N 34a_100011246163_100000210202 [1,1,0,0,0,0|1,0,1]=4 1406 B14R1.5238 CCOc1ccc(cc1C(=O)OC)N 7a_100011246163_100000210202 [1,1,0,0,0,0|1,0,1]=4 1407 B14R1.5238 CCSc1ccc(cc1C(=O)OC)Br 62a_100000148213_100000210202 [1,1,0,0,0,0|1,0,1]=4 1408 B14R1.5238 CCSc1ccc(cc1C(=O)OC)Br 62a_100000210202_100000148213 [1,1,0,0,0,0|1,0,1]=4 1409 B14R1.5238 CCSc1ccc(cc1C(=O)OC)C 62a_100000210202_100012339458 [1,1,0,0,0,0|1,0,1]=4 1410 B14R1.5238 CCSc1ccc(cc1C(=O)OC)C 62a_100012339458_100000210202 [1,1,0,0,0,0|1,0,1]=4 1411 B14R1.5238 CCSc1ccc(cc1C(=O)OC)Cl 62a_100000210202_100011294804 [1,1,0,0,0,0|1,0,1]=4 1412 B14R1.5238 CCSc1ccc(cc1C(=O)OC)Cl 62a_100011294804_100000210202 [1,1,0,0,0,0|1,0,1]=4 1413 B14R1.5238 CCSc1ccc(cc1C(=O)OC)F 62a_100000205820_100000210202 [1,1,0,0,0,0|1,0,1]=4 1414 B14R1.5238 CCSc1ccc(cc1C(=O)OC)F 62a_100000210202_100000205820 [1,1,0,0,0,0|1,0,1]=4 1415 B14R1.5238 CCSc1ccc(cc1C(=O)OC)N 62a_100000210202_100011794239 [1,1,0,0,0,0|1,0,1]=4 1416 B14R1.5238 CCSc1ccc(cc1C(=O)OC)N 62a_100000696289_100000210202 [1,1,0,0,0,0|1,0,1]=4 1417 B14R1.5238 CCSc1ccc(cc1C(=O)OC)O 62a_100000210202_100010230369 [1,1,0,0,0,0|1,0,1]=4 1418 B14R1.5238 CCSc1ccc(cc1C(=O)OC)O 62a_100010230369_100000210202 [1,1,0,0,0,0|1,0,1]=4 1419 B14R1.5238 CNCc1ccc(cc1C(=O)OC)Br 2230a_106832991635_100000728005 [1,1,0,0,0,0|2,0,0]=4 1420 B14R1.5238 CNCc1ccc(cc1C(=O)OC)Br 26a_100102657272_100000149267 [1,1,0,0,0,0|2,0,0]=4 1421 B14R1.5238 CNCc1ccc(cc1C(=O)OC)Br 34a_100102657272_100000728005 [1,1,0,0,0,0|2,0,0]=4 1422 B14R1.5238 CNCc1ccc(cc1C(=O)OC)Br 7a_106832991635_100000728005 [1,1,0,0,0,0|2,0,0]=4 1423 B14R1.5238 CNCc1ccc(cc1C(=O)OC)Cl 2230a_106832991635_100012352085 [1,1,0,0,0,0|2,0,0]=4 1424 B14R1.5238 CNCc1ccc(cc1C(=O)OC)Cl 34a_100102657272_100012352085 [1,1,0,0,0,0|2,0,0]=4 1425 B14R1.5238 CNCc1ccc(cc1C(=O)OC)Cl 7a_106832991635_100012352085 [1,1,0,0,0,0|2,0,0]=4 1426 B14R1.5238 CNCc1ccc(cc1C(=O)OC)F 2230a_106832991635_100000751459 [1,1,0,0,0,0|2,0,0]=4 1427 B14R1.5238 CNCc1ccc(cc1C(=O)OC)F 34a_100102657272_100000751459 [1,1,0,0,0,0|2,0,0]=4 1428 B14R1.5238 CNCc1ccc(cc1C(=O)OC)F 7a_106832991635_100000751459 [1,1,0,0,0,0|2,0,0]=4 1429 B14R1.5238 CNCc1ccc(cc1C(=O)OC)I 2230a_106832991635_100011096949 [1,1,0,0,0,0|2,0,0]=4 1430 B14R1.5238 CNCc1ccc(cc1C(=O)OC)I 34a_100102657272_100011096949 [1,1,0,0,0,0|2,0,0]=4 1431 B14R1.5238 CNCc1ccc(cc1C(=O)OC)I 7a_106832991635_100011096949 [1,1,0,0,0,0|2,0,0]=4 1432 B14R1.5238 COC(=O)c1cc(ccc1CSC)Br 62a_100000728005_200000210301 [1,1,0,0,0,0|2,0,0]=4 1433 B14R1.5238 COC(=O)c1cc(ccc1CSC)Cl 62a_100012352085_200000210301 [1,1,0,0,0,0|2,0,0]=4 1434 B14R1.5238 COC(=O)c1cc(ccc1CSC)Cl 62a_200000210301_100012352085 [1,1,0,0,0,0|2,0,0]=4 1435 B14R1.5238 COC(=O)c1cc(ccc1CSC)F 62a_100000751459_200000210301 [1,1,0,0,0,0|2,0,0]=4 1436 B14R1.5238 COC(=O)c1cc(ccc1CSC)F 62a_200000210301_100000751459 [1,1,0,0,0,0|2,0,0]=4 1437 B14R1.5238 COC(=O)c1cc(ccc1CSC)I 62a_100011096949_200000210301 [1,1,0,0,0,0|2,0,0]=4 1438 B14R1.5238 COC(=O)c1cc(ccc1CSC)I 62a_200000210301_100011096949 [1,1,0,0,0,0|2,0,0]=4 1439 B14R1.5238 COC(=O)c1cc(ccc1CS[13CH3])Br 62a_100000728005_200025704644 [1,1,0,0,0,0|2,0,0]=4 1440 B14R1.5238 COC(=O)c1cc(ccc1CS[13CH3])Cl 62a_100012352085_200025704644 [1,1,0,0,0,0|2,0,0]=4 1441 B14R1.5238 COC(=O)c1cc(ccc1CS[13CH3])Cl 62a_200025704644_100012352085 [1,1,0,0,0,0|2,0,0]=4 1442 B14R1.5238 COC(=O)c1cc(ccc1CS[13CH3])F 62a_100000751459_200025704644 [1,1,0,0,0,0|2,0,0]=4 1443 B14R1.5238 COC(=O)c1cc(ccc1CS[13CH3])F 62a_200025704644_100000751459 [1,1,0,0,0,0|2,0,0]=4 1444 B14R1.5238 COC(=O)c1cc(ccc1CS[13CH3])I 62a_100011096949_200025704644 [1,1,0,0,0,0|2,0,0]=4 1445 B14R1.5238 COC(=O)c1cc(ccc1CS[13CH3])I 62a_200025704644_100011096949 [1,1,0,0,0,0|2,0,0]=4 1446 B14R1.5238 COCc1ccc(cc1C(=O)OC)Br 34a_100138415774_100000728005 [1,1,0,0,0,0|2,0,0]=4 1447 B14R1.5238 COCc1ccc(cc1C(=O)OC)Cl 34a_100138415774_100012352085 [1,1,0,0,0,0|2,0,0]=4 1448 B14R1.5238 COCc1ccc(cc1C(=O)OC)F 34a_100138415774_100000751459 [1,1,0,0,0,0|2,0,0]=4 1449 B14R1.5238 COCc1ccc(cc1C(=O)OC)I 34a_100138415774_100011096949 [1,1,0,0,0,0|2,0,0]=4 1450 B14R1.5566 CC=Cc1cccc(c1C(=O)NC)F 271570a_100016259895_100012642803 [1,1,0,0,0,0|2,0,0]=4 1451 B14R1.5566 CC=Cc1cccc(c1C(=O)OC)Br 271570a_100016259895_100010247157 [1,1,0,0,0,0|1,0,0]=3 1452 B14R1.5566 CC=Cc1cccc(c1C(=O)OC)C 271570a_100016259895_100010204206 [1,1,0,0,0,0|1,0,0]=3 1453 B14R1.5566 CC=Cc1cccc(c1C(=O)OC)Cl 271570a_100016259895_100010150959 [1,1,0,0,0,0|1,0,0]=3 1454 B14R1.5566 CC=Cc1cccc(c1C(=O)OC)F 271570a_100016259895_100000150693 [1,1,0,0,0,0|1,0,0]=3 1455 B14R1.5566 CC=Cc1cccc(c1C(=O)OC)N 271570a_100016259895_100010253892 [1,1,0,0,0,0|1,0,0]=3 1456 B14R1.5566 CC=Cc1ccnc(c1C(=O)OC)Cl 271570a_100016259895_100010138530 [1,1,0,0,0,0|2,0,0]=4 1457 B14R1.5566 CC=Cc1ccnc(c1C(=O)OC)F 271570a_100016259895_100010150474 [1,1,0,0,0,0|2,0,0]=4 1458 B14R1.5566 CC=Cc1cncc(c1C(=O)OC)F 271570a_100016259895_100010189632 [1,1,0,0,0,0|2,0,0]=4 1459 B14R1.5566 CC=Cc1nccc(c1C(=O)OC)F 271570a_100016259895_100015560809 [1,1,0,0,0,0|2,0,0]=4 1460 B14R1.5566 CC=Cc1nccc(c1C(=O)OC)N 271570a_100016259895_100009985557 [1,1,0,0,0,0|2,0,0]=4 1461 B14R1.5566 CCNc1cccc(c1C(=O)NC)F 27a_100015525214_100012642803 [1,1,0,0,0,0|1,0,1]=4 1462 B14R1.5566 CCOc1cccc(c1C(=O)OC)C 34a_100000084604_100000210202 [1,1,0,0,0,0|1,0,1]=4 1463 B14R1.5566 CCOc1cccc(c1C(=O)OC)C 7a_100000084604_100000210202 [1,1,0,0,0,0|1,0,1]=4 1464 B14R1.5566 CCOc1cccc(c1C(=O)OC)Cl 34a_200000055445_100000210202 [1,1,0,0,0,0|1,0,1]=4 1465 B14R1.5566 CCOc1cccc(c1C(=O)OC)Cl 7a_200000055445_100000210202 [1,1,0,0,0,0|1,0,1]=4 1466 B14R1.5566 CCOc1cccc(c1C(=O)OC)F 34a_100011216559_100000210202 [1,1,0,0,0,0|1,0,1]=4 1467 B14R1.5566 CCOc1cccc(c1C(=O)OC)F 7a_100011216559_100000210202 [1,1,0,0,0,0|1,0,1]=4 1468 B14R1.5566 CCSc1cccc(c1C(=O)OC)Br 62a_100000210202_100010247157 [1,1,0,0,0,0|1,0,1]=4 1469 B14R1.5566 CCSc1cccc(c1C(=O)OC)Br 62a_100010247157_100000210202 [1,1,0,0,0,0|1,0,1]=4 1470 B14R1.5566 CCSc1cccc(c1C(=O)OC)C 62a_100000210202_100010204206 [1,1,0,0,0,0|1,0,1]=4 1471 B14R1.5566 CCSc1cccc(c1C(=O)OC)C 62a_100010204206_100000210202 [1,1,0,0,0,0|1,0,1]=4 1472 B14R1.5566 CCSc1cccc(c1C(=O)OC)Cl 62a_100000210202_100010150959 [1,1,0,0,0,0|1,0,1]=4 1473 B14R1.5566 CCSc1cccc(c1C(=O)OC)Cl 62a_100010150959_100000210202 [1,1,0,0,0,0|1,0,1]=4 1474 B14R1.5566 CCSc1cccc(c1C(=O)OC)F 62a_100000150693_100000210202 [1,1,0,0,0,0|1,0,1]=4 1475 B14R1.5566 CCSc1cccc(c1C(=O)OC)F 62a_100000210202_100000150693 [1,1,0,0,0,0|1,0,1]=4 1476 B14R1.5566 CCSc1cccc(c1C(=O)OC)N 62a_100010253892_100000210202 [1,1,0,0,0,0|1,0,1]=4 1477 B14R1.5566 CNCc1cccc(c1C(=O)OC)I 2230a_106832991635_200010272806 [1,1,0,0,0,0|2,0,0]=4 1478 B14R1.5566 CNCc1cccc(c1C(=O)OC)I 34a_100102657272_200010272806 [1,1,0,0,0,0|2,0,0]=4 1479 B14R1.5566 CNCc1cccc(c1C(=O)OC)I 7a_106832991635_200010272806 [1,1,0,0,0,0|2,0,0]=4 1480 B14R1.5566 COC(=O)c1c(cccc1CSC)I 62a_200000210301_200010272806 [1,1,0,0,0,0|2,0,0]=4 1481 B14R1.5566 COC(=O)c1c(cccc1CSC)I 62a_200010272806_200000210301 [1,1,0,0,0,0|2,0,0]=4 1482 B14R1.5566 COC(=O)c1c(cccc1CS[13CH3])I 62a_200010272806_200025704644 [1,1,0,0,0,0|2,0,0]=4 1483 B14R1.5566 COC(=O)c1c(cccc1CS[13CH3])I 62a_200025704644_200010272806 [1,1,0,0,0,0|2,0,0]=4 1484 B14R1.5566 COCc1cccc(c1C(=O)OC)I 34a_100138415774_200010272806 [1,1,0,0,0,0|2,0,0]=4 1485 B14R1.164 C=C(C)c1ccc(cc1NC(=O)C)C 271570a_100000694244_100000182586 [1,1,0,0,0,0|1,0,0]=3 1486 B14R1.164 C=C(C)c1ccc(cc1NC(=O)C)F 271570a_100000694244_100012558231 [1,1,0,0,0,0|1,0,0]=3 1487 B14R1.164 C=C(C)c1ccc(cc1OC(=O)C)F 271570a_100000694244_200015685721 [1,1,0,0,0,0|2,0,0]=4 1488 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)C)Br 1458a_100000747254_200000210301 [1,1,0,0,0,0|0,0,0]=2 1489 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)C)Cl 1458a_100000195377_200000210301 [1,1,0,0,0,0|0,0,0]=2 1490 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)C)F 1458a_100000222213_200000210301 [1,1,0,0,0,0|0,0,0]=2 1491 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)Br 1626a_100012349972_100015343762 [1,1,0,0,0,0|1,0,0]=3 1492 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)C 11a_100011219537_100015343762 [1,1,0,0,0,0|1,0,0]=3 1493 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)C 1626a_100011219537_100015343762 [1,1,0,0,0,0|1,0,0]=3 1494 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)C 22a_100011219537_100000070787 [1,1,0,0,0,0|1,0,0]=3 1495 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)Cl 11a_100000738103_100015343762 [1,1,0,0,0,0|1,0,0]=3 1496 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)Cl 1626a_100000738103_100015343762 [1,1,0,0,0,0|1,0,0]=3 1497 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)F 11a_100011298637_100015343762 [1,1,0,0,0,0|1,0,0]=3 1498 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)F 1626a_100011298637_100015343762 [1,1,0,0,0,0|1,0,0]=3 1499 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)F 22a_100011298637_100000070787 [1,1,0,0,0,0|1,0,0]=3 1500 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)O 22a_100012186684_100000070787 [1,1,0,0,0,0|1,0,0]=3 1501 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)[13CH3])Br 1458a_100000747254_200025704644 [1,1,0,0,0,0|0,0,0]=2 1502 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000195377_200025704644 [1,1,0,0,0,0|0,0,0]=2 1503 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)[13CH3])F 1458a_100000222213_200025704644 [1,1,0,0,0,0|0,0,0]=2 1504 B14R1.164 CC(=O)Nc1cc(ccc1C(=S)N)Cl 1626a_200011805470_100015343762 [1,1,0,0,0,0|1,1,0]=4 1505 B14R1.164 CC(=O)Nc1cc(ccc1C(C)C)F 11a_100012283353_100015343762 [1,1,0,0,0,0|1,0,1]=4 1506 B14R1.164 CC(=O)Nc1cc(ccc1C(C)C)F 1626a_100012283353_100015343762 [1,1,0,0,0,0|1,0,1]=4 1507 B14R1.164 CC(=O)Nc1cc(ccc1C(C)C)F 22a_100012283353_100000070787 [1,1,0,0,0,0|1,0,1]=4 1508 B14R1.164 CC(=O)Nc1cc(ccc1N(C)C)Br 11a_100000737018_100015343762 [1,1,0,0,0,0|2,0,0]=4 1509 B14R1.164 CC(=O)Nc1cc(ccc1N(C)C)Br 1626a_100000737018_100015343762 [1,1,0,0,0,0|2,0,0]=4 1510 B14R1.164 CC(=O)Nc1cc(ccc1N(C)C)Br 22a_100000737018_100000070787 [1,1,0,0,0,0|2,0,0]=4 1511 B14R1.164 CC(=O)Nc1cc(ccc1N(C)C)C 11a_100015186467_100015343762 [1,1,0,0,0,0|2,0,0]=4 1512 B14R1.164 CC(=O)Nc1cc(ccc1N(C)C)C 1626a_100015186467_100015343762 [1,1,0,0,0,0|2,0,0]=4 1513 B14R1.164 CC(=O)Nc1cc(ccc1N(C)C)C 22a_100015186467_100000070787 [1,1,0,0,0,0|2,0,0]=4 1514 B14R1.164 CC(=O)Nc1cc(ccc1N(C)C)Cl 11a_100000736992_100015343762 [1,1,0,0,0,0|2,0,0]=4 1515 B14R1.164 CC(=O)Nc1cc(ccc1N(C)C)Cl 1626a_100000736992_100015343762 [1,1,0,0,0,0|2,0,0]=4 1516 B14R1.164 CC(=O)Nc1cc(ccc1N(C)C)Cl 22a_100000736992_100000070787 [1,1,0,0,0,0|2,0,0]=4 1517 B14R1.164 CC(=O)c1ccc(cc1C=C(C)C)C 271570a_100102525489_100012353930 [1,1,0,0,0,0|2,0,0]=4 1518 B14R1.164 CC(=O)c1ccc(cc1C=C(C)C)F 271570a_100102525489_100000686192 [1,1,0,0,0,0|2,0,0]=4 1519 B14R1.164 CC(=O)c1ccc(cc1C=C(C)C)O 271570a_100102525489_100012340537 [1,1,0,0,0,0|2,0,0]=4 1520 B14R1.164 CC(=O)c1ccc(cc1NC(C)C)F 27a_100138425928_100000686192 [1,1,0,0,0,0|1,0,1]=4 1521 B14R1.429 CC(=O)N(C)c1ccccc1C(=O)N 11a_100000184419_100015343762 [1,1,0,0,0,0|1,0,0]=3 1522 B14R1.429 CC(=O)N(C)c1ccccc1C(=O)N 1626a_100000184419_100015343762 [1,1,0,0,0,0|1,0,0]=3 1523 B14R1.429 CC(=O)N(C)c1ccccc1C(=O)[13CH3] 1458a_100000242783_200025704644 [1,1,0,0,0,0|0,0,0]=2 1524 B14R1.429 CC(=O)N(C)c1ccccc1C(C)C 11a_106256037369_100015343762 [1,1,0,0,0,0|1,0,1]=4 1525 B14R1.429 CC(=O)N(C)c1ccccc1C(C)C 1626a_106256037369_100015343762 [1,1,0,0,0,0|1,0,1]=4 1526 B14R1.429 CC(=O)N(C)c1ccccc1C(C)C 22a_106256037369_100000070787 [1,1,0,0,0,0|1,0,1]=4 1527 B14R1.429 CC(=O)c1ccccc1C(=C(C)C)C 271570a_200000049429_100000751169 [1,1,0,0,0,0|2,0,0]=4 1528 B14R1.429 CC(=O)c1ccccc1N(C)C(=O)C 1458a_100000242783_200000210301 [1,1,0,0,0,0|0,0,0]=2 1529 B14R1.815 CC(=O)Cc1ccccc1S(=O)(=O)C 1458a_100000070787_100009814939 [1,1,0,0,0,0|2,0,0]=4 1530 B14R1.815 CC(=O)Nc1ccccc1C(C)(C)C 11a_100000211005_100015343762 [1,1,0,0,0,0|1,0,1]=4 1531 B14R1.815 CC(=O)Nc1ccccc1C(C)(C)C 1626a_100000211005_100015343762 [1,1,0,0,0,0|1,0,1]=4 1532 B14R1.815 CC(=O)Nc1ccccc1C(C)(C)C 22a_100000211005_100000070787 [1,1,0,0,0,0|1,0,1]=4 1533 B14R1.815 CC(=O)Nc1ccccc1C(C)(C)O 1626a_100000081495_100015343762 [1,1,0,0,0,0|0,0,2]=4 1534 B14R1.815 CC(=O)Nc1ccccc1C(C)(C)O 22a_100000081495_100000070787 [1,1,0,0,0,0|0,0,2]=4 1535 B14R1.815 CC(=O)Nc1ccccc1C(C)(C)O 527a_100000081495_100103153847 [1,1,0,0,0,0|0,0,2]=4 1536 B14R1.815 CC(=O)Nc1ccccc1P(=O)(C)C 11a_100010749338_100015343762 [1,1,0,0,0,0|1,0,0]=3 1537 B14R1.815 CC(=O)Nc1ccccc1P(=O)(C)C 1626a_100010749338_100015343762 [1,1,0,0,0,0|1,0,0]=3 1538 B14R1.815 CC(=O)Nc1ccccc1P(=O)(C)C 22a_100010749338_100000070787 [1,1,0,0,0,0|1,0,0]=3 1539 B14R1.815 CC(=O)Nc1ccccc1S(=O)(=O)C 11a_100000241000_100015343762 [1,1,0,0,0,0|1,0,0]=3 1540 B14R1.815 CC(=O)Nc1ccccc1S(=O)(=O)C 1626a_100000241000_100015343762 [1,1,0,0,0,0|1,0,0]=3 1541 B14R1.3302 C=C(C)c1ccccc1CC(=O)NC 271570a_100000694244_200009816160 [1,1,0,0,0,0|2,0,0]=4 1542 B14R1.3302 C=C(C)c1ccccc1CC(=O)OC 271570a_100000694244_100000699816 [1,1,0,0,0,0|2,0,0]=4 1543 B14R1.3302 C=C(C)c1ccccc1NC(=O)CC 11a_100000037685_100000210414 [1,1,0,0,0,0|1,0,0]=3 1544 B14R1.3302 C=C(C)c1ccccc1NC(=O)CC 1626a_100000037685_100000210414 [1,1,0,0,0,0|1,0,0]=3 1545 B14R1.3302 C=C(C)c1ccccc1NC(=O)CC 22a_100000037685_100000210414 [1,1,0,0,0,0|1,0,0]=3 1546 B14R1.3302 C=C(C)c1ccccc1NC(=O)CC 271570a_100000694244_100000153536 [1,1,0,0,0,0|1,0,0]=3 1547 B14R1.3302 C=C(C)c1ccccc1NC(=O)CO 22a_100000037685_100000210174 [1,1,0,0,0,0|1,0,0]=3 1548 B14R1.3302 C=C(C)c1ccccc1NC(=O)NC 2430a_100000037685_100102657272 [1,1,0,0,0,0|1,0,0]=3 1549 B14R1.3302 C=C(C)c1ccccc1NC(=O)OC 271570a_100000694244_100000216184 [1,1,0,0,0,0|1,0,0]=3 1550 B14R1.3302 C=CC(=O)Nc1ccccc1C(=C)C 1626a_100000037685_100000185746 [1,1,0,0,0,0|1,0,1]=4 1551 B14R1.3302 C=CC(=O)Nc1ccccc1C(=C)C 22a_100000037685_100000185746 [1,1,0,0,0,0|1,0,1]=4 1552 B14R1.3302 C=CC(=O)Nc1ccccc1C(=O)N 1626a_100000185089_100000185746 [1,1,0,0,0,0|1,0,1]=4 1553 B14R1.3302 C=CC(=O)Nc1ccccc1C(=O)N 22a_100000185089_100000185746 [1,1,0,0,0,0|1,0,1]=4 1554 B14R1.3302 CC(C)c1ccccc1NC(=O)CO 22a_100000210643_100000210174 [1,1,0,0,0,0|1,0,1]=4 1555 B14R1.3302 CC(C)c1ccccc1NC(=O)CO 527a_100000210643_100000210174 [1,1,0,0,0,0|1,0,1]=4 1556 B14R1.3302 CCC(=O)Nc1ccccc1C(=O)C 1458a_100000194446_200000210301 [1,1,0,0,0,0|0,0,0]=2 1557 B14R1.3302 CCC(=O)Nc1ccccc1C(=O)N 11a_100000185089_100000210414 [1,1,0,0,0,0|1,0,0]=3 1558 B14R1.3302 CCC(=O)Nc1ccccc1C(=O)N 1626a_100000185089_100000210414 [1,1,0,0,0,0|1,0,0]=3 1559 B14R1.3302 CCC(=O)Nc1ccccc1C(=O)N 22a_100000185089_100000210414 [1,1,0,0,0,0|1,0,0]=3 1560 B14R1.3302 CCC(=O)Nc1ccccc1C(=O)[13CH3] 1458a_100000194446_200025704644 [1,1,0,0,0,0|0,0,0]=2 1561 B14R1.3302 CCC(=O)Nc1ccccc1C(=S)N 1626a_100000206033_100000210414 [1,1,0,0,0,0|1,1,0]=4 1562 B14R1.3302 CCC(=O)Nc1ccccc1C(C)C 11a_100000210643_100000210414 [1,1,0,0,0,0|1,0,1]=4 1563 B14R1.3302 CCC(=O)Nc1ccccc1C(C)C 1626a_100000210643_100000210414 [1,1,0,0,0,0|1,0,1]=4 1564 B14R1.3302 CCC(=O)Nc1ccccc1C(C)C 22a_100000210643_100000210414 [1,1,0,0,0,0|1,0,1]=4 1565 B14R1.3302 CCC(=O)Nc1ccccc1C(C)C 527a_100000210643_100000210414 [1,1,0,0,0,0|1,0,1]=4 1566 B14R1.3302 CCC(=O)Nc1ccccc1N(C)C 11a_100000737595_100000210414 [1,1,0,0,0,0|2,0,0]=4 1567 B14R1.3302 CCC(=O)Nc1ccccc1N(C)C 1626a_100000737595_100000210414 [1,1,0,0,0,0|2,0,0]=4 1568 B14R1.3302 CCC(=O)Nc1ccccc1N(C)C 22a_100000737595_100000210414 [1,1,0,0,0,0|2,0,0]=4 1569 B14R1.3302 CCC(=O)Nc1ccccc1N(C)C 527a_100000737595_100000210414 [1,1,0,0,0,0|2,0,0]=4 1570 B14R1.3302 CN(C)c1ccccc1NC(=O)CO 22a_100000737595_100000210174 [1,1,0,0,0,0|2,0,0]=4 1571 B14R1.3302 CN(C)c1ccccc1NC(=O)CO 527a_100000737595_100000210174 [1,1,0,0,0,0|2,0,0]=4 1572 B14R1.3302 CNC(=O)Nc1ccccc1C(=S)N 2430a_100000206033_100102657272 [1,1,0,0,0,0|1,1,0]=4 1573 B14R1.3302 CNC(=O)Nc1ccccc1C(C)C 2430a_100000210643_100102657272 [1,1,0,0,0,0|1,0,1]=4 1574 B14R1.3302 CNC(=O)Nc1ccccc1N(C)C 2430a_100000737595_100102657272 [1,1,0,0,0,0|2,0,0]=4 1575 B14R1.3302 COC(=O)Cc1ccccc1C(=O)C 1458a_100000726341_200000210301 [1,1,0,0,0,0|1,0,0]=3 1576 B14R1.3302 COC(=O)Cc1ccccc1C(=O)[13CH3] 1458a_100000726341_200025704644 [1,1,0,0,0,0|1,0,0]=3 1577 B14R1.3302 NC(=O)c1ccccc1NC(=O)CO 22a_100000185089_100000210174 [1,1,0,0,0,0|1,0,0]=3 1578 B14R1.4894 C=C(C)c1cccc(c1NC(=O)C)Cl 11a_200135500832_100015343762 [1,1,0,0,0,0|1,0,0]=3 1579 B14R1.4894 C=C(C)c1cccc(c1NC(=O)C)Cl 1626a_200135500832_100015343762 [1,1,0,0,0,0|1,0,0]=3 1580 B14R1.4894 CC(=O)Nc1c(cccc1C(=O)N)Br 1626a_100010144993_100015343762 [1,1,0,0,0,0|1,0,0]=3 1581 B14R1.4894 CC(=O)Nc1c(cccc1C(=O)N)C 1626a_100000223273_100015343762 [1,1,0,0,0,0|1,0,0]=3 1582 B14R1.4894 CC(=O)Nc1c(cccc1C(=O)N)Cl 1626a_200011997947_100015343762 [1,1,0,0,0,0|1,0,0]=3 1583 B14R1.4894 CC(=O)Nc1c(cccc1C(=O)N)F 1626a_100011722151_100015343762 [1,1,0,0,0,0|1,0,0]=3 1584 B14R1.4894 CC(=O)Nc1c(cccc1C(C)C)Br 11a_100010571509_100015343762 [1,1,0,0,0,0|1,0,1]=4 1585 B14R1.4894 CC(=O)Nc1c(cccc1C(C)C)Br 1626a_100010571509_100015343762 [1,1,0,0,0,0|1,0,1]=4 1586 B14R1.4894 CC(=O)Nc1c(cccc1C(C)C)C 11a_100138557336_100015343762 [1,1,0,0,0,0|1,0,1]=4 1587 B14R1.4894 CC(=O)Nc1c(cccc1C(C)C)C 1626a_100138557336_100015343762 [1,1,0,0,0,0|1,0,1]=4 1588 B14R1.4894 CC(=O)Nc1c(cccc1C(C)C)C 22a_100138557336_100000070787 [1,1,0,0,0,0|1,0,1]=4 1589 B14R1.4894 CC(=O)Nc1c(cccc1C(C)C)Cl 11a_200009958663_100015343762 [1,1,0,0,0,0|1,0,1]=4 1590 B14R1.4894 CC(=O)Nc1c(cccc1C(C)C)Cl 1626a_200009958663_100015343762 [1,1,0,0,0,0|1,0,1]=4 1591 B14R1.4894 CC(=O)c1cccc(c1C=C(C)C)F 271570a_100102525489_100012362612 [1,1,0,0,0,0|2,0,0]=4 1592 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)C)Cl 1458a_200011219801_200000210301 [1,1,0,0,0,0|0,0,0]=2 1593 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)C)F 1458a_100000756107_200000210301 [1,1,0,0,0,0|0,0,0]=2 1594 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)C 11a_100102558177_100015343762 [1,1,0,0,0,0|1,0,0]=3 1595 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)C 1626a_100102558177_100015343762 [1,1,0,0,0,0|1,0,0]=3 1596 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)C 22a_100102558177_100000070787 [1,1,0,0,0,0|1,0,0]=3 1597 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)Cl 11a_100000764435_100015343762 [1,1,0,0,0,0|1,0,0]=3 1598 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)Cl 1626a_100000764435_100015343762 [1,1,0,0,0,0|1,0,0]=3 1599 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)F 11a_100000036109_100015343762 [1,1,0,0,0,0|1,0,0]=3 1600 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)F 1626a_100000036109_100015343762 [1,1,0,0,0,0|1,0,0]=3 1601 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)F 22a_100000036109_100000070787 [1,1,0,0,0,0|1,0,0]=3 1602 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)[13CH3])Cl 1458a_200011219801_200025704644 [1,1,0,0,0,0|0,0,0]=2 1603 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)[13CH3])F 1458a_100000756107_200025704644 [1,1,0,0,0,0|0,0,0]=2 1604 B14R1.4926 CC(=O)Nc1cccc(c1[N+](=O)[O-])C 11a_100011424894_100015343762 [1,1,0,0,0,0|1,0,1]=4 1605 B14R1.4926 CC(=O)Nc1cccc(c1[N+](=O)[O-])Cl 11a_100011934165_100015343762 [1,1,0,0,0,0|1,0,1]=4 1606 B14R1.4926 CC(=O)Nc1cccc(c1[N+](=O)[O-])Cl 1626a_100011934165_100015343762 [1,1,0,0,0,0|1,0,1]=4 1607 B14R1.4926 CC(=O)Nc1cccc(c1[N+](=O)[O-])F 11a_100011219493_100015343762 [1,1,0,0,0,0|1,0,1]=4 1608 B14R1.4926 CC(=O)Nc1cccc(c1[N+](=O)[O-])F 1626a_100011219493_100015343762 [1,1,0,0,0,0|1,0,1]=4 1609 B14R1.4926 CC(=O)Nc1cccc(c1[N+](=O)[O-])I 1626a_100010150234_100015343762 [1,1,0,0,0,0|1,0,1]=4 1610 B14R1.4926 CC(=O)c1c(cccc1C=C(C)C)F 271570a_100102525489_100012351873 [1,1,0,0,0,0|2,0,0]=4 1611 B14R1.4926 CC(=O)c1c(cccc1C=C(C)C)O 271570a_100102525489_100010174959 [1,1,0,0,0,0|2,0,0]=4 1612 B14R1.6074 C=C(C)c1cc(ccc1NC(=O)C)Br 271570a_100000694244_100009813020 [1,1,0,0,0,0|1,0,0]=3 1613 B14R1.6074 C=C(C)c1cc(ccc1NC(=O)C)C 271570a_100000694244_100000152032 [1,1,0,0,0,0|1,0,0]=3 1614 B14R1.6074 C=C(C)c1cc(ccc1NC(=O)C)F 11a_100009961556_100015343762 [1,1,0,0,0,0|1,0,0]=3 1615 B14R1.6074 C=C(C)c1cc(ccc1NC(=O)C)F 1626a_100009961556_100015343762 [1,1,0,0,0,0|1,0,0]=3 1616 B14R1.6074 C=C(C)c1cc(ccc1NC(=O)C)F 22a_100009961556_100000070787 [1,1,0,0,0,0|1,0,0]=3 1617 B14R1.6074 C=C(C)c1cc(ccc1NC(=O)C)F 271570a_100000694244_100011215554 [1,1,0,0,0,0|1,0,0]=3 1618 B14R1.6074 C=C(C)c1cc(cnc1NC(=O)C)C 271570a_100000694244_200009816786 [1,1,0,0,0,0|2,0,0]=4 1619 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)C)Br 1458a_100000195241_200000210301 [1,1,0,0,0,0|0,0,0]=2 1620 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)C)F 1458a_100011219192_200000210301 [1,1,0,0,0,0|0,0,0]=2 1621 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Br 11a_100000740421_100015343762 [1,1,0,0,0,0|1,0,0]=3 1622 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Br 1626a_100000740421_100015343762 [1,1,0,0,0,0|1,0,0]=3 1623 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Br 22a_100000740421_100000070787 [1,1,0,0,0,0|1,0,0]=3 1624 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)C 11a_100011692829_100015343762 [1,1,0,0,0,0|1,0,0]=3 1625 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)C 1626a_100011692829_100015343762 [1,1,0,0,0,0|1,0,0]=3 1626 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)C 22a_100011692829_100000070787 [1,1,0,0,0,0|1,0,0]=3 1627 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Cl 11a_100000743835_100015343762 [1,1,0,0,0,0|1,0,0]=3 1628 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Cl 1626a_100000743835_100015343762 [1,1,0,0,0,0|1,0,0]=3 1629 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Cl 22a_100000743835_100000070787 [1,1,0,0,0,0|1,0,0]=3 1630 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)F 11a_100000741173_100015343762 [1,1,0,0,0,0|1,0,0]=3 1631 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)F 1626a_100000741173_100015343762 [1,1,0,0,0,0|1,0,0]=3 1632 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)F 22a_100000741173_100000070787 [1,1,0,0,0,0|1,0,0]=3 1633 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)[13CH3])Br 1458a_100000195241_200025704644 [1,1,0,0,0,0|0,0,0]=2 1634 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)[13CH3])F 1458a_100011219192_200025704644 [1,1,0,0,0,0|0,0,0]=2 1635 B14R1.6074 CC(=O)Nc1ccc(cc1C(C)C)Br 11a_100000694223_100015343762 [1,1,0,0,0,0|1,0,1]=4 1636 B14R1.6074 CC(=O)Nc1ccc(cc1C(C)C)Br 1626a_100000694223_100015343762 [1,1,0,0,0,0|1,0,1]=4 1637 B14R1.6074 CC(=O)Nc1ccc(cc1C(C)C)Br 22a_100000694223_100000070787 [1,1,0,0,0,0|1,0,1]=4 1638 B14R1.6074 CC(=O)Nc1ccc(cc1C(C)C)Br 527a_100000694223_100103153847 [1,1,0,0,0,0|1,0,1]=4 1639 B14R1.6074 CC(=O)Nc1ccc(cc1C(C)C)F 11a_100011941472_100015343762 [1,1,0,0,0,0|1,0,1]=4 1640 B14R1.6074 CC(=O)Nc1ccc(cc1C(C)C)F 1626a_100011941472_100015343762 [1,1,0,0,0,0|1,0,1]=4 1641 B14R1.6074 CC(=O)Nc1ccc(cc1C(C)C)F 22a_100011941472_100000070787 [1,1,0,0,0,0|1,0,1]=4 1642 B14R1.6074 CC(=O)Nc1ccc(cc1[N+](=O)[O-])Cl 1626a_100000210029_100015343762 [1,1,0,0,0,0|1,0,1]=4 1643 B14R1.6074 CC(=O)Nc1ccc(cc1[N+](=O)[O-])F 11a_100000187532_100015343762 [1,1,0,0,0,0|1,0,1]=4 1644 B14R1.6074 CC(=O)Nc1ccc(cc1[N+](=O)[O-])F 1626a_100000187532_100015343762 [1,1,0,0,0,0|1,0,1]=4 1645 B14R1.6074 CC(=O)Nc1ccc(cc1[N+](=O)[O-])O 527a_100000740891_100103153847 [1,1,0,0,0,0|1,0,1]=4 1646 B14R1.6074 CC(=O)c1cc(ccc1C=C(C)C)Br 271570a_100102525489_100012349576 [1,1,0,0,0,0|2,0,0]=4 1647 B14R1.6074 CC(=O)c1cc(ccc1C=C(C)C)C 271570a_100102525489_100012361225 [1,1,0,0,0,0|2,0,0]=4 1648 B14R1.6074 CC(=O)c1cc(ccc1C=C(C)C)F 271570a_100102525489_100012353695 [1,1,0,0,0,0|2,0,0]=4 1649 B14R1.6074 CC(=O)c1cc(ccc1C=C(C)C)N 271570a_100102525489_100012349454 [1,1,0,0,0,0|2,0,0]=4 1650 B14R1.6312 C=C(C)c1ccccc1NS(=O)(=O)C 271570a_100000694244_100000165598 [1,1,0,0,0,0|2,0,0]=4 1651 B14R1.6312 C=C(C)c1ccccc1NS(=O)(=O)C 40a_100000037685_100000738038 [1,1,0,0,0,0|2,0,0]=4 1652 B14R1.6312 CC(=O)c1ccccc1NS(=O)(=O)C 1458a_100000169588_200000210301 [1,1,0,0,0,0|1,0,0]=3 1653 B14R1.6312 CS(=O)(=O)Nc1ccccc1C(=O)N 40a_100000185089_100000738038 [1,1,0,0,0,0|2,0,0]=4 1654 B14R1.6312 CS(=O)(=O)Nc1ccccc1C(=O)[13CH3] 1458a_100000169588_200025704644 [1,1,0,0,0,0|1,0,0]=3 1655 B14R1.317 CCS(=O)(=O)c1ccccc1C(=O)C 1458a_100000199001_200000210301 [0,1,0,0,1,0|2,0,0]=4 1656 B14R1.317 CCS(=O)(=O)c1ccccc1C(=O)[13CH3] 1458a_100000199001_200025704644 [0,1,0,0,1,0|2,0,0]=4 1657 B14R1.623 C=C(C)c1ccccc1C(=O)NCC 271570a_100000694244_200000155173 [0,1,0,0,1,0|2,0,0]=4 1658 B14R1.623 C=C(C)c1ccccc1C(=O)OCC 271570a_100000694244_100000169879 [0,1,0,0,1,0|1,0,0]=3 1659 B14R1.623 C=C(C)c1cccnc1C(=O)OCC 271570a_100000694244_100012351660 [0,1,0,0,1,0|2,0,0]=4 1660 B14R1.623 C=C(C)c1ccncc1C(=O)OCC 271570a_100000694244_100016987518 [0,1,0,0,1,0|2,0,0]=4 1661 B14R1.623 C=C(C)c1cnccc1C(=O)OCC 271570a_100000694244_100010238393 [0,1,0,0,1,0|2,0,0]=4 1662 B14R1.623 C=C(C)c1ncccc1C(=O)OCC 271570a_100000694244_100000170124 [0,1,0,0,1,0|2,0,0]=4 1663 B14R1.623 CCCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100000210303 [0,1,0,0,1,0|2,0,0]=4 1664 B14R1.623 CCNC(=O)c1ccccc1S(=O)C 240690a_100015525214_100000204632 [0,1,0,0,1,0|2,0,0]=4 1665 B14R1.623 CCOC(=O)c1ccccc1N(C)C 2230a_100160572725_200000210301 [0,1,0,0,1,0|2,0,0]=4 1666 B14R1.623 CCOC(=O)c1ccccc1N(C)C 269982a_100160572725_200000210301 [0,1,0,0,1,0|2,0,0]=4 1667 B14R1.623 CCOC(=O)c1ccccc1N(C)[13CH3] 2230a_100160572725_200025704644 [0,1,0,0,1,0|2,0,0]=4 1668 B14R1.623 CCOC(=O)c1ccccc1N(C)[13CH3] 269982a_100160572725_200025704644 [0,1,0,0,1,0|2,0,0]=4 1669 B14R1.623 CNNC(=O)c1ccccc1S(=O)C 22a_100016993582_100000204632 [0,1,0,0,1,0|2,0,0]=4 1670 B14R1.623 CS(=O)c1ccccc1C(=O)CCF 1458a_100000204632_100011217306 [0,1,0,0,1,0|2,0,0]=4 1671 B14R1.623 CS(=O)c1ccccc1C(=O)CCO 1458a_100000204632_100000211926 [0,1,0,0,1,0|2,0,0]=4 1672 B14R1.707 C=C(C)c1ccc(cc1C(=O)NC)Cl 271570a_100000694244_200011279454 [0,1,0,0,1,0|2,0,0]=4 1673 B14R1.707 C=C(C)c1ccc(cc1C(=O)NC)F 271570a_100000694244_200000206232 [0,1,0,0,1,0|2,0,0]=4 1674 B14R1.707 C=C(C)c1ccc(cc1C(=O)OC)Br 271570a_100000694244_100000148213 [0,1,0,0,1,0|1,0,0]=3 1675 B14R1.707 C=C(C)c1ccc(cc1C(=O)OC)C 271570a_100000694244_100012339458 [0,1,0,0,1,0|1,0,0]=3 1676 B14R1.707 C=C(C)c1ccc(cc1C(=O)OC)Cl 271570a_100000694244_100011294804 [0,1,0,0,1,0|1,0,0]=3 1677 B14R1.707 C=C(C)c1ccc(cc1C(=O)OC)F 271570a_100000694244_100000205820 [0,1,0,0,1,0|1,0,0]=3 1678 B14R1.707 C=C(C)c1ccc(cc1C(=O)OC)N 271570a_100000694244_100000696289 [0,1,0,0,1,0|1,0,0]=3 1679 B14R1.707 C=C(C)c1ccc(cc1C(=O)OC)O 271570a_100000694244_100010230369 [0,1,0,0,1,0|1,0,0]=3 1680 B14R1.707 C=C(C)c1ccc(nc1C(=O)OC)N 271570a_100000694244_100009816986 [0,1,0,0,1,0|2,0,0]=4 1681 B14R1.707 C=C(C)c1ccc(nc1C(=O)OC)O 271570a_100000694244_100010189638 [0,1,0,0,1,0|2,0,0]=4 1682 B14R1.707 C=C(C)c1cnc(cc1C(=O)OC)N 271570a_100000694244_100011934820 [0,1,0,0,1,0|2,0,0]=4 1683 B14R1.707 C=C(C)c1cnc(cc1C(=O)OC)O 271570a_100000694244_100009816900 [0,1,0,0,1,0|2,0,0]=4 1684 B14R1.707 C=C(C)c1ncc(cc1C(=O)OC)C 271570a_100000694244_100000085774 [0,1,0,0,1,0|2,0,0]=4 1685 B14R1.707 C=C(C)c1ncc(cc1C(=O)OC)F 271570a_100000694244_100012000215 [0,1,0,0,1,0|2,0,0]=4 1686 B14R1.707 C=C(C)c1ncc(cc1C(=O)OC)N 271570a_100000694244_200012182668 [0,1,0,0,1,0|2,0,0]=4 1687 B14R1.707 COC(=O)c1cc(ccc1N(C)C)Br 269982a_200000216482_200000210301 [0,1,0,0,1,0|2,0,0]=4 1688 B14R1.707 COC(=O)c1cc(ccc1N(C)C)Br 34a_200000216482_200000210301 [0,1,0,0,1,0|2,0,0]=4 1689 B14R1.707 COC(=O)c1cc(ccc1N(C)C)Br 7a_200000216482_200000210301 [0,1,0,0,1,0|2,0,0]=4 1690 B14R1.707 COC(=O)c1cc(ccc1N(C)C)Cl 269982a_100000216484_200000210301 [0,1,0,0,1,0|2,0,0]=4 1691 B14R1.707 COC(=O)c1cc(ccc1N(C)C)Cl 34a_100000216484_200000210301 [0,1,0,0,1,0|2,0,0]=4 1692 B14R1.707 COC(=O)c1cc(ccc1N(C)C)Cl 38a_100000216484_200000210301 [0,1,0,0,1,0|2,0,0]=4 1693 B14R1.707 COC(=O)c1cc(ccc1N(C)C)F 269982a_100011806480_200000210301 [0,1,0,0,1,0|2,0,0]=4 1694 B14R1.707 COC(=O)c1cc(ccc1N(C)C)F 34a_100011806480_200000210301 [0,1,0,0,1,0|2,0,0]=4 1695 B14R1.707 COC(=O)c1cc(ccc1N(C)C)F 38a_100011806480_200000210301 [0,1,0,0,1,0|2,0,0]=4 1696 B14R1.707 COC(=O)c1cc(ccc1N(C)[13CH3])Br 269982a_200000216482_200025704644 [0,1,0,0,1,0|2,0,0]=4 1697 B14R1.707 COC(=O)c1cc(ccc1N(C)[13CH3])Br 34a_200000216482_200025704644 [0,1,0,0,1,0|2,0,0]=4 1698 B14R1.707 COC(=O)c1cc(ccc1N(C)[13CH3])Br 7a_200000216482_200025704644 [0,1,0,0,1,0|2,0,0]=4 1699 B14R1.707 COC(=O)c1cc(ccc1N(C)[13CH3])Cl 269982a_100000216484_200025704644 [0,1,0,0,1,0|2,0,0]=4 1700 B14R1.707 COC(=O)c1cc(ccc1N(C)[13CH3])Cl 34a_100000216484_200025704644 [0,1,0,0,1,0|2,0,0]=4 1701 B14R1.707 COC(=O)c1cc(ccc1N(C)[13CH3])Cl 38a_100000216484_200025704644 [0,1,0,0,1,0|2,0,0]=4 1702 B14R1.707 COC(=O)c1cc(ccc1N(C)[13CH3])F 269982a_100011806480_200025704644 [0,1,0,0,1,0|2,0,0]=4 1703 B14R1.707 COC(=O)c1cc(ccc1N(C)[13CH3])F 34a_100011806480_200025704644 [0,1,0,0,1,0|2,0,0]=4 1704 B14R1.707 COC(=O)c1cc(ccc1N(C)[13CH3])F 38a_100011806480_200025704644 [0,1,0,0,1,0|2,0,0]=4 1705 B14R1.745 CCC(=O)c1ccccc1S(=O)(=O)C 1458a_100000185186_100000210202 [0,1,0,0,1,0|2,0,0]=4 1706 B14R1.745 CNC(=O)c1ccccc1S(=O)(=O)C 11a_106832991635_100000185186 [0,1,0,0,1,0|2,0,0]=4 1707 B14R1.745 CNC(=O)c1ccccc1S(=O)(=O)C 1626a_100102657272_100000185186 [0,1,0,0,1,0|2,0,0]=4 1708 B14R1.745 CNC(=O)c1ccccc1S(=O)(=O)C 240690a_100102657272_100000185186 [0,1,0,0,1,0|2,0,0]=4 1709 B14R1.1126 C=C(C)c1cc(ccc1C(=O)CC)C 271570a_100000694244_200012349623 [0,1,0,0,1,0|2,0,0]=4 1710 B14R1.1126 C=C(C)c1cc(ccc1C(=O)NC)F 271570a_100000694244_200000206206 [0,1,0,0,1,0|2,0,0]=4 1711 B14R1.1126 C=C(C)c1cc(ccc1C(=O)OC)Br 271570a_100000694244_100000701758 [0,1,0,0,1,0|1,0,0]=3 1712 B14R1.1126 C=C(C)c1cc(ccc1C(=O)OC)C 271570a_100000694244_100012340597 [0,1,0,0,1,0|1,0,0]=3 1713 B14R1.1126 C=C(C)c1cc(ccc1C(=O)OC)Cl 271570a_100000694244_100000047510 [0,1,0,0,1,0|1,0,0]=3 1714 B14R1.1126 C=C(C)c1cc(ccc1C(=O)OC)F 271570a_100000694244_100000204356 [0,1,0,0,1,0|1,0,0]=3 1715 B14R1.1126 C=C(C)c1cc(ccc1C(=O)OC)N 271570a_100000694244_100009998378 [0,1,0,0,1,0|1,0,0]=3 1716 B14R1.1126 C=C(C)c1cc(ccc1C(=O)OC)O 271570a_100000694244_100010150825 [0,1,0,0,1,0|1,0,0]=3 1717 B14R1.1126 C=C(C)c1cc(cnc1C(=O)OC)C 271570a_100000694244_100010167497 [0,1,0,0,1,0|2,0,0]=4 1718 B14R1.1126 C=C(C)c1cc(cnc1C(=O)OC)F 271570a_100000694244_100010189631 [0,1,0,0,1,0|2,0,0]=4 1719 B14R1.1126 C=C(C)c1cc(ncc1C(=O)OC)C 271570a_100000694244_100011998247 [0,1,0,0,1,0|2,0,0]=4 1720 B14R1.1126 C=C(C)c1nc(ccc1C(=O)OC)C 271570a_100000694244_100000054099 [0,1,0,0,1,0|2,0,0]=4 1721 B14R1.1126 C=C(C)c1nc(ccc1C(=O)OC)N 271570a_100000694244_100009865240 [0,1,0,0,1,0|2,0,0]=4 1722 B14R1.1126 C=C(C)c1nc(ccc1C(=O)OC)O 271570a_100000694244_100016008356 [0,1,0,0,1,0|2,0,0]=4 1723 B14R1.1126 COC(=O)c1ccc(cc1C(=O)C)F 1458a_200010710419_200000210301 [0,1,0,0,1,0|0,0,0]=2 1724 B14R1.1126 COC(=O)c1ccc(cc1C(=O)[13CH3])F 1458a_200010710419_200025704644 [0,1,0,0,1,0|0,0,0]=2 1725 B14R1.1126 COC(=O)c1ccc(cc1N(C)C)Br 269982a_200160487225_200000210301 [0,1,0,0,1,0|2,0,0]=4 1726 B14R1.1126 COC(=O)c1ccc(cc1N(C)C)Br 34a_200160487225_200000210301 [0,1,0,0,1,0|2,0,0]=4 1727 B14R1.1126 COC(=O)c1ccc(cc1N(C)[13CH3])Br 269982a_200160487225_200025704644 [0,1,0,0,1,0|2,0,0]=4 1728 B14R1.1126 COC(=O)c1ccc(cc1N(C)[13CH3])Br 34a_200160487225_200025704644 [0,1,0,0,1,0|2,0,0]=4 1729 B14R1.1153 C=C(C)c1c(cccc1C(=O)OC)Br 271570a_100000694244_100010150843 [0,1,0,0,1,0|1,0,0]=3 1730 B14R1.1153 C=C(C)c1c(cccc1C(=O)OC)C 271570a_100000694244_100012002529 [0,1,0,0,1,0|1,0,0]=3 1731 B14R1.1153 C=C(C)c1c(cccc1C(=O)OC)F 271570a_100000694244_100012357630 [0,1,0,0,1,0|1,0,0]=3 1732 B14R1.1153 C=C(C)c1c(cccc1C(=O)OC)N 271570a_100000694244_100000719424 [0,1,0,0,1,0|1,0,0]=3 1733 B14R1.1153 C=C(C)c1c(cccc1C(=O)OC)O 271570a_100000694244_200010230364 [0,1,0,0,1,0|1,0,0]=3 1734 B14R1.1153 COC(=O)c1cccc(c1C(=O)C)Br 1458a_100010710481_200000210301 [0,1,0,0,1,0|0,0,0]=2 1735 B14R1.1153 COC(=O)c1cccc(c1C(=O)[13CH3])Br 1458a_100010710481_200025704644 [0,1,0,0,1,0|0,0,0]=2 1736 B14R1.1164 C=C(C)c1cccc(c1C(=O)NC)F 271570a_100000694244_100012642803 [0,1,0,0,1,0|2,0,0]=4 1737 B14R1.1164 C=C(C)c1cccc(c1C(=O)OC)Br 271570a_100000694244_100010247157 [0,1,0,0,1,0|1,0,0]=3 1738 B14R1.1164 C=C(C)c1cccc(c1C(=O)OC)C 271570a_100000694244_100010204206 [0,1,0,0,1,0|1,0,0]=3 1739 B14R1.1164 C=C(C)c1cccc(c1C(=O)OC)Cl 271570a_100000694244_100010150959 [0,1,0,0,1,0|1,0,0]=3 1740 B14R1.1164 C=C(C)c1cccc(c1C(=O)OC)F 271570a_100000694244_100000150693 [0,1,0,0,1,0|1,0,0]=3 1741 B14R1.1164 C=C(C)c1cccc(c1C(=O)OC)N 271570a_100000694244_100010253892 [0,1,0,0,1,0|1,0,0]=3 1742 B14R1.1164 C=C(C)c1ccnc(c1C(=O)OC)Cl 271570a_100000694244_100010138530 [0,1,0,0,1,0|2,0,0]=4 1743 B14R1.1164 C=C(C)c1ccnc(c1C(=O)OC)F 271570a_100000694244_100010150474 [0,1,0,0,1,0|2,0,0]=4 1744 B14R1.1164 C=C(C)c1cncc(c1C(=O)OC)F 271570a_100000694244_100010189632 [0,1,0,0,1,0|2,0,0]=4 1745 B14R1.1164 C=C(C)c1nccc(c1C(=O)OC)F 271570a_100000694244_100015560809 [0,1,0,0,1,0|2,0,0]=4 1746 B14R1.1164 C=C(C)c1nccc(c1C(=O)OC)N 271570a_100000694244_100009985557 [0,1,0,0,1,0|2,0,0]=4 1747 B14R1.1164 COC(=O)c1c(cccc1N(C)C)Cl 269982a_200010565112_200000210301 [0,1,0,0,1,0|2,0,0]=4 1748 B14R1.1164 COC(=O)c1c(cccc1N(C)C)Cl 34a_200010565112_200000210301 [0,1,0,0,1,0|2,0,0]=4 1749 B14R1.1164 COC(=O)c1c(cccc1N(C)[13CH3])Cl 269982a_200010565112_200025704644 [0,1,0,0,1,0|2,0,0]=4 1750 B14R1.1164 COC(=O)c1c(cccc1N(C)[13CH3])Cl 34a_200010565112_200025704644 [0,1,0,0,1,0|2,0,0]=4 1751 B14R1.1076 COC(=O)c1csc(c1NC(=O)C)C 188690a_106726388886_100015343762 [0,1,0,0,1,0|1,0,0]=3 1752 B14R1.1166 COC(=O)c1c(cnn1C)NC(=O)C 188690a_100011997160_100015343762 [0,1,0,0,1,0|2,0,0]=4 1753 B14R1.3308 CCC(=O)Cc1ccoc1C(=O)OC 1458a_100000210414_100000734845 [0,1,0,0,1,0|2,0,0]=4 1754 B14R1.3308 CCC(=O)Cc1occc1C(=O)OC 1458a_100000210414_100009813464 [0,1,0,0,1,0|2,0,0]=4 1755 B14R1.3308 COC(=O)c1ccoc1CC(=O)CO 1458a_100000210174_100009813464 [0,1,0,0,1,0|2,0,0]=4 1756 B14R1.3308 COC(=O)c1occc1CC(=O)CO 1458a_100000210174_100000734845 [0,1,0,0,1,0|2,0,0]=4 1757 B16R1.959 C=C(C)CNc1ccccc1C(=O)NCC 27a_100000765925_200000155173 [0,1,0,0,0,1|2,0,0]=4 1758 B16R1.959 C=C(C)CNc1ccccc1C(=O)NCC 34a_100000205978_100000748629 [0,1,0,0,0,1|2,0,0]=4 1759 B16R1.959 C=C(C)CNc1ccccc1C(=O)NOC 34a_100011599994_100000748629 [0,1,0,0,0,1|1,0,0]=3 1760 B16R1.959 C=C(C)CNc1ccncc1C(=O)OCC 27a_100000765925_100016987518 [0,1,0,0,0,1|2,0,0]=4 1761 B16R1.959 C=C(C)CNc1ncccc1C(=O)OCC 27a_100000765925_100000170124 [0,1,0,0,0,1|2,0,0]=4 1762 B16R1.959 C=C(C)COc1ccccc1C(=O)OCC 7a_100000169922_100000748629 [0,1,0,0,0,1|2,0,0]=4 1763 B16R1.959 C=C(C)CSc1ccccc1C(=O)OCC 62a_100000169876_100000211660 [0,1,0,0,0,1|2,0,0]=4 1764 B16R1.959 C=C(C)CSc1ccccc1C(=O)OCC 62a_100000748629_100000169879 [0,1,0,0,0,1|2,0,0]=4 1765 B16R1.959 C=C(F)CNc1ccccc1C(=O)NOC 34a_100011599994_100009893438 [0,1,0,0,0,1|1,0,1]=4 1766 B16R1.959 CCNC(=O)c1ccccc1NCC(=O)N 34a_100000205978_100000187820 [0,1,0,0,0,1|2,0,0]=4 1767 B16R1.959 CCNC(=O)c1ccccc1NCC(=O)[O-] 34a_100000205978_100020667443 [0,1,0,0,0,1|2,0,0]=4 1768 B16R1.959 CCOC(=O)c1ccccc1CCC(=O)C 1458a_100000070787_100011002046 [0,1,0,0,0,1|1,0,0]=3 1769 B16R1.959 CCOC(=O)c1ccccc1CNC(C)C 2230a_100138425928_100009816840 [0,1,0,0,0,1|1,0,1]=4 1770 B16R1.959 CCOC(=O)c1ccccc1CNC(C)C 34a_100138425928_100009816840 [0,1,0,0,0,1|1,0,1]=4 1771 B16R1.959 CCOC(=O)c1ccccc1OCC(=O)N 7a_100000169922_100000187820 [0,1,0,0,0,1|2,0,0]=4 1772 B16R1.959 CCOC(=O)c1ccccc1SCC(=O)N 62a_100000169876_100000747473 [0,1,0,0,0,1|2,0,0]=4 1773 B16R1.959 CCOC(=O)c1ccccc1SCC(=O)N 62a_100000747473_100000169879 [0,1,0,0,0,1|2,0,0]=4 1774 B16R1.959 CCOC(=O)c1ccccc1SCC(=O)[O-] 62a_100000169876_100020667443 [0,1,0,0,0,1|2,0,0]=4 1775 B16R1.959 CCOC(=O)c1ccccc1SCC(=O)[O-] 62a_100020667443_100000169879 [0,1,0,0,0,1|2,0,0]=4 1776 B16R1.959 CONC(=O)c1ccccc1NCC(=O)N 34a_100011599994_100000187820 [0,1,0,0,0,1|1,0,0]=3 1777 B16R1.959 CONC(=O)c1ccccc1NCC(=O)[O-] 34a_100011599994_100020667443 [0,1,0,0,0,1|1,0,0]=3 1778 B16R1.959 CONC(=O)c1ccccc1NCC(C)C 34a_100011599994_100000210624 [0,1,0,0,0,1|1,0,1]=4 1779 B16R1.959 CONC(=O)c1ccccc1NCC(C)O 34a_100011599994_100011218427 [0,1,0,0,0,1|0,0,2]=4 1780 B16R1.959 CONC(=O)c1ccccc1NC[C@@H](C)O 34a_100011599994_100009817552 [0,1,0,0,0,1|0,0,2]=4 1781 B16R1.959 CONC(=O)c1ccccc1NC[N+](=O)[O-] 34a_100011599994_100000761209 [0,1,0,0,0,1|2,0,0]=4 1782 B16R1.1175 COC(=O)c1ccccc1CNC(C)(C)C 2230a_100000715429_100000744672 [0,1,0,0,0,1|1,0,1]=4 1783 B16R1.1332 C#CC(=O)CCc1ccccc1C(=O)OC 1458a_100000211873_200010284099 [0,1,0,0,0,1|1,0,1]=4 1784 B16R1.1332 C#CC(C)NCc1ccccc1C(=O)OC 2230a_100000707721_100000744672 [0,1,0,0,0,1|1,0,1]=4 1785 B16R1.1332 C#CC(C)NCc1ccccc1C(=O)OC 34a_100000707721_100000744672 [0,1,0,0,0,1|1,0,1]=4 1786 B16R1.1332 C=CC(=O)CCc1ccccc1C(=O)OC 1458a_100000185746_200010284099 [0,1,0,0,0,1|1,0,1]=4 1787 B16R1.1332 C=CC(=O)NCc1ccccc1C(=O)CC 1458a_100138551331_100000210202 [0,1,0,0,0,1|1,0,1]=4 1788 B16R1.1332 C=CC(=O)NCc1ccccc1C(=O)NC 11a_106832991635_100138551331 [0,1,0,0,0,1|1,0,1]=4 1789 B16R1.1332 C=CC(=O)NCc1ccccc1C(=O)NC 1626a_100102657272_100138551331 [0,1,0,0,0,1|1,0,1]=4 1790 B16R1.1332 C=CC(=O)NCc1ccccc1C(=O)NC 527a_100102657272_100138551331 [0,1,0,0,0,1|1,0,1]=4 1791 B16R1.1332 CCC(=O)CCc1ccccc1C(=O)OC 1458a_100000210414_200010284099 [0,1,0,0,0,1|1,0,0]=3 1792 B16R1.1332 CCC(=O)CCc1ccccc1C(=O)OC 1458a_100000694103_100000210202 [0,1,0,0,0,1|1,0,0]=3 1793 B16R1.1332 CCC(=O)COc1ccccc1C(=O)CC 7a_100000184720_100000747405 [0,1,0,0,0,1|2,0,0]=4 1794 B16R1.1332 CCC(=O)COc1ccccc1C(=O)NC 7a_100000185920_100000747405 [0,1,0,0,0,1|2,0,0]=4 1795 B16R1.1332 CCC(=O)COc1ccccc1C(=O)OC 7a_100000150335_100000747405 [0,1,0,0,0,1|1,0,0]=3 1796 B16R1.1332 CCC(=O)COc1cccnc1C(=O)OC 7a_100000744052_100000747405 [0,1,0,0,0,1|2,0,0]=4 1797 B16R1.1332 CCC(=O)CSc1ccccc1C(=O)NC 62a_100000155073_100000747405 [0,1,0,0,0,1|2,0,0]=4 1798 B16R1.1332 CCC(=O)CSc1ccccc1C(=O)NC 62a_100000747405_100000155073 [0,1,0,0,0,1|2,0,0]=4 1799 B16R1.1332 CCC(=O)CSc1ccccc1C(=O)OC 62a_100000148710_100000747405 [0,1,0,0,0,1|1,0,0]=3 1800 B16R1.1332 CCC(=O)CSc1ccccc1C(=O)OC 62a_100000747405_100000148710 [0,1,0,0,0,1|1,0,0]=3 1801 B16R1.1332 CCC(=O)CSc1ccccc1C(=O)O[Na] 62a_100000747405_114855342371 [0,1,0,0,0,1|2,0,0]=4 1802 B16R1.1332 CCC(=O)CSc1cccnc1C(=O)OC 62a_100000747405_100011935214 [0,1,0,0,0,1|2,0,0]=4 1803 B16R1.1332 CCC(=O)CSc1cccnc1C(=O)OC 62a_100011935214_100000747405 [0,1,0,0,0,1|2,0,0]=4 1804 B16R1.1332 CCC(=O)CSc1ccncc1C(=O)OC 62a_100000747405_100020629055 [0,1,0,0,0,1|2,0,0]=4 1805 B16R1.1332 CCC(=O)CSc1ccncc1C(=O)OC 62a_100020629055_100000747405 [0,1,0,0,0,1|2,0,0]=4 1806 B16R1.1332 CCC(=O)CSc1cnccc1C(=O)OC 62a_100000747405_100010008606 [0,1,0,0,0,1|2,0,0]=4 1807 B16R1.1332 CCC(=O)CSc1cnccc1C(=O)OC 62a_100010008606_100000747405 [0,1,0,0,0,1|2,0,0]=4 1808 B16R1.1332 CCC(=O)CSc1ncccc1C(=O)OC 62a_100000747405_100000150852 [0,1,0,0,0,1|2,0,0]=4 1809 B16R1.1332 CCC(=O)CSc1ncccc1C(=O)OC 62a_100011587185_100000747405 [0,1,0,0,0,1|2,0,0]=4 1810 B16R1.1332 CCC(=O)NCc1ccccc1C(=O)OC 188690a_100000726750_100000210414 [0,1,0,0,0,1|0,0,0]=2 1811 B16R1.1332 CCC(=O)NCc1ncccc1C(=O)OC 188690a_100016994483_100000210414 [0,1,0,0,0,1|1,0,0]=3 1812 B16R1.1332 CCC(=O)c1ccccc1OCC(=O)NC 7a_100000184720_100000183359 [0,1,0,0,0,1|2,0,0]=4 1813 B16R1.1332 CCC(=O)c1ccccc1OCC(=O)OC 7a_100000184720_100000747449 [0,1,0,0,0,1|2,0,0]=4 1814 B16R1.1332 CCC(C)NCc1ccccc1C(=O)OC 2230a_100000209981_100000744672 [0,1,0,0,0,1|1,0,1]=4 1815 B16R1.1332 CNC(=O)CCc1ccccc1C(=O)OC 11a_106832991635_100000694103 [0,1,0,0,0,1|1,0,0]=3 1816 B16R1.1332 CNC(=O)CCc1ccccc1C(=O)OC 1626a_100102657272_100000694103 [0,1,0,0,0,1|1,0,0]=3 1817 B16R1.1332 CNC(=O)CCc1ccccc1C(=O)OC 240690a_100102657272_100000694103 [0,1,0,0,0,1|1,0,0]=3 1818 B16R1.1332 CNC(=O)CCc1ccccc1C(=O)OC 527a_100102657272_100000694103 [0,1,0,0,0,1|1,0,0]=3 1819 B16R1.1332 CNC(=O)CNc1ccccc1C(=O)NC 27a_100000693194_100000155073 [0,1,0,0,0,1|1,0,0]=3 1820 B16R1.1332 CNC(=O)CNc1ccccc1C(=O)NC 34a_100000185696_100000183359 [0,1,0,0,0,1|1,0,0]=3 1821 B16R1.1332 CNC(=O)CNc1ncccc1C(=O)NC 27a_100000693194_100000159833 [0,1,0,0,0,1|2,0,0]=4 1822 B16R1.1332 CNC(=O)CNc1ncccc1C(=O)OC 27a_100000693194_100000150852 [0,1,0,0,0,1|1,0,0]=3 1823 B16R1.1332 CNC(=O)CNc1nccnc1C(=O)OC 27a_100000693194_100000079898 [0,1,0,0,0,1|2,0,0]=4 1824 B16R1.1332 CNC(=O)CNc1ncncc1C(=O)OC 27a_100000693194_100000726419 [0,1,0,0,0,1|2,0,0]=4 1825 B16R1.1332 CNC(=O)COc1ccccc1C(=O)NC 34a_100000185920_100000183359 [0,1,0,0,0,1|2,0,0]=4 1826 B16R1.1332 CNC(=O)COc1ccccc1C(=O)NC 7a_100000185920_100000183359 [0,1,0,0,0,1|2,0,0]=4 1827 B16R1.1332 CNC(=O)COc1ccccc1C(=O)OC 7a_100000150335_100000183359 [0,1,0,0,0,1|1,0,0]=3 1828 B16R1.1332 CNC(=O)COc1cccnc1C(=O)OC 34a_100000744052_100000183359 [0,1,0,0,0,1|2,0,0]=4 1829 B16R1.1332 CNC(=O)COc1cccnc1C(=O)OC 7a_100000744052_100000183359 [0,1,0,0,0,1|2,0,0]=4 1830 B16R1.1332 CNC(=O)CSc1ccccc1C(=O)NC 62a_100000155073_100000183359 [0,1,0,0,0,1|2,0,0]=4 1831 B16R1.1332 CNC(=O)CSc1ccccc1C(=O)NC 62a_100000183359_100000155073 [0,1,0,0,0,1|2,0,0]=4 1832 B16R1.1332 CNC(=O)CSc1ccccc1C(=O)OC 62a_100000148710_100000183359 [0,1,0,0,0,1|1,0,0]=3 1833 B16R1.1332 CNC(=O)CSc1ccccc1C(=O)OC 62a_100000183359_100000148710 [0,1,0,0,0,1|1,0,0]=3 1834 B16R1.1332 CNC(=O)CSc1ccccc1C(=O)O[Na] 62a_100000183359_114855342371 [0,1,0,0,0,1|2,0,0]=4 1835 B16R1.1332 CNC(=O)CSc1cccnc1C(=O)OC 62a_100000183359_100011935214 [0,1,0,0,0,1|2,0,0]=4 1836 B16R1.1332 CNC(=O)CSc1cccnc1C(=O)OC 62a_100011935214_100000183359 [0,1,0,0,0,1|2,0,0]=4 1837 B16R1.1332 CNC(=O)CSc1ccncc1C(=O)OC 62a_100000183359_100020629055 [0,1,0,0,0,1|2,0,0]=4 1838 B16R1.1332 CNC(=O)CSc1ccncc1C(=O)OC 62a_100020629055_100000183359 [0,1,0,0,0,1|2,0,0]=4 1839 B16R1.1332 CNC(=O)CSc1cnccc1C(=O)OC 62a_100000183359_100010008606 [0,1,0,0,0,1|2,0,0]=4 1840 B16R1.1332 CNC(=O)CSc1cnccc1C(=O)OC 62a_100010008606_100000183359 [0,1,0,0,0,1|2,0,0]=4 1841 B16R1.1332 CNC(=O)CSc1ncccc1C(=O)OC 62a_100000183359_100000150852 [0,1,0,0,0,1|2,0,0]=4 1842 B16R1.1332 CNC(=O)CSc1ncccc1C(=O)OC 62a_100011587185_100000183359 [0,1,0,0,0,1|2,0,0]=4 1843 B16R1.1332 CNC(=O)c1ccccc1NCC(=O)OC 34a_100000185696_100000747449 [0,1,0,0,0,1|1,0,0]=3 1844 B16R1.1332 CNC(=O)c1ccccc1OCC(=O)OC 34a_100000185920_100000747449 [0,1,0,0,0,1|2,0,0]=4 1845 B16R1.1332 CNC(=O)c1ccccc1OCC(=O)OC 7a_100000185920_100000747449 [0,1,0,0,0,1|2,0,0]=4 1846 B16R1.1332 CNC(=O)c1ccccc1SCC(=O)OC 62a_100000155073_100000747449 [0,1,0,0,0,1|2,0,0]=4 1847 B16R1.1332 CNC(=O)c1ccccc1SCC(=O)OC 62a_100000747449_100000155073 [0,1,0,0,0,1|2,0,0]=4 1848 B16R1.1332 COC(=O)COc1ccccc1C(=O)OC 7a_100000150335_100000747449 [0,1,0,0,0,1|1,0,0]=3 1849 B16R1.1332 COC(=O)COc1cccnc1C(=O)OC 34a_100000744052_100000747449 [0,1,0,0,0,1|2,0,0]=4 1850 B16R1.1332 COC(=O)COc1cccnc1C(=O)OC 7a_100000744052_100000747449 [0,1,0,0,0,1|2,0,0]=4 1851 B16R1.1332 COC(=O)CSc1ccccc1C(=O)OC 62a_100000148710_100000747449 [0,1,0,0,0,1|1,0,0]=3 1852 B16R1.1332 COC(=O)CSc1ccccc1C(=O)OC 62a_100000747449_100000148710 [0,1,0,0,0,1|1,0,0]=3 1853 B16R1.1332 COC(=O)CSc1ccccc1C(=O)O[Na] 62a_100000747449_114855342371 [0,1,0,0,0,1|2,0,0]=4 1854 B16R1.1332 COC(=O)CSc1cccnc1C(=O)OC 62a_100000747449_100011935214 [0,1,0,0,0,1|2,0,0]=4 1855 B16R1.1332 COC(=O)CSc1cccnc1C(=O)OC 62a_100011935214_100000747449 [0,1,0,0,0,1|2,0,0]=4 1856 B16R1.1332 COC(=O)CSc1ccncc1C(=O)OC 62a_100000747449_100020629055 [0,1,0,0,0,1|2,0,0]=4 1857 B16R1.1332 COC(=O)CSc1ccncc1C(=O)OC 62a_100020629055_100000747449 [0,1,0,0,0,1|2,0,0]=4 1858 B16R1.1332 COC(=O)CSc1cnccc1C(=O)OC 62a_100000747449_100010008606 [0,1,0,0,0,1|2,0,0]=4 1859 B16R1.1332 COC(=O)CSc1cnccc1C(=O)OC 62a_100010008606_100000747449 [0,1,0,0,0,1|2,0,0]=4 1860 B16R1.1332 COC(=O)CSc1ncccc1C(=O)OC 62a_100000747449_100000150852 [0,1,0,0,0,1|2,0,0]=4 1861 B16R1.1332 COC(=O)CSc1ncccc1C(=O)OC 62a_100011587185_100000747449 [0,1,0,0,0,1|2,0,0]=4 1862 B16R1.1332 COC(=O)c1ccccc1CCC(=O)CF 1458a_100000694103_100015361967 [0,1,0,0,0,1|1,0,0]=3 1863 B16R1.1332 COC(=O)c1ccccc1CCC(=O)CO 1458a_100000210174_200010284099 [0,1,0,0,0,1|1,0,0]=3 1864 B16R1.1332 COC(=O)c1ccccc1CNC(=O)CO 188690a_100000726750_100000210174 [0,1,0,0,0,1|0,0,0]=2 1865 B16R1.1332 COC(=O)c1ccccc1CNC(C)C#N 2230a_100000737613_100000744672 [0,1,0,0,0,1|1,0,1]=4 1866 B16R1.1332 COC(=O)c1ccccc1CN[C@H](C)CO 2230a_100000737577_100000744672 [0,1,0,0,0,1|0,0,2]=4 1867 B16R1.1332 COC(=O)c1cccnc1CNC(=O)CO 188690a_100016994483_100000210174 [0,1,0,0,0,1|1,0,0]=3 1868 B16R1.7618 C=C(C)CNc1ccccc1C(=O)N(C)C 34a_100000188421_100000748629 [0,1,0,0,0,1|2,0,0]=4 1869 B16R1.7618 CC(=O)NCc1ccccc1C(=C(C)C)C 271570a_200000049429_100011237613 [0,1,0,0,0,1|2,0,0]=4 1870 B16R1.7618 CN(C)C(=O)c1ccccc1NCC(=O)N 34a_100000188421_100000187820 [0,1,0,0,0,1|2,0,0]=4 1871 B16R1.7618 CN(C)C(=O)c1ccccc1NCC(=O)[O-] 34a_100000188421_100020667443 [0,1,0,0,0,1|2,0,0]=4 1872 B16R1.16697 C=C(C)CC(=O)c1ccccc1C(=O)OC 1458a_100011215673_100000748629 [0,1,0,0,0,1|2,0,0]=4 1873 B16R1.16697 C=C(C)CN(C)c1ccccc1C(=O)NC 27a_100000225649_100000155073 [0,1,0,0,0,1|2,0,0]=4 1874 B16R1.16697 C=C(C)CN(C)c1ccccc1C(=O)OC 269982a_100000170468_100000748629 [0,1,0,0,0,1|1,0,0]=3 1875 B16R1.16697 C=C(C)CN(C)c1ccccc1C(=O)OC 34a_100000170468_100000748629 [0,1,0,0,0,1|1,0,0]=3 1876 B16R1.16697 C=C(C)CN(C)c1ncccc1C(=O)OC 27a_100000225649_100000150852 [0,1,0,0,0,1|2,0,0]=4 1877 B16R1.16697 C=C(F)CN(C)c1ccccc1C(=O)OC 269982a_100000170468_100009893438 [0,1,0,0,0,1|1,0,1]=4 1878 B16R1.16697 C=C(F)CN(C)c1ccccc1C(=O)OC 34a_100000170468_100009893438 [0,1,0,0,0,1|1,0,1]=4 1879 B16R1.16697 CNC(=O)c1ccccc1N(C)CC(=O)N 27a_100000739694_100000155073 [0,1,0,0,0,1|2,0,0]=4 1880 B16R1.16697 COC(=O)c1ccccc1C(=O)CC(=O)N 1458a_100011215673_100000187820 [0,1,0,0,0,1|2,0,0]=4 1881 B16R1.16697 COC(=O)c1ccccc1C(=O)CC(=O)[O-] 1458a_100011215673_100020667443 [0,1,0,0,0,1|2,0,0]=4 1882 B16R1.16697 COC(=O)c1ccccc1C(=O)NC(C)C 1626a_100138425928_100011215673 [0,1,0,0,0,1|1,0,1]=4 1883 B16R1.16697 COC(=O)c1ccccc1C(=O)NC(C)C 240690a_100138425928_100011215673 [0,1,0,0,0,1|1,0,1]=4 1884 B16R1.16697 COC(=O)c1ccccc1N(C)CC(=O)N 269982a_100000170468_100000187820 [0,1,0,0,0,1|1,0,0]=3 1885 B16R1.16697 COC(=O)c1ccccc1N(C)CC(=O)N 34a_100000170468_100000187820 [0,1,0,0,0,1|1,0,0]=3 1886 B16R1.16697 COC(=O)c1ccccc1N(C)CC(=O)[O-] 269982a_100000170468_100020667443 [0,1,0,0,0,1|1,0,0]=3 1887 B16R1.16697 COC(=O)c1ccccc1N(C)CC(=O)[O-] 34a_100000170468_100020667443 [0,1,0,0,0,1|1,0,0]=3 1888 B16R1.16697 COC(=O)c1ccccc1N(C)CC(C)C 269982a_100000170468_100000210624 [0,1,0,0,0,1|1,0,1]=4 1889 B16R1.16697 COC(=O)c1ccccc1N(C)CC(C)C 34a_100000170468_100000210624 [0,1,0,0,0,1|1,0,1]=4 1890 B16R1.16697 COC(=O)c1ccccc1N(C)CC(C)O 269982a_100000170468_100011218427 [0,1,0,0,0,1|0,0,2]=4 1891 B16R1.16697 COC(=O)c1ccccc1N(C)CC(C)O 34a_100000170468_100011218427 [0,1,0,0,0,1|0,0,2]=4 1892 B16R1.16697 COC(=O)c1ccccc1N(C)C[C@@H](C)O 269982a_100000170468_100009817552 [0,1,0,0,0,1|0,0,2]=4 1893 B16R1.16697 COC(=O)c1ccccc1N(C)C[C@@H](C)O 34a_100000170468_100009817552 [0,1,0,0,0,1|0,0,2]=4 1894 B16R1.16697 COC(=O)c1ccccc1N(C)C[N+](=O)[O-] 269982a_100000170468_100000761209 [0,1,0,0,0,1|2,0,0]=4 1895 B16R1.16697 COC(=O)c1ccccc1N(C)C[N+](=O)[O-] 34a_100000170468_100000761209 [0,1,0,0,0,1|2,0,0]=4 1896 B16R1.16697 COC(=O)c1cccnc1N(C)CC(=O)N 27a_100000739694_100000150852 [0,1,0,0,0,1|2,0,0]=4 1897 B16R1.16698 C=C(C)C(=O)Cc1ccccc1C(=O)OC 1458a_100000185857_100000744672 [0,1,0,0,0,1|2,0,0]=4 1898 B16R1.16698 C=C(C)C(=O)Nc1ccccc1C(=O)NC 11a_100000185696_100000185857 [0,1,0,0,0,1|2,0,0]=4 1899 B16R1.16698 C=C(C)C(=O)Nc1ccccc1C(=O)NC 1626a_100000185696_100000185857 [0,1,0,0,0,1|2,0,0]=4 1900 B16R1.16698 C=C(C)C(=O)Nc1ccccc1C(=O)NC 22a_100000185696_100000185857 [0,1,0,0,0,1|2,0,0]=4 1901 B16R1.16698 CC(=O)C(C)Sc1ccccc1C(=O)O[Na] 62a_100009814033_114855342371 [0,1,0,0,0,1|2,0,0]=4 1902 B16R1.16698 CCC(=O)c1ccccc1OC(C)C(=O)C 7a_100000184720_100000179758 [0,1,0,0,0,1|2,0,0]=4 1903 B16R1.16698 CNC(=O)c1ccccc1NC(=O)C(=O)N 22a_100000185696_100011215815 [0,1,0,0,0,1|2,0,0]=4 1904 B16R1.16698 CNC(=O)c1ccccc1NC(C)C(=O)N 34a_100000185696_100000702099 [0,1,0,0,0,1|2,0,0]=4 1905 B16R1.16698 CNC(=O)c1ccccc1NC(F)C(=O)N 34a_100000185696_100009813875 [0,1,0,0,0,1|2,0,0]=4 1906 B16R1.16698 CNC(=O)c1ccccc1NC(F)C(=O)[O-] 34a_100000185696_100020610796 [0,1,0,0,0,1|2,0,0]=4 1907 B16R1.16698 CNC(=O)c1ccccc1N[C@H](C)C(=O)N 27a_100000119354_100000155073 [0,1,0,0,0,1|2,0,0]=4 1908 B16R1.16698 CNC(=O)c1ccccc1OC(C)C(=O)C 7a_100000185920_100000179758 [0,1,0,0,0,1|2,0,0]=4 1909 B16R1.16698 CNC(=O)c1ccccc1SC(C)C(=O)C 62a_100000155073_100009814033 [0,1,0,0,0,1|2,0,0]=4 1910 B16R1.16698 CNC(=O)c1ccccc1SC(C)C(=O)C 62a_100009814033_100000155073 [0,1,0,0,0,1|2,0,0]=4 1911 B16R1.16698 COC(=O)c1ccccc1CN(C)C(C)C 269982a_200000211004_100000744672 [0,1,0,0,0,1|1,0,1]=4 1912 B16R1.16698 COC(=O)c1ccccc1OC(C)C(=O)C 7a_100000150335_100000179758 [0,1,0,0,0,1|1,0,0]=3 1913 B16R1.16698 COC(=O)c1ccccc1OC(C)C(=O)N 7a_100000150335_100000702099 [0,1,0,0,0,1|2,0,0]=4 1914 B16R1.16698 COC(=O)c1ccccc1OC(F)C(=O)N 7a_100000150335_100009813875 [0,1,0,0,0,1|2,0,0]=4 1915 B16R1.16698 COC(=O)c1ccccc1SC(C)C(=O)C 62a_100000148710_100009814033 [0,1,0,0,0,1|1,0,0]=3 1916 B16R1.16698 COC(=O)c1ccccc1SC(C)C(=O)C 62a_100009814033_100000148710 [0,1,0,0,0,1|1,0,0]=3 1917 B16R1.16698 COC(=O)c1ccccc1SC(C)C(=O)N 62a_100000148710_100000702099 [0,1,0,0,0,1|2,0,0]=4 1918 B16R1.16698 COC(=O)c1ccccc1SC(C)C(=O)N 62a_100000702099_100000148710 [0,1,0,0,0,1|2,0,0]=4 1919 B16R1.16698 COC(=O)c1ccccc1SC(F)C(=O)N 62a_100000148710_100009813875 [0,1,0,0,0,1|2,0,0]=4 1920 B16R1.16698 COC(=O)c1ccccc1SC(F)C(=O)N 62a_100009813875_100000148710 [0,1,0,0,0,1|2,0,0]=4 1921 B16R1.16698 COC(=O)c1ccccc1SC(F)C(=O)[O-] 62a_100000148710_100020610796 [0,1,0,0,0,1|2,0,0]=4 1922 B16R1.16698 COC(=O)c1ccccc1SC(F)C(=O)[O-] 62a_100020610796_100000148710 [0,1,0,0,0,1|2,0,0]=4 1923 B16R1.16698 COC(=O)c1cccnc1N[C@H](C)C(=O)N 27a_100000119354_100000150852 [0,1,0,0,0,1|2,0,0]=4 1924 B16R1.16698 COC(=O)c1cccnc1SC(C)C(=O)C 62a_100009814033_100000150852 [0,1,0,0,0,1|2,0,0]=4 1925 B16R1.16698 COC(=O)c1cccnc1SC(C)C(=O)C 62a_100011587185_100009814033 [0,1,0,0,0,1|2,0,0]=4 1926 B16R1.16698 COC(=O)c1ccncc1SC(C)C(=O)C 62a_100009814033_100010008606 [0,1,0,0,0,1|2,0,0]=4 1927 B16R1.16698 COC(=O)c1ccncc1SC(C)C(=O)C 62a_100010008606_100009814033 [0,1,0,0,0,1|2,0,0]=4 1928 B16R1.16698 COC(=O)c1cnccc1SC(C)C(=O)C 62a_100009814033_100020629055 [0,1,0,0,0,1|2,0,0]=4 1929 B16R1.16698 COC(=O)c1cnccc1SC(C)C(=O)C 62a_100020629055_100009814033 [0,1,0,0,0,1|2,0,0]=4 1930 B16R1.16698 COC(=O)c1ncccc1OC(C)C(=O)C 7a_100000744052_100000179758 [0,1,0,0,0,1|2,0,0]=4 1931 B16R1.16698 COC(=O)c1ncccc1SC(C)C(=O)C 62a_100009814033_100011935214 [0,1,0,0,0,1|2,0,0]=4 1932 B16R1.16698 COC(=O)c1ncccc1SC(C)C(=O)C 62a_100011935214_100009814033 [0,1,0,0,0,1|2,0,0]=4 1933 B16R1.16763 C=C(C)CNc1ccc(cc1C(=O)NC)Br 34a_100000690504_100000748629 [0,1,0,0,0,1|2,0,0]=4 1934 B16R1.16763 C=C(C)CNc1ccc(cc1C(=O)NC)Cl 27a_100000765925_200011279454 [0,1,0,0,0,1|2,0,0]=4 1935 B16R1.16763 C=C(C)CNc1ccc(cc1C(=O)NC)Cl 34a_100000739363_100000748629 [0,1,0,0,0,1|2,0,0]=4 1936 B16R1.16763 C=C(C)CNc1ccc(cc1C(=O)NC)F 27a_100000765925_200000206232 [0,1,0,0,0,1|2,0,0]=4 1937 B16R1.16763 C=C(C)CNc1ncc(cc1C(=O)OC)C 27a_100000765925_100000085774 [0,1,0,0,0,1|2,0,0]=4 1938 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)Br 34a_100000149267_100000748629 [0,1,0,0,0,1|2,0,0]=4 1939 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)Br 7a_100000149267_100000748629 [0,1,0,0,0,1|2,0,0]=4 1940 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)C 34a_100000216618_100000748629 [0,1,0,0,0,1|2,0,0]=4 1941 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)C 7a_100000216618_100000748629 [0,1,0,0,0,1|2,0,0]=4 1942 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)Cl 34a_100000149278_100000748629 [0,1,0,0,0,1|2,0,0]=4 1943 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)Cl 7a_100000149278_100000748629 [0,1,0,0,0,1|2,0,0]=4 1944 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)F 34a_100011219540_100000748629 [0,1,0,0,0,1|2,0,0]=4 1945 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)F 7a_100011219540_100000748629 [0,1,0,0,0,1|2,0,0]=4 1946 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)I 34a_100000149868_100000748629 [0,1,0,0,0,1|2,0,0]=4 1947 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)I 7a_100000149868_100000748629 [0,1,0,0,0,1|2,0,0]=4 1948 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)N 34a_100011246163_100000748629 [0,1,0,0,0,1|2,0,0]=4 1949 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)OC)N 7a_100011246163_100000748629 [0,1,0,0,0,1|2,0,0]=4 1950 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)Br 62a_100000148213_100000211660 [0,1,0,0,0,1|2,0,0]=4 1951 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)Br 62a_100000748629_100000148213 [0,1,0,0,0,1|2,0,0]=4 1952 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)C 62a_100000748629_100012339458 [0,1,0,0,0,1|2,0,0]=4 1953 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)C 62a_100012339458_100000211660 [0,1,0,0,0,1|2,0,0]=4 1954 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)Cl 62a_100000748629_100011294804 [0,1,0,0,0,1|2,0,0]=4 1955 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)Cl 62a_100011294804_100000211660 [0,1,0,0,0,1|2,0,0]=4 1956 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)F 62a_100000205820_100000211660 [0,1,0,0,0,1|2,0,0]=4 1957 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)F 62a_100000748629_100000205820 [0,1,0,0,0,1|2,0,0]=4 1958 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)N 62a_100000696289_100000211660 [0,1,0,0,0,1|2,0,0]=4 1959 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)N 62a_100000748629_100011794239 [0,1,0,0,0,1|2,0,0]=4 1960 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)O 62a_100000748629_100010230369 [0,1,0,0,0,1|2,0,0]=4 1961 B16R1.16763 C=C(C)CSc1ccc(cc1C(=O)OC)O 62a_100010230369_100000211660 [0,1,0,0,0,1|2,0,0]=4 1962 B16R1.16763 CNC(=O)c1cc(ccc1NCC(=O)N)Br 34a_100000690504_100000187820 [0,1,0,0,0,1|2,0,0]=4 1963 B16R1.16763 CNC(=O)c1cc(ccc1NCC(=O)N)Cl 34a_100000739363_100000187820 [0,1,0,0,0,1|2,0,0]=4 1964 B16R1.16763 CNC(=O)c1cc(ccc1NCC(=O)[O-])Br 34a_100000690504_100020667443 [0,1,0,0,0,1|2,0,0]=4 1965 B16R1.16763 CNC(=O)c1cc(ccc1NCC(=O)[O-])Cl 34a_100000739363_100020667443 [0,1,0,0,0,1|2,0,0]=4 1966 B16R1.16763 COC(=O)c1cc(ccc1CNC(=O)C)Br 188690a_100016992124_100015343762 [0,1,0,0,0,1|0,0,0]=2 1967 B16R1.16763 COC(=O)c1cc(ccc1CNC(C)C)Br 2230a_100138425928_100000728005 [0,1,0,0,0,1|1,0,1]=4 1968 B16R1.16763 COC(=O)c1cc(ccc1CNC(C)C)Br 34a_100138425928_100000728005 [0,1,0,0,0,1|1,0,1]=4 1969 B16R1.16763 COC(=O)c1cc(ccc1CNC(C)C)Cl 2230a_100138425928_100012352085 [0,1,0,0,0,1|1,0,1]=4 1970 B16R1.16763 COC(=O)c1cc(ccc1CNC(C)C)Cl 34a_100138425928_100012352085 [0,1,0,0,0,1|1,0,1]=4 1971 B16R1.16763 COC(=O)c1cc(ccc1CNC(C)C)F 2230a_100138425928_100000751459 [0,1,0,0,0,1|1,0,1]=4 1972 B16R1.16763 COC(=O)c1cc(ccc1CNC(C)C)F 34a_100138425928_100000751459 [0,1,0,0,0,1|1,0,1]=4 1973 B16R1.16763 COC(=O)c1cc(ccc1CNC(C)C)I 2230a_100138425928_100011096949 [0,1,0,0,0,1|1,0,1]=4 1974 B16R1.16763 COC(=O)c1cc(ccc1CNC(C)C)I 34a_100138425928_100011096949 [0,1,0,0,0,1|1,0,1]=4 1975 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)Br 34a_100000149267_100000187820 [0,1,0,0,0,1|2,0,0]=4 1976 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)Br 7a_100000149267_100000187820 [0,1,0,0,0,1|2,0,0]=4 1977 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)C 34a_100000216618_100000187820 [0,1,0,0,0,1|2,0,0]=4 1978 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)C 7a_100000216618_100000187820 [0,1,0,0,0,1|2,0,0]=4 1979 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)Cl 34a_100000149278_100000187820 [0,1,0,0,0,1|2,0,0]=4 1980 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)Cl 7a_100000149278_100000187820 [0,1,0,0,0,1|2,0,0]=4 1981 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)F 34a_100011219540_100000187820 [0,1,0,0,0,1|2,0,0]=4 1982 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)F 7a_100011219540_100000187820 [0,1,0,0,0,1|2,0,0]=4 1983 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)I 34a_100000149868_100000187820 [0,1,0,0,0,1|2,0,0]=4 1984 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)I 7a_100000149868_100000187820 [0,1,0,0,0,1|2,0,0]=4 1985 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)N 34a_100011246163_100000187820 [0,1,0,0,0,1|2,0,0]=4 1986 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)N 7a_100011246163_100000187820 [0,1,0,0,0,1|2,0,0]=4 1987 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])Br 34a_100000149267_100020667443 [0,1,0,0,0,1|2,0,0]=4 1988 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])C 34a_100000216618_100020667443 [0,1,0,0,0,1|2,0,0]=4 1989 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])Cl 34a_100000149278_100020667443 [0,1,0,0,0,1|2,0,0]=4 1990 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])F 34a_100011219540_100020667443 [0,1,0,0,0,1|2,0,0]=4 1991 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])I 34a_100000149868_100020667443 [0,1,0,0,0,1|2,0,0]=4 1992 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])N 34a_100011246163_100020667443 [0,1,0,0,0,1|2,0,0]=4 1993 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)Br 62a_100000148213_100000747473 [0,1,0,0,0,1|2,0,0]=4 1994 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)Br 62a_100000747473_100000148213 [0,1,0,0,0,1|2,0,0]=4 1995 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)C 62a_100000747473_100012339458 [0,1,0,0,0,1|2,0,0]=4 1996 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)C 62a_100012339458_100000747473 [0,1,0,0,0,1|2,0,0]=4 1997 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)Cl 62a_100000747473_100011294804 [0,1,0,0,0,1|2,0,0]=4 1998 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)Cl 62a_100011294804_100000747473 [0,1,0,0,0,1|2,0,0]=4 1999 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)F 62a_100000205820_100000747473 [0,1,0,0,0,1|2,0,0]=4 2000 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)F 62a_100000747473_100000205820 [0,1,0,0,0,1|2,0,0]=4 2001 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)N 62a_100000696289_100000747473 [0,1,0,0,0,1|2,0,0]=4 2002 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)N 62a_100000747473_100011794239 [0,1,0,0,0,1|2,0,0]=4 2003 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)O 62a_100000747473_100010230369 [0,1,0,0,0,1|2,0,0]=4 2004 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)N)O 62a_100010230369_100000747473 [0,1,0,0,0,1|2,0,0]=4 2005 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])Br 62a_100000148213_100020667443 [0,1,0,0,0,1|2,0,0]=4 2006 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])Br 62a_100020667443_100000148213 [0,1,0,0,0,1|2,0,0]=4 2007 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])C 62a_100012339458_100020667443 [0,1,0,0,0,1|2,0,0]=4 2008 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])C 62a_100020667443_100012339458 [0,1,0,0,0,1|2,0,0]=4 2009 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])Cl 62a_100011294804_100020667443 [0,1,0,0,0,1|2,0,0]=4 2010 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])Cl 62a_100020667443_100011294804 [0,1,0,0,0,1|2,0,0]=4 2011 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])F 62a_100000205820_100020667443 [0,1,0,0,0,1|2,0,0]=4 2012 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])F 62a_100020667443_100000205820 [0,1,0,0,0,1|2,0,0]=4 2013 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])N 62a_100000696289_100020667443 [0,1,0,0,0,1|2,0,0]=4 2014 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])N 62a_100020667443_100011794239 [0,1,0,0,0,1|2,0,0]=4 2015 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])O 62a_100010230369_100020667443 [0,1,0,0,0,1|2,0,0]=4 2016 B16R1.16763 COC(=O)c1cc(ccc1SCC(=O)[O-])O 62a_100020667443_100010230369 [0,1,0,0,0,1|2,0,0]=4 2017 B16R1.17274 C=C(C)CNc1cccc(c1C(=O)NC)F 27a_100000765925_100012642803 [0,1,0,0,0,1|2,0,0]=4 2018 B16R1.17274 C=C(C)COc1cccc(c1C(=O)OC)C 34a_100000084604_100000748629 [0,1,0,0,0,1|2,0,0]=4 2019 B16R1.17274 C=C(C)COc1cccc(c1C(=O)OC)C 7a_100000084604_100000748629 [0,1,0,0,0,1|2,0,0]=4 2020 B16R1.17274 C=C(C)COc1cccc(c1C(=O)OC)Cl 34a_200000055445_100000748629 [0,1,0,0,0,1|2,0,0]=4 2021 B16R1.17274 C=C(C)COc1cccc(c1C(=O)OC)Cl 7a_200000055445_100000748629 [0,1,0,0,0,1|2,0,0]=4 2022 B16R1.17274 C=C(C)COc1cccc(c1C(=O)OC)F 34a_100011216559_100000748629 [0,1,0,0,0,1|2,0,0]=4 2023 B16R1.17274 C=C(C)COc1cccc(c1C(=O)OC)F 7a_100011216559_100000748629 [0,1,0,0,0,1|2,0,0]=4 2024 B16R1.17274 C=C(C)CSc1cccc(c1C(=O)OC)Br 62a_100000748629_100010247157 [0,1,0,0,0,1|2,0,0]=4 2025 B16R1.17274 C=C(C)CSc1cccc(c1C(=O)OC)Br 62a_100010247157_100000211660 [0,1,0,0,0,1|2,0,0]=4 2026 B16R1.17274 C=C(C)CSc1cccc(c1C(=O)OC)C 62a_100000748629_100010204206 [0,1,0,0,0,1|2,0,0]=4 2027 B16R1.17274 C=C(C)CSc1cccc(c1C(=O)OC)C 62a_100010204206_100000211660 [0,1,0,0,0,1|2,0,0]=4 2028 B16R1.17274 C=C(C)CSc1cccc(c1C(=O)OC)Cl 62a_100000748629_100010150959 [0,1,0,0,0,1|2,0,0]=4 2029 B16R1.17274 C=C(C)CSc1cccc(c1C(=O)OC)Cl 62a_100010150959_100000211660 [0,1,0,0,0,1|2,0,0]=4 2030 B16R1.17274 C=C(C)CSc1cccc(c1C(=O)OC)F 62a_100000150693_100000211660 [0,1,0,0,0,1|2,0,0]=4 2031 B16R1.17274 C=C(C)CSc1cccc(c1C(=O)OC)F 62a_100000748629_100000150693 [0,1,0,0,0,1|2,0,0]=4 2032 B16R1.17274 C=C(C)CSc1cccc(c1C(=O)OC)N 62a_100010253892_100000211660 [0,1,0,0,0,1|2,0,0]=4 2033 B16R1.17274 COC(=O)c1c(cccc1CNC(C)C)I 2230a_100138425928_200010272806 [0,1,0,0,0,1|1,0,1]=4 2034 B16R1.17274 COC(=O)c1c(cccc1CNC(C)C)I 34a_100138425928_200010272806 [0,1,0,0,0,1|1,0,1]=4 2035 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)C 34a_100000084604_100000187820 [0,1,0,0,0,1|2,0,0]=4 2036 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)C 7a_100000084604_100000187820 [0,1,0,0,0,1|2,0,0]=4 2037 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)Cl 34a_200000055445_100000187820 [0,1,0,0,0,1|2,0,0]=4 2038 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)Cl 7a_200000055445_100000187820 [0,1,0,0,0,1|2,0,0]=4 2039 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)F 34a_100011216559_100000187820 [0,1,0,0,0,1|2,0,0]=4 2040 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)F 7a_100011216559_100000187820 [0,1,0,0,0,1|2,0,0]=4 2041 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)[O-])C 34a_100000084604_100020667443 [0,1,0,0,0,1|2,0,0]=4 2042 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)[O-])Cl 34a_200000055445_100020667443 [0,1,0,0,0,1|2,0,0]=4 2043 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)[O-])F 34a_100011216559_100020667443 [0,1,0,0,0,1|2,0,0]=4 2044 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)N)Br 62a_100000747473_100010247157 [0,1,0,0,0,1|2,0,0]=4 2045 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)N)Br 62a_100010247157_100000747473 [0,1,0,0,0,1|2,0,0]=4 2046 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)N)C 62a_100000747473_100010204206 [0,1,0,0,0,1|2,0,0]=4 2047 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)N)C 62a_100010204206_100000747473 [0,1,0,0,0,1|2,0,0]=4 2048 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)N)Cl 62a_100000747473_100010150959 [0,1,0,0,0,1|2,0,0]=4 2049 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)N)Cl 62a_100010150959_100000747473 [0,1,0,0,0,1|2,0,0]=4 2050 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)N)F 62a_100000150693_100000747473 [0,1,0,0,0,1|2,0,0]=4 2051 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)N)F 62a_100000747473_100000150693 [0,1,0,0,0,1|2,0,0]=4 2052 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)N)N 62a_100010253892_100000747473 [0,1,0,0,0,1|2,0,0]=4 2053 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)[O-])Br 62a_100010247157_100020667443 [0,1,0,0,0,1|2,0,0]=4 2054 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)[O-])Br 62a_100020667443_100010247157 [0,1,0,0,0,1|2,0,0]=4 2055 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)[O-])C 62a_100010204206_100020667443 [0,1,0,0,0,1|2,0,0]=4 2056 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)[O-])C 62a_100020667443_100010204206 [0,1,0,0,0,1|2,0,0]=4 2057 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)[O-])Cl 62a_100010150959_100020667443 [0,1,0,0,0,1|2,0,0]=4 2058 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)[O-])Cl 62a_100020667443_100010150959 [0,1,0,0,0,1|2,0,0]=4 2059 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)[O-])F 62a_100000150693_100020667443 [0,1,0,0,0,1|2,0,0]=4 2060 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)[O-])F 62a_100020667443_100000150693 [0,1,0,0,0,1|2,0,0]=4 2061 B16R1.17274 COC(=O)c1c(cccc1SCC(=O)[O-])N 62a_100010253892_100020667443 [0,1,0,0,0,1|2,0,0]=4 2062 B16R1.74189 C=C(C)CNc1c(cccc1C(=O)NC)C 34a_100000223168_100000748629 [0,1,0,0,0,1|2,0,0]=4 2063 B16R1.74189 C=C(C)CNc1c(cccc1C(=O)NC)Cl 34a_200012181065_100000748629 [0,1,0,0,0,1|2,0,0]=4 2064 B16R1.74189 C=C(C)COc1c(cccc1C(=O)OC)Br 34a_100009816214_100000748629 [0,1,0,0,0,1|2,0,0]=4 2065 B16R1.74189 C=C(C)COc1c(cccc1C(=O)OC)C 34a_100000149854_100000748629 [0,1,0,0,0,1|2,0,0]=4 2066 B16R1.74189 C=C(C)COc1c(cccc1C(=O)OC)C 7a_100000149854_100000748629 [0,1,0,0,0,1|2,0,0]=4 2067 B16R1.74189 C=C(C)COc1c(cccc1C(=O)OC)Cl 34a_100000074923_100000748629 [0,1,0,0,0,1|2,0,0]=4 2068 B16R1.74189 C=C(C)COc1c(cccc1C(=O)OC)Cl 7a_100000074923_100000748629 [0,1,0,0,0,1|2,0,0]=4 2069 B16R1.74189 C=C(C)COc1c(cccc1C(=O)OC)F 34a_100000082593_100000748629 [0,1,0,0,0,1|2,0,0]=4 2070 B16R1.74189 C=C(C)COc1c(cccc1C(=O)OC)F 7a_100000082593_100000748629 [0,1,0,0,0,1|2,0,0]=4 2071 B16R1.74189 C=C(C)COc1c(cccc1C(=O)OC)N 34a_100000750886_100000748629 [0,1,0,0,0,1|2,0,0]=4 2072 B16R1.74189 C=C(C)CSc1c(cccc1C(=O)OC)Br 62a_100000748629_100010150843 [0,1,0,0,0,1|2,0,0]=4 2073 B16R1.74189 C=C(C)CSc1c(cccc1C(=O)OC)Br 62a_100010150843_100000211660 [0,1,0,0,0,1|2,0,0]=4 2074 B16R1.74189 C=C(C)CSc1c(cccc1C(=O)OC)C 62a_100000748629_100012002529 [0,1,0,0,0,1|2,0,0]=4 2075 B16R1.74189 C=C(C)CSc1c(cccc1C(=O)OC)C 62a_100012002529_100000211660 [0,1,0,0,0,1|2,0,0]=4 2076 B16R1.74189 C=C(C)CSc1c(cccc1C(=O)OC)F 62a_100000748629_100012357630 [0,1,0,0,0,1|2,0,0]=4 2077 B16R1.74189 C=C(C)CSc1c(cccc1C(=O)OC)F 62a_100012357630_100000211660 [0,1,0,0,0,1|2,0,0]=4 2078 B16R1.74189 C=C(C)CSc1c(cccc1C(=O)OC)N 62a_100000719424_100000211660 [0,1,0,0,0,1|2,0,0]=4 2079 B16R1.74189 C=C(C)CSc1c(cccc1C(=O)OC)O 62a_100000748629_200010230364 [0,1,0,0,0,1|2,0,0]=4 2080 B16R1.74189 C=C(C)CSc1c(cccc1C(=O)OC)O 62a_200010230364_100000211660 [0,1,0,0,0,1|2,0,0]=4 2081 B16R1.74189 CNC(=O)c1cccc(c1NCC(=O)N)C 34a_100000223168_100000187820 [0,1,0,0,0,1|2,0,0]=4 2082 B16R1.74189 CNC(=O)c1cccc(c1NCC(=O)N)Cl 34a_200012181065_100000187820 [0,1,0,0,0,1|2,0,0]=4 2083 B16R1.74189 CNC(=O)c1cccc(c1NCC(=O)[O-])C 34a_100000223168_100020667443 [0,1,0,0,0,1|2,0,0]=4 2084 B16R1.74189 CNC(=O)c1cccc(c1NCC(=O)[O-])Cl 34a_200012181065_100020667443 [0,1,0,0,0,1|2,0,0]=4 2085 B16R1.74189 COC(=O)c1cccc(c1CNC(C)C)Br 2230a_100138425928_100012352084 [0,1,0,0,0,1|1,0,1]=4 2086 B16R1.74189 COC(=O)c1cccc(c1CNC(C)C)Br 34a_100138425928_100012352084 [0,1,0,0,0,1|1,0,1]=4 2087 B16R1.74189 COC(=O)c1cccc(c1CNC(C)C)Cl 2230a_100138425928_100000725332 [0,1,0,0,0,1|1,0,1]=4 2088 B16R1.74189 COC(=O)c1cccc(c1CNC(C)C)Cl 34a_100138425928_100000725332 [0,1,0,0,0,1|1,0,1]=4 2089 B16R1.74189 COC(=O)c1cccc(c1CNC(C)C)F 2230a_100138425928_100010239718 [0,1,0,0,0,1|1,0,1]=4 2090 B16R1.74189 COC(=O)c1cccc(c1CNC(C)C)F 34a_100138425928_100010239718 [0,1,0,0,0,1|1,0,1]=4 2091 B16R1.74189 COC(=O)c1cccc(c1CNC(C)C)I 2230a_100138425928_100011003723 [0,1,0,0,0,1|1,0,1]=4 2092 B16R1.74189 COC(=O)c1cccc(c1CNC(C)C)I 34a_100138425928_100011003723 [0,1,0,0,0,1|1,0,1]=4 2093 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)Br 34a_100009816214_100000187820 [0,1,0,0,0,1|2,0,0]=4 2094 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)C 34a_100000149854_100000187820 [0,1,0,0,0,1|2,0,0]=4 2095 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)C 7a_100000149854_100000187820 [0,1,0,0,0,1|2,0,0]=4 2096 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)Cl 34a_100000074923_100000187820 [0,1,0,0,0,1|2,0,0]=4 2097 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)Cl 7a_100000074923_100000187820 [0,1,0,0,0,1|2,0,0]=4 2098 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)F 34a_100000082593_100000187820 [0,1,0,0,0,1|2,0,0]=4 2099 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)F 7a_100000082593_100000187820 [0,1,0,0,0,1|2,0,0]=4 2100 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)N 34a_100000750886_100000187820 [0,1,0,0,0,1|2,0,0]=4 2101 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)[O-])Br 34a_100009816214_100020667443 [0,1,0,0,0,1|2,0,0]=4 2102 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)[O-])C 34a_100000149854_100020667443 [0,1,0,0,0,1|2,0,0]=4 2103 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)[O-])Cl 34a_100000074923_100020667443 [0,1,0,0,0,1|2,0,0]=4 2104 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)[O-])F 34a_100000082593_100020667443 [0,1,0,0,0,1|2,0,0]=4 2105 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)[O-])N 34a_100000750886_100020667443 [0,1,0,0,0,1|2,0,0]=4 2106 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)N)Br 62a_100000747473_100010150843 [0,1,0,0,0,1|2,0,0]=4 2107 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)N)Br 62a_100010150843_100000747473 [0,1,0,0,0,1|2,0,0]=4 2108 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)N)C 62a_100000747473_100012002529 [0,1,0,0,0,1|2,0,0]=4 2109 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)N)C 62a_100012002529_100000747473 [0,1,0,0,0,1|2,0,0]=4 2110 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)N)F 62a_100000747473_100012357630 [0,1,0,0,0,1|2,0,0]=4 2111 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)N)F 62a_100012357630_100000747473 [0,1,0,0,0,1|2,0,0]=4 2112 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)N)N 62a_100000719424_100000747473 [0,1,0,0,0,1|2,0,0]=4 2113 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)N)O 62a_100000747473_200010230364 [0,1,0,0,0,1|2,0,0]=4 2114 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)N)O 62a_200010230364_100000747473 [0,1,0,0,0,1|2,0,0]=4 2115 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)[O-])Br 62a_100010150843_100020667443 [0,1,0,0,0,1|2,0,0]=4 2116 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)[O-])Br 62a_100020667443_100010150843 [0,1,0,0,0,1|2,0,0]=4 2117 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)[O-])C 62a_100012002529_100020667443 [0,1,0,0,0,1|2,0,0]=4 2118 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)[O-])C 62a_100020667443_100012002529 [0,1,0,0,0,1|2,0,0]=4 2119 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)[O-])F 62a_100012357630_100020667443 [0,1,0,0,0,1|2,0,0]=4 2120 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)[O-])F 62a_100020667443_100012357630 [0,1,0,0,0,1|2,0,0]=4 2121 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)[O-])N 62a_100000719424_100020667443 [0,1,0,0,0,1|2,0,0]=4 2122 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)[O-])O 62a_100020667443_200010230364 [0,1,0,0,0,1|2,0,0]=4 2123 B16R1.74189 COC(=O)c1cccc(c1SCC(=O)[O-])O 62a_200010230364_100020667443 [0,1,0,0,0,1|2,0,0]=4 2124 B16R1.75817 C=C(C)CNc1cc(ccc1C(=O)CC)C 27a_100000765925_200012349623 [0,1,0,0,0,1|2,0,0]=4 2125 B16R1.75817 C=C(C)CNc1cc(ccc1C(=O)NC)Cl 34a_100000742614_100000748629 [0,1,0,0,0,1|2,0,0]=4 2126 B16R1.75817 C=C(C)CNc1cc(ccc1C(=O)NC)F 27a_100000765925_200000206206 [0,1,0,0,0,1|2,0,0]=4 2127 B16R1.75817 C=C(C)CNc1cc(ncc1C(=O)OC)C 27a_100000765925_100011998247 [0,1,0,0,0,1|2,0,0]=4 2128 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)Br 34a_100000699699_100000748629 [0,1,0,0,0,1|2,0,0]=4 2129 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)Br 7a_100000699699_100000748629 [0,1,0,0,0,1|2,0,0]=4 2130 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)C 34a_100000148187_100000748629 [0,1,0,0,0,1|2,0,0]=4 2131 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)C 7a_100000148187_100000748629 [0,1,0,0,0,1|2,0,0]=4 2132 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)Cl 34a_100000151441_100000748629 [0,1,0,0,0,1|2,0,0]=4 2133 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)Cl 7a_100000151441_100000748629 [0,1,0,0,0,1|2,0,0]=4 2134 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)F 34a_100011216117_100000748629 [0,1,0,0,0,1|2,0,0]=4 2135 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)F 7a_100011216117_100000748629 [0,1,0,0,0,1|2,0,0]=4 2136 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)I 7a_100000062286_100000748629 [0,1,0,0,0,1|2,0,0]=4 2137 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)N 34a_100000718744_100000748629 [0,1,0,0,0,1|2,0,0]=4 2138 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)OC)N 7a_100000718744_100000748629 [0,1,0,0,0,1|2,0,0]=4 2139 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)Br 62a_100000701758_100000211660 [0,1,0,0,0,1|2,0,0]=4 2140 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)C 62a_100000748629_100012340597 [0,1,0,0,0,1|2,0,0]=4 2141 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)C 62a_100012340597_100000211660 [0,1,0,0,0,1|2,0,0]=4 2142 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)Cl 62a_100000047510_100000211660 [0,1,0,0,0,1|2,0,0]=4 2143 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)Cl 62a_100000748629_100000047510 [0,1,0,0,0,1|2,0,0]=4 2144 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)F 62a_100000204356_100000211660 [0,1,0,0,0,1|2,0,0]=4 2145 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)F 62a_100000748629_100000204356 [0,1,0,0,0,1|2,0,0]=4 2146 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)N 62a_100000748629_100010150747 [0,1,0,0,0,1|2,0,0]=4 2147 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)N 62a_100009998378_100000211660 [0,1,0,0,0,1|2,0,0]=4 2148 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)O 62a_100000748629_100010150825 [0,1,0,0,0,1|2,0,0]=4 2149 B16R1.75817 C=C(C)CSc1cc(ccc1C(=O)OC)O 62a_100010150825_100000211660 [0,1,0,0,0,1|2,0,0]=4 2150 B16R1.75817 CNC(=O)c1ccc(cc1NCC(=O)N)Cl 34a_100000742614_100000187820 [0,1,0,0,0,1|2,0,0]=4 2151 B16R1.75817 CNC(=O)c1ccc(cc1NCC(=O)[O-])Cl 34a_100000742614_100020667443 [0,1,0,0,0,1|2,0,0]=4 2152 B16R1.75817 COC(=O)c1ccc(cc1CNC(C)C)Br 2230a_100138425928_100000693193 [0,1,0,0,0,1|1,0,1]=4 2153 B16R1.75817 COC(=O)c1ccc(cc1CNC(C)C)Br 34a_100138425928_100000693193 [0,1,0,0,0,1|1,0,1]=4 2154 B16R1.75817 COC(=O)c1ccc(cc1CNC(C)C)Cl 2230a_100138425928_100010239717 [0,1,0,0,0,1|1,0,1]=4 2155 B16R1.75817 COC(=O)c1ccc(cc1CNC(C)C)Cl 34a_100138425928_100010239717 [0,1,0,0,0,1|1,0,1]=4 2156 B16R1.75817 COC(=O)c1ccc(cc1CNC(C)C)F 2230a_100138425928_100000700702 [0,1,0,0,0,1|1,0,1]=4 2157 B16R1.75817 COC(=O)c1ccc(cc1CNC(C)C)F 34a_100138425928_100000700702 [0,1,0,0,0,1|1,0,1]=4 2158 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)Br 34a_100000699699_100000187820 [0,1,0,0,0,1|2,0,0]=4 2159 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)Br 7a_100000699699_100000187820 [0,1,0,0,0,1|2,0,0]=4 2160 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)C 34a_100000148187_100000187820 [0,1,0,0,0,1|2,0,0]=4 2161 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)C 7a_100000148187_100000187820 [0,1,0,0,0,1|2,0,0]=4 2162 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)Cl 34a_100000151441_100000187820 [0,1,0,0,0,1|2,0,0]=4 2163 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)Cl 7a_100000151441_100000187820 [0,1,0,0,0,1|2,0,0]=4 2164 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)F 34a_100011216117_100000187820 [0,1,0,0,0,1|2,0,0]=4 2165 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)F 7a_100011216117_100000187820 [0,1,0,0,0,1|2,0,0]=4 2166 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)I 7a_100000062286_100000187820 [0,1,0,0,0,1|2,0,0]=4 2167 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)N 34a_100000718744_100000187820 [0,1,0,0,0,1|2,0,0]=4 2168 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)N 7a_100000718744_100000187820 [0,1,0,0,0,1|2,0,0]=4 2169 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)[O-])Br 34a_100000699699_100020667443 [0,1,0,0,0,1|2,0,0]=4 2170 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)[O-])C 34a_100000148187_100020667443 [0,1,0,0,0,1|2,0,0]=4 2171 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)[O-])Cl 34a_100000151441_100020667443 [0,1,0,0,0,1|2,0,0]=4 2172 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)[O-])F 34a_100011216117_100020667443 [0,1,0,0,0,1|2,0,0]=4 2173 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)[O-])N 34a_100000718744_100020667443 [0,1,0,0,0,1|2,0,0]=4 2174 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)Br 62a_100000701758_100000747473 [0,1,0,0,0,1|2,0,0]=4 2175 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)C 62a_100000747473_100012340597 [0,1,0,0,0,1|2,0,0]=4 2176 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)C 62a_100012340597_100000747473 [0,1,0,0,0,1|2,0,0]=4 2177 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)Cl 62a_100000047510_100000747473 [0,1,0,0,0,1|2,0,0]=4 2178 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)Cl 62a_100000747473_100000047510 [0,1,0,0,0,1|2,0,0]=4 2179 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)F 62a_100000204356_100000747473 [0,1,0,0,0,1|2,0,0]=4 2180 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)F 62a_100000747473_100000204356 [0,1,0,0,0,1|2,0,0]=4 2181 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)N 62a_100000747473_100010150747 [0,1,0,0,0,1|2,0,0]=4 2182 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)N 62a_100009998378_100000747473 [0,1,0,0,0,1|2,0,0]=4 2183 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)O 62a_100000747473_100010150825 [0,1,0,0,0,1|2,0,0]=4 2184 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)N)O 62a_100010150825_100000747473 [0,1,0,0,0,1|2,0,0]=4 2185 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])Br 62a_100000701758_100020667443 [0,1,0,0,0,1|2,0,0]=4 2186 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])C 62a_100012340597_100020667443 [0,1,0,0,0,1|2,0,0]=4 2187 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])C 62a_100020667443_100012340597 [0,1,0,0,0,1|2,0,0]=4 2188 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])Cl 62a_100000047510_100020667443 [0,1,0,0,0,1|2,0,0]=4 2189 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])Cl 62a_100020667443_100000047510 [0,1,0,0,0,1|2,0,0]=4 2190 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])F 62a_100000204356_100020667443 [0,1,0,0,0,1|2,0,0]=4 2191 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])F 62a_100020667443_100000204356 [0,1,0,0,0,1|2,0,0]=4 2192 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])N 62a_100009998378_100020667443 [0,1,0,0,0,1|2,0,0]=4 2193 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])N 62a_100020667443_100010150747 [0,1,0,0,0,1|2,0,0]=4 2194 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])O 62a_100010150825_100020667443 [0,1,0,0,0,1|2,0,0]=4 2195 B16R1.75817 COC(=O)c1ccc(cc1SCC(=O)[O-])O 62a_100020667443_100010150825 [0,1,0,0,0,1|2,0,0]=4 2196 B16R1.1554 C#CCC(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100011220946 [0,1,0,0,0,1|1,0,1]=4 2197 B16R1.1554 C=CCC(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100000210193 [0,1,0,0,0,1|1,0,1]=4 2198 B16R1.1554 C=CCC(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100000210193 [0,1,0,0,0,1|1,0,1]=4 2199 B16R1.1554 C=CCC(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000210193 [0,1,0,0,0,1|1,0,1]=4 2200 B16R1.1554 CC#CC(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000763181 [0,1,0,0,0,1|1,0,0]=3 2201 B16R1.1554 CC(=O)Nc1ccccc1NC(=O)C=CBr 1626a_100011193560_100016273825 [0,1,0,0,0,1|1,0,1]=4 2202 B16R1.1554 CC(=O)Nc1ccccc1NC(=O)C=CCl 11a_100011193560_200016279998 [0,1,0,0,0,1|1,0,1]=4 2203 B16R1.1554 CC(=O)Nc1ccccc1NC(=O)C=CCl 1626a_100011193560_200016279998 [0,1,0,0,0,1|1,0,1]=4 2204 B16R1.1554 CC(=O)Nc1ccccc1NC(=O)C=CI 1626a_100011193560_100016256311 [0,1,0,0,0,1|1,0,1]=4 2205 B16R1.1554 CC(=O)Nc1ccccc1NC(=O)CC#N 1626a_100011193560_100051588842 [0,1,0,0,0,1|1,0,1]=4 2206 B16R1.1554 CC(=O)Nc1ccccc1NC(=O)CC#N 22a_100011193560_100051588842 [0,1,0,0,0,1|1,0,1]=4 2207 B16R1.1554 CC(=O)Nc1ccccc1NC(=O)CCO 22a_100011193560_100011216618 [0,1,0,0,0,1|1,0,0]=3 2208 B16R1.1554 CC=CC(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100000210699 [0,1,0,0,0,1|1,0,0]=3 2209 B16R1.1554 CC=CC(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100000210699 [0,1,0,0,0,1|1,0,0]=3 2210 B16R1.1554 CC=CC(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000210699 [0,1,0,0,0,1|1,0,0]=3 2211 B16R1.1554 CCCC(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100000211992 [0,1,0,0,0,1|1,0,0]=3 2212 B16R1.1554 CCCC(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100000211992 [0,1,0,0,0,1|1,0,0]=3 2213 B16R1.1554 CCCC(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000211992 [0,1,0,0,0,1|1,0,0]=3 2214 B16R1.1554 CCNC(=O)Nc1ccccc1NC(=O)C 2430a_100011193560_100015525214 [0,1,0,0,0,1|1,0,0]=3 2215 B16R1.1554 CCOC(=O)Cc1ccccc1C=C(C)C 271570a_100102525489_100011218996 [0,1,0,0,0,1|2,0,0]=4 2216 B16R1.1554 CCOC(=O)Cc1ccccc1NC(=O)C 188690a_100000755671_100015343762 [0,1,0,0,0,1|0,0,0]=2 2217 B16R1.1554 CNCC(=O)Nc1ccccc1NC(=O)C 2230a_106832991635_100000066250 [0,1,0,0,0,1|1,0,0]=3 2218 B16R1.1554 CNCC(=O)Nc1ccccc1NC(=O)C 7a_106832991635_100000066250 [0,1,0,0,0,1|1,0,0]=3 2219 B16R1.1554 COCC(=O)Nc1ccccc1C=C(C)C 271570a_100102525489_200000158336 [0,1,0,0,0,1|2,0,0]=4 2220 B16R1.1554 COCC(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100000210968 [0,1,0,0,0,1|0,0,0]=2 2221 B16R1.1554 COCC(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100000210968 [0,1,0,0,0,1|0,0,0]=2 2222 B16R1.1554 COCC(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000210968 [0,1,0,0,0,1|0,0,0]=2 2223 B16R1.1554 COCC(C)Nc1ccccc1NC(=O)C 34a_100011193560_100000765312 [0,1,0,0,0,1|1,0,1]=4 2224 B16R1.1554 COCC(C)Oc1ccccc1NC(=O)C 34a_100000185124_100000765312 [0,1,0,0,0,1|1,0,1]=4 2225 B16R1.1554 COCC(C)Oc1ccccc1NC(=O)C 7a_100000185124_100000765312 [0,1,0,0,0,1|1,0,1]=4 2226 B16R1.1554 COCC(C)Sc1ccccc1NC(=O)C 62a_100000765312_100000153524 [0,1,0,0,0,1|1,0,1]=4 2227 B16R1.1554 CSCC(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100000184570 [0,1,0,0,0,1|0,1,0]=3 2228 B16R1.1554 CSCC(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100000184570 [0,1,0,0,0,1|0,1,0]=3 2229 B16R1.1554 CSCC(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000184570 [0,1,0,0,0,1|0,1,0]=3 2230 B16R1.1661 COC(=O)C(=O)c1ccccc1C=C(C)C 271570a_100102525489_200010133017 [0,1,0,0,0,1|2,0,0]=4 2231 B16R1.1661 COC(=O)C(O)c1ccccc1C=C(C)C 271570a_100102525489_200011625927 [0,1,0,0,0,1|2,0,0]=4 2232 B16R1.1661 CON(C)C(=O)c1ccccc1NC(=O)C 11a_100000748624_100015343762 [0,1,0,0,0,1|2,0,0]=4 2233 B16R1.1661 CON(C)C(=O)c1ccccc1NC(=O)C 1626a_100000748624_100015343762 [0,1,0,0,0,1|2,0,0]=4 2234 B16R1.1661 CON(C)C(=O)c1ccccc1NC(=O)C 22a_100000748624_100000070787 [0,1,0,0,0,1|2,0,0]=4 2235 B16R1.4377 C=CC(=O)Nc1cc(ccc1NC(=O)C)Br 22a_100000749274_100000185746 [0,1,0,0,0,1|1,0,1]=4 2236 B16R1.4377 C=CC(=O)Nc1cc(ccc1NC(=O)C)C 1626a_100000750913_100000185746 [0,1,0,0,0,1|1,0,1]=4 2237 B16R1.4377 C=CC(=O)Nc1cc(ccc1NC(=O)C)C 22a_100000750913_100000185746 [0,1,0,0,0,1|1,0,1]=4 2238 B16R1.4377 C=CC(=O)Nc1cc(ccc1NC(=O)C)Cl 1626a_100000747302_100000185746 [0,1,0,0,0,1|1,0,1]=4 2239 B16R1.4377 C=CC(=O)Nc1cc(ccc1NC(=O)C)Cl 22a_100000747302_100000185746 [0,1,0,0,0,1|1,0,1]=4 2240 B16R1.4377 CC(=O)Nc1ccc(cc1NC(=O)CO)Br 22a_100000749274_100000210174 [0,1,0,0,0,1|2,0,0]=4 2241 B16R1.4377 CC(=O)Nc1ccc(cc1NC(=O)CO)C 22a_100000750913_100000210174 [0,1,0,0,0,1|2,0,0]=4 2242 B16R1.4377 CC(=O)Nc1ccc(cc1NC(=O)CO)Cl 22a_100000747302_100000210174 [0,1,0,0,0,1|2,0,0]=4 2243 B16R1.4377 CCC(=O)Nc1cc(ccc1NC(=O)C)Br 11a_100000749274_100000210414 [0,1,0,0,0,1|1,0,0]=3 2244 B16R1.4377 CCC(=O)Nc1cc(ccc1NC(=O)C)Br 22a_100000749274_100000210414 [0,1,0,0,0,1|1,0,0]=3 2245 B16R1.4377 CCC(=O)Nc1cc(ccc1NC(=O)C)C 11a_100000750913_100000210414 [0,1,0,0,0,1|1,0,0]=3 2246 B16R1.4377 CCC(=O)Nc1cc(ccc1NC(=O)C)C 1626a_100000750913_100000210414 [0,1,0,0,0,1|1,0,0]=3 2247 B16R1.4377 CCC(=O)Nc1cc(ccc1NC(=O)C)C 22a_100000750913_100000210414 [0,1,0,0,0,1|1,0,0]=3 2248 B16R1.4377 CCC(=O)Nc1cc(ccc1NC(=O)C)Cl 11a_100000747302_100000210414 [0,1,0,0,0,1|1,0,0]=3 2249 B16R1.4377 CCC(=O)Nc1cc(ccc1NC(=O)C)Cl 1626a_100000747302_100000210414 [0,1,0,0,0,1|1,0,0]=3 2250 B16R1.4377 CCC(=O)Nc1cc(ccc1NC(=O)C)Cl 22a_100000747302_100000210414 [0,1,0,0,0,1|1,0,0]=3 2251 B16R1.4377 CNC(=O)Nc1cc(ccc1NC(=O)C)C 2430a_100000750913_100102657272 [0,1,0,0,0,1|1,0,0]=3 2252 B16R1.4377 COC(C)Sc1cc(ccc1NC(=O)C)Br 62a_100009813020_100009879195 [0,1,0,0,0,1|1,0,1]=4 2253 B16R1.4377 COC(C)Sc1cc(ccc1NC(=O)C)C 62a_100009879195_100000152032 [0,1,0,0,0,1|1,0,1]=4 2254 B16R1.4377 COC(C)Sc1cc(ccc1NC(=O)C)F 62a_100009879195_100011215554 [0,1,0,0,0,1|1,0,1]=4 2255 B16R1.4412 COC(=O)Cc1ccccc1C(=C(C)C)C 271570a_200000049429_100000699816 [0,1,0,0,0,1|2,0,0]=4 2256 B16R1.4412 COC(=O)Nc1ccccc1C(=C(C)C)C 271570a_200000049429_100000216184 [0,1,0,0,0,1|2,0,0]=4 2257 B16R1.4414 C#CC(=O)Cc1ccccc1CC(=O)OC 1458a_100000211873_100000094086 [0,1,0,0,0,1|1,0,1]=4 2258 B16R1.4414 C=CC(=O)Cc1ccccc1CC(=O)OC 1458a_100000185746_100000094086 [0,1,0,0,0,1|1,0,1]=4 2259 B16R1.4414 C=CC(=O)Nc1ccccc1CC(=O)NC 1626a_100000738506_100000185746 [0,1,0,0,0,1|1,0,1]=4 2260 B16R1.4414 C=CC(=O)Nc1ccccc1CC(=O)NC 22a_100000738506_100000185746 [0,1,0,0,0,1|1,0,1]=4 2261 B16R1.4414 CCC(=O)Cc1ccccc1CC(=O)OC 1458a_100000210414_100000094086 [0,1,0,0,0,1|1,0,0]=3 2262 B16R1.4414 CCC(=O)Nc1ccccc1CC(=O)NC 11a_100000738506_100000210414 [0,1,0,0,0,1|1,0,0]=3 2263 B16R1.4414 CCC(=O)Nc1ccccc1CC(=O)NC 1626a_100000738506_100000210414 [0,1,0,0,0,1|1,0,0]=3 2264 B16R1.4414 CCC(=O)Nc1ccccc1CC(=O)NC 22a_100000738506_100000210414 [0,1,0,0,0,1|1,0,0]=3 2265 B16R1.4414 CCC(=O)Nc1ccccc1CC(=O)NC 527a_100000738506_100000210414 [0,1,0,0,0,1|1,0,0]=3 2266 B16R1.4414 CCC(=O)Nc1ccccc1CC(=O)OC 188690a_100000766173_100000210414 [0,1,0,0,0,1|0,0,0]=2 2267 B16R1.4414 CCC(=O)Nc1ccccc1SC(C)OC 62a_100009879195_100000153536 [0,1,0,0,0,1|1,0,1]=4 2268 B16R1.4414 CNC(=O)Cc1ccccc1NC(=O)CO 22a_100000738506_100000210174 [0,1,0,0,0,1|1,0,0]=3 2269 B16R1.4414 CNC(=O)Cc1ccccc1NC(=O)CO 527a_100000738506_100000210174 [0,1,0,0,0,1|1,0,0]=3 2270 B16R1.4414 CNC(=O)Cc1ccccc1NC(=O)NC 2430a_100000738506_100102657272 [0,1,0,0,0,1|1,0,0]=3 2271 B16R1.4414 COC(=O)Cc1ccccc1CC(=O)CO 1458a_100000210174_100000094086 [0,1,0,0,0,1|1,0,0]=3 2272 B16R1.4414 COC(=O)Cc1ccccc1NC(=O)CO 188690a_100000766173_100000210174 [0,1,0,0,0,1|0,0,0]=2 2273 B16R1.4414 COC(=O)Nc1ccccc1SC(C)OC 62a_100009879195_100000216184 [0,1,0,0,0,1|1,0,1]=4 2274 B16R1.4414 COC(C)Sc1ccccc1NC(=O)CN 62a_100009879195_100000683505 [0,1,0,0,0,1|1,0,1]=4 2275 B16R1.10309 CCS(=O)(=O)Nc1ccccc1NC(=O)C 232682a_100011193560_100000211323 [0,1,0,0,0,1|2,0,0]=4 2276 B16R1.12518 C=C(Br)C(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100009813364 [0,1,0,0,0,1|1,0,1]=4 2277 B16R1.12518 C=C(Br)C(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100009813364 [0,1,0,0,0,1|1,0,1]=4 2278 B16R1.12518 C=C(C)C(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100000185857 [0,1,0,0,0,1|1,0,0]=3 2279 B16R1.12518 C=C(C)C(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100000185857 [0,1,0,0,0,1|1,0,0]=3 2280 B16R1.12518 C=C(C)C(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000185857 [0,1,0,0,0,1|1,0,0]=3 2281 B16R1.12518 C=C(Cl)C(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100000039160 [0,1,0,0,0,1|1,0,1]=4 2282 B16R1.12518 C=C(Cl)C(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100000039160 [0,1,0,0,0,1|1,0,1]=4 2283 B16R1.12518 C=C(Cl)C(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000039160 [0,1,0,0,0,1|1,0,1]=4 2284 B16R1.12518 C=C(F)C(=O)Nc1ccccc1NC(=O)C 11a_100011193560_100000036797 [0,1,0,0,0,1|1,0,1]=4 2285 B16R1.12518 C=C(F)C(=O)Nc1ccccc1NC(=O)C 1626a_100011193560_100000036797 [0,1,0,0,0,1|1,0,1]=4 2286 B16R1.12518 C=C(F)C(=O)Nc1ccccc1NC(=O)C 22a_100011193560_100000036797 [0,1,0,0,0,1|1,0,1]=4 2287 B16R1.12518 CC(=O)Nc1ccccc1CC(=O)N(C)C 11a_100000743740_100015343762 [0,1,0,0,0,1|1,0,0]=3 2288 B16R1.12518 CC(=O)Nc1ccccc1CC(=O)N(C)C 1626a_100000743740_100015343762 [0,1,0,0,0,1|1,0,0]=3 2289 B16R1.12518 CC(=O)Nc1ccccc1CC(=O)N(C)C 22a_100000743740_100000070787 [0,1,0,0,0,1|1,0,0]=3 2290 B16R1.12518 CC(=O)Nc1ccccc1CC(=O)N(C)C 527a_100000743740_100103153847 [0,1,0,0,0,1|1,0,0]=3 2291 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(=O)N 22a_100011193560_100011215815 [0,1,0,0,0,1|2,0,0]=4 2292 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(C)C 11a_100011193560_100000210198 [0,1,0,0,0,1|1,0,0]=3 2293 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(C)C 11a_200011193546_100015343762 [0,1,0,0,0,1|1,0,0]=3 2294 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(C)C 1626a_100011193560_100000210198 [0,1,0,0,0,1|1,0,0]=3 2295 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(C)C 1626a_200011193546_100015343762 [0,1,0,0,0,1|1,0,0]=3 2296 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(C)C 22a_100011193560_100000210198 [0,1,0,0,0,1|1,0,0]=3 2297 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(C)C 22a_200011193546_100000070787 [0,1,0,0,0,1|1,0,0]=3 2298 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(C)F 11a_100011193560_100000062450 [0,1,0,0,0,1|1,0,0]=3 2299 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(C)F 1626a_100011193560_100000062450 [0,1,0,0,0,1|1,0,0]=3 2300 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(C)F 22a_100011193560_100000062450 [0,1,0,0,0,1|1,0,0]=3 2301 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(F)F 11a_100011193560_100000210393 [0,1,0,0,0,1|2,0,0]=4 2302 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(F)F 1626a_100011193560_100000210393 [0,1,0,0,0,1|2,0,0]=4 2303 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(F)F 22a_100011193560_100000210393 [0,1,0,0,0,1|2,0,0]=4 2304 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)C(O)O 22a_100011193560_100000233687 [0,1,0,0,0,1|2,0,0]=4 2305 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)N(C)C 2430a_100011193560_100102631434 [0,1,0,0,0,1|1,0,0]=3 2306 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)[C@@H](C)O 22a_100011193560_100000717761 [0,1,0,0,0,1|1,0,0]=3 2307 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)[C@H](C)O 1626a_100011193560_217856618621 [0,1,0,0,0,1|1,0,0]=3 2308 B16R1.12518 CC(=O)Nc1ccccc1NC(=O)[C@H](C)O 22a_100011193560_217856618621 [0,1,0,0,0,1|1,0,0]=3 2309 B16R1.12518 CC(=O)Nc1ccccc1SC(=O)N(C)C 11a_100000750950_100015343762 [0,1,0,0,0,1|1,0,0]=3 2310 B16R1.12518 CC(=O)Nc1ccccc1SC(=O)N(C)C 22a_100000750950_100000070787 [0,1,0,0,0,1|1,0,0]=3 2311 B16R1.17376 CCC(=O)Cc1ccccc1NS(=O)(=O)C 1458a_100000754572_100000210202 [0,1,0,0,0,1|2,0,0]=4 2312 B16R1.17376 CCC(=O)Nc1ccccc1NS(=O)(=O)C 11a_100011193664_100000210414 [0,1,0,0,0,1|2,0,0]=4 2313 B16R1.17376 CCC(=O)Nc1ccccc1NS(=O)(=O)C 22a_100011193664_100000210414 [0,1,0,0,0,1|2,0,0]=4 2314 B16R1.17376 CNC(=O)Cc1ccccc1NS(=O)(=O)C 11a_106832991635_100000754572 [0,1,0,0,0,1|2,0,0]=4 2315 B16R1.17376 CNC(=O)Cc1ccccc1NS(=O)(=O)C 240690a_100102657272_100000754572 [0,1,0,0,0,1|2,0,0]=4 2316 B16R1.17376 CNC(=O)Cc1ccccc1NS(=O)(=O)C 40a_100000738506_100000738038 [0,1,0,0,0,1|2,0,0]=4 2317 B16R1.17376 CNC(=O)Cc1ccccc1NS(=O)(=O)C 527a_100102657272_100000754572 [0,1,0,0,0,1|2,0,0]=4 2318 B16R1.17376 CNC(=O)Nc1ccccc1NS(=O)(=O)C 2430a_100011193664_100102657272 [0,1,0,0,0,1|2,0,0]=4 2319 B16R1.17376 CNC(=O)Nc1ccccc1NS(=O)(=O)C 512a_100011193664_100102657272 [0,1,0,0,0,1|2,0,0]=4 2320 B16R1.25318 C=CC(=O)Nc1ccc(cc1NC(=O)C)Cl 1626a_100000749253_100000185746 [0,1,0,0,0,1|1,0,1]=4 2321 B16R1.25318 C=CC(=O)Nc1ccc(cc1NC(=O)C)Cl 22a_100000749253_100000185746 [0,1,0,0,0,1|1,0,1]=4 2322 B16R1.25318 CC(=O)Nc1cc(ccc1NC(=O)CO)Cl 22a_100000749253_100000210174 [0,1,0,0,0,1|2,0,0]=4 2323 B16R1.25318 CCC(=O)Nc1ccc(cc1NC(=O)C)C 11a_200011203071_100015343762 [0,1,0,0,0,1|1,0,0]=3 2324 B16R1.25318 CCC(=O)Nc1ccc(cc1NC(=O)C)C 1626a_200011203071_100015343762 [0,1,0,0,0,1|1,0,0]=3 2325 B16R1.25318 CCC(=O)Nc1ccc(cc1NC(=O)C)C 22a_200011203071_100000070787 [0,1,0,0,0,1|1,0,0]=3 2326 B16R1.25318 CCC(=O)Nc1ccc(cc1NC(=O)C)Cl 11a_100000749253_100000210414 [0,1,0,0,0,1|1,0,0]=3 2327 B16R1.25318 CCC(=O)Nc1ccc(cc1NC(=O)C)Cl 1626a_100000749253_100000210414 [0,1,0,0,0,1|1,0,0]=3 2328 B16R1.25318 CCC(=O)Nc1ccc(cc1NC(=O)C)Cl 22a_100000749253_100000210414 [0,1,0,0,0,1|1,0,0]=3 2329 B16R1.25318 COC(=O)Cc1ccc(cc1C=C(C)C)F 271570a_100102525489_200012569216 [0,1,0,0,0,1|2,0,0]=4 2330 B16R1.25318 COC(=O)Nc1ccc(cc1C=C(C)C)C 271570a_100102525489_100000750523 [0,1,0,0,0,1|2,0,0]=4 2331 B16R1.25318 COC(C)Sc1ccc(cc1NC(=O)C)C 62a_100009879195_100000182586 [0,1,0,0,0,1|1,0,1]=4 2332 B16R1.25318 COC(C)Sc1ccc(cc1NC(=O)C)F 62a_100009879195_100012558231 [0,1,0,0,0,1|1,0,1]=4 2333 B16R1.74491 COC(=O)Cc1c(cccc1C=C(C)C)F 271570a_100102525489_100010741561 [0,1,0,0,0,1|2,0,0]=4 2334 B16R1.78048 COC(=O)Cc1cccc(c1C=C(C)C)C 271570a_100102525489_200010150888 [0,1,0,0,0,1|2,0,0]=4 2335 B16R1.3992 CCCS(=O)(=O)c1ccccc1NC(=O)C 11a_200103154875_100015343762 [0,2,0,0,0,0|2,0,0]=4 2336 B16R1.3992 CCCS(=O)(=O)c1ccccc1NC(=O)C 1626a_200103154875_100015343762 [0,2,0,0,0,0|2,0,0]=4 2337 B16R1.3992 CCNS(=O)(=O)c1ccccc1NC(=O)C 1626a_100000736761_100015343762 [0,2,0,0,0,0|2,0,0]=4 2338 B16R1.18182 CC(=O)Nc1ccccc1S(=O)(=O)C(C)C 11a_100000750238_100015343762 [0,2,0,0,0,0|2,0,0]=4 2339 B16R1.18182 CC(=O)Nc1ccccc1S(=O)(=O)C(C)C 1626a_100000750238_100015343762 [0,2,0,0,0,0|2,0,0]=4 2340 B16R1.18182 CC(=O)Nc1ccccc1S(=O)(=O)N(C)C 11a_100000725497_100015343762 [0,2,0,0,0,0|2,0,0]=4 2341 B16R1.18182 CC(=O)Nc1ccccc1S(=O)(=O)N(C)C 1626a_100000725497_100015343762 [0,2,0,0,0,0|2,0,0]=4 2342 B16R1.78088 CCC(=O)Nc1ccccc1S(=O)(=O)CC 11a_100000738084_100000210414 [0,2,0,0,0,0|2,0,0]=4 2343 B16R1.78088 CCC(=O)Nc1ccccc1S(=O)(=O)CC 1626a_100000738084_100000210414 [0,2,0,0,0,0|2,0,0]=4 2344 B16R1.78088 CCS(=O)(=O)c1ccccc1NC(=O)NC 2430a_100000738084_100102657272 [0,2,0,0,0,0|2,0,0]=4 2345 B16R1.78088 CCS(=O)(=O)c1ccccc1NC(=O)NC 512a_100000738084_100102657272 [0,2,0,0,0,0|2,0,0]=4 2346 B16R1.78088 CNC(=O)Nc1ccccc1S(=O)(=O)NC 512a_100000736802_100102657272 [0,2,0,0,0,0|2,0,0]=4 2347 B16R1.884 C#CCC(=O)c1cc(ccc1NC(=O)C)Br 1458a_100000195241_100000184674 [0,2,0,0,0,0|1,0,1]=4 2348 B16R1.884 C#CCC(=O)c1cc(ccc1NC(=O)C)F 1458a_100011219192_100000184674 [0,2,0,0,0,0|1,0,1]=4 2349 B16R1.884 C=CCC(=O)c1cc(ccc1NC(=O)C)Br 1458a_100000195241_100000210623 [0,2,0,0,0,0|1,0,1]=4 2350 B16R1.884 C=CCC(=O)c1cc(ccc1NC(=O)C)F 1458a_100011219192_100000210623 [0,2,0,0,0,0|1,0,1]=4 2351 B16R1.884 CC(=O)Nc1ccc(cc1C(=O)CC#N)Br 1458a_100000195241_100011214920 [0,2,0,0,0,0|1,0,1]=4 2352 B16R1.884 CC(=O)Nc1ccc(cc1C(=O)CC#N)F 1458a_100011219192_100011214920 [0,2,0,0,0,0|1,0,1]=4 2353 B16R1.884 CC(=O)Nc1ccc(cc1C(=O)CCF)Br 1458a_100000195241_100011217306 [0,2,0,0,0,0|1,0,0]=3 2354 B16R1.884 CC(=O)Nc1ccc(cc1C(=O)CCF)F 1458a_100011219192_100011217306 [0,2,0,0,0,0|1,0,0]=3 2355 B16R1.884 CC(=O)Nc1ccc(cc1C(=O)CCO)Br 1458a_100000195241_100000211926 [0,2,0,0,0,0|1,0,0]=3 2356 B16R1.884 CC(=O)Nc1ccc(cc1C(=O)CCO)F 1458a_100011219192_100000211926 [0,2,0,0,0,0|1,0,0]=3 2357 B16R1.884 CCCC(=O)c1cc(ccc1NC(=O)C)Br 1458a_100000195241_100000210303 [0,2,0,0,0,0|1,0,0]=3 2358 B16R1.884 CCCC(=O)c1cc(ccc1NC(=O)C)F 1458a_100011219192_100000210303 [0,2,0,0,0,0|1,0,0]=3 2359 B16R1.884 CCNC(=O)c1cc(ccc1NC(=O)C)Br 240690a_100015525214_100000195241 [0,2,0,0,0,0|1,0,0]=3 2360 B16R1.884 CCNC(=O)c1cc(ccc1NC(=O)C)F 240690a_100015525214_100011219192 [0,2,0,0,0,0|1,0,0]=3 2361 B16R1.884 CCNC(=O)c1cc(ccc1OC(=O)C)Br 240690a_100015525214_200009996594 [0,2,0,0,0,0|2,0,0]=4 2362 B16R1.884 CCNC(=O)c1cc(ccc1OC(=O)C)C 240690a_100015525214_100000047319 [0,2,0,0,0,0|2,0,0]=4 2363 B16R1.884 CCNC(=O)c1cc(ccc1OC(=O)C)Cl 240690a_100015525214_100000058116 [0,2,0,0,0,0|2,0,0]=4 2364 B16R1.884 CCOC(=O)c1cc(ccc1C=C(C)C)Br 271570a_100102525489_100000171027 [0,2,0,0,0,0|2,0,0]=4 2365 B16R1.884 CCOC(=O)c1cc(ccc1C=C(C)C)C 271570a_100102525489_200012353901 [0,2,0,0,0,0|2,0,0]=4 2366 B16R1.884 CCOC(=O)c1cc(ccc1C=C(C)C)Cl 271570a_100102525489_100011294803 [0,2,0,0,0,0|2,0,0]=4 2367 B16R1.884 CCOC(=O)c1cc(ccc1C=C(C)C)F 271570a_100102525489_100011206316 [0,2,0,0,0,0|2,0,0]=4 2368 B16R1.884 CCOC(=O)c1cc(cnc1CC(=O)C)C 1458a_100000070787_200010135773 [0,2,0,0,0,0|2,0,0]=4 2369 B16R1.958 C#CCC(=O)c1ccccc1N(C)C(=O)C 1458a_100000242783_100000184674 [0,2,0,0,0,0|1,0,1]=4 2370 B16R1.958 C=CCC(=O)c1ccccc1N(C)C(=O)C 1458a_100000242783_100000210623 [0,2,0,0,0,0|1,0,1]=4 2371 B16R1.958 CC(=O)N(C)c1ccccc1C(=O)CC#N 1458a_100000242783_100011214920 [0,2,0,0,0,0|1,0,1]=4 2372 B16R1.958 CC(=O)N(C)c1ccccc1C(=O)CCF 1458a_100000242783_100011217306 [0,2,0,0,0,0|1,0,0]=3 2373 B16R1.958 CC(=O)N(C)c1ccccc1C(=O)CCO 1458a_100000242783_100000211926 [0,2,0,0,0,0|1,0,0]=3 2374 B16R1.958 CCCC(=O)c1ccccc1N(C)C(=O)C 1458a_100000242783_100000210303 [0,2,0,0,0,0|1,0,0]=3 2375 B16R1.958 CCNC(=O)c1ccccc1N(C)C(=O)C 240690a_100015525214_100000242783 [0,2,0,0,0,0|1,0,0]=3 2376 B16R1.958 CCOC(=O)c1ccccc1C(=C(C)C)C 271570a_200000049429_100000169879 [0,2,0,0,0,0|2,0,0]=4 2377 B16R1.958 CCOC(=O)c1ccccc1N(C)C(=O)C 11a_100160572725_100015343762 [0,2,0,0,0,0|0,0,0]=2 2378 B16R1.958 CCOC(=O)c1ccccc1N(C)C(=O)C 1626a_100160572725_100015343762 [0,2,0,0,0,0|0,0,0]=2 2379 B16R1.958 CCOC(=O)c1ccccc1N(C)C(C)C 2230a_100160572725_100000210206 [0,2,0,0,0,0|1,0,1]=4 2380 B16R1.958 CCOC(=O)c1ccccc1N(C)C(C)C 269982a_100160572725_100000210206 [0,2,0,0,0,0|1,0,1]=4 2381 B16R1.960 C#CC(=O)Cc1ccccc1C(=O)OCC 1458a_100000211873_100009816840 [0,2,0,0,0,0|1,0,1]=4 2382 B16R1.960 C#CC(C)Nc1ccccc1C(=O)NOC 34a_100011599994_200000035995 [0,2,0,0,0,0|1,0,1]=4 2383 B16R1.960 C#CCC(=O)c1ccccc1NC(=O)CC 1458a_100000194446_100000184674 [0,2,0,0,0,0|1,0,1]=4 2384 B16R1.960 C=CC(=O)Cc1ccccc1C(=O)OCC 1458a_100000185746_100009816840 [0,2,0,0,0,0|1,0,1]=4 2385 B16R1.960 C=CC(=O)Nc1ccccc1C(=O)NCC 1626a_100000205978_100000185746 [0,2,0,0,0,0|1,0,1]=4 2386 B16R1.960 C=CC(=O)Nc1ccccc1C(=O)NCC 22a_100000205978_100000185746 [0,2,0,0,0,0|1,0,1]=4 2387 B16R1.960 C=CC(=O)Nc1ccccc1C(=O)NOC 1626a_100011599994_100000185746 [0,2,0,0,0,0|0,0,1]=3 2388 B16R1.960 C=CC(=O)Nc1ccccc1C(=O)NOC 22a_100011599994_100000185746 [0,2,0,0,0,0|0,0,1]=3 2389 B16R1.960 C=CCC(=O)c1ccccc1NC(=O)CC 1458a_100000194446_100000210623 [0,2,0,0,0,0|1,0,1]=4 2390 B16R1.960 CCC(=O)Nc1ccccc1C(=O)CC#N 1458a_100000194446_100011214920 [0,2,0,0,0,0|1,0,1]=4 2391 B16R1.960 CCC(=O)Nc1ccccc1C(=O)CCF 1458a_100000194446_100011217306 [0,2,0,0,0,0|1,0,0]=3 2392 B16R1.960 CCC(=O)Nc1ccccc1C(=O)CCO 1458a_100000194446_100000211926 [0,2,0,0,0,0|1,0,0]=3 2393 B16R1.960 CCC(=O)Nc1ccccc1C(=O)NOC 11a_100011599994_100000210414 [0,2,0,0,0,0|0,0,0]=2 2394 B16R1.960 CCC(=O)Nc1ccccc1C(=O)NOC 1626a_100011599994_100000210414 [0,2,0,0,0,0|0,0,0]=2 2395 B16R1.960 CCC(=O)Nc1ccccc1C(=O)NOC 22a_100011599994_100000210414 [0,2,0,0,0,0|0,0,0]=2 2396 B16R1.960 CCC(C)Nc1ccccc1C(=O)NOC 34a_100011599994_100011215416 [0,2,0,0,0,0|1,0,1]=4 2397 B16R1.960 CCCC(=O)c1ccccc1CC(=O)OC 1458a_100000726341_100000210303 [0,2,0,0,0,0|2,0,0]=4 2398 B16R1.960 CCCC(=O)c1ccccc1NC(=O)CC 1458a_100000194446_100000210303 [0,2,0,0,0,0|1,0,0]=3 2399 B16R1.960 CCNC(=O)c1ccccc1CC(=O)OC 240690a_100015525214_100000726341 [0,2,0,0,0,0|2,0,0]=4 2400 B16R1.960 CCNC(=O)c1ccccc1NC(=O)CC 11a_100000205978_100000210414 [0,2,0,0,0,0|1,0,0]=3 2401 B16R1.960 CCNC(=O)c1ccccc1NC(=O)CC 1626a_100000205978_100000210414 [0,2,0,0,0,0|1,0,0]=3 2402 B16R1.960 CCNC(=O)c1ccccc1NC(=O)CC 22a_100000205978_100000210414 [0,2,0,0,0,0|1,0,0]=3 2403 B16R1.960 CCNC(=O)c1ccccc1NC(=O)CC 240690a_100015525214_100000194446 [0,2,0,0,0,0|1,0,0]=3 2404 B16R1.960 CCNC(=O)c1ccccc1NC(=O)CC 527a_100015525214_100000194446 [0,2,0,0,0,0|1,0,0]=3 2405 B16R1.960 CCNC(=O)c1ccccc1NC(=O)CO 22a_100000205978_100000210174 [0,2,0,0,0,0|1,0,0]=3 2406 B16R1.960 CCNC(=O)c1ccccc1NC(=O)NC 2430a_100000205978_100102657272 [0,2,0,0,0,0|1,0,0]=3 2407 B16R1.960 CCOC(=O)c1ccccc1CC(=O)CC 1458a_100000210414_100009816840 [0,2,0,0,0,0|1,0,0]=3 2408 B16R1.960 CCOC(=O)c1ccccc1CC(=O)CO 1458a_100000210174_100009816840 [0,2,0,0,0,0|1,0,0]=3 2409 B16R1.960 CNC(=O)Nc1ccccc1C(=O)NOC 2430a_100011599994_100102657272 [0,2,0,0,0,0|0,0,0]=2 2410 B16R1.960 CNNC(=O)c1ccccc1CC(=O)OC 22a_100016993582_100000726341 [0,2,0,0,0,0|2,0,0]=4 2411 B16R1.960 COC(=O)Cc1ccccc1C(=O)CCF 1458a_100000726341_100011217306 [0,2,0,0,0,0|2,0,0]=4 2412 B16R1.960 COC(=O)Cc1ccccc1C(=O)CCO 1458a_100000726341_100000211926 [0,2,0,0,0,0|2,0,0]=4 2413 B16R1.960 CONC(=O)c1ccccc1NC(=O)CO 22a_100011599994_100000210174 [0,2,0,0,0,0|0,0,0]=2 2414 B16R1.960 CONC(=O)c1ccccc1NC(C)CO 34a_100011599994_100012180447 [0,2,0,0,0,0|0,0,2]=4 2415 B16R1.1498 C#CCNC(=O)c1ccccc1NC(=O)C 11a_100000204693_100015343762 [0,2,0,0,0,0|1,0,0]=3 2416 B16R1.1498 C#CCNC(=O)c1ccccc1NC(=O)C 1626a_100000204693_100015343762 [0,2,0,0,0,0|1,0,0]=3 2417 B16R1.1498 C#CCNC(=O)c1ccccc1NC(=O)C 22a_100000204693_100000070787 [0,2,0,0,0,0|1,0,0]=3 2418 B16R1.1498 C#CCNC(=O)c1ccccc1OC(=O)C 240690a_100000212058_100000210466 [0,2,0,0,0,0|2,0,0]=4 2419 B16R1.1498 C=CCNC(=O)c1ccccc1NC(=O)C 11a_100000182330_100015343762 [0,2,0,0,0,0|1,0,0]=3 2420 B16R1.1498 C=CCNC(=O)c1ccccc1NC(=O)C 1626a_100000182330_100015343762 [0,2,0,0,0,0|1,0,0]=3 2421 B16R1.1498 C=CCNC(=O)c1ccccc1NC(=O)C 22a_100000182330_100000070787 [0,2,0,0,0,0|1,0,0]=3 2422 B16R1.1498 C=CCNC(=O)c1ccccc1OC(=O)C 240690a_100020586998_100000210466 [0,2,0,0,0,0|2,0,0]=4 2423 B16R1.1498 CC(=O)Oc1ccccc1C(=O)NCCF 240690a_100000724931_100000210466 [0,2,0,0,0,0|2,0,0]=4 2424 B16R1.1498 CC(=O)Oc1ccccc1C(=O)NCCO 240690a_100000210304_100000210466 [0,2,0,0,0,0|2,0,0]=4 2425 B16R1.1498 CCCNC(=O)c1ccccc1NC(=O)C 11a_100000181257_100015343762 [0,2,0,0,0,0|1,0,0]=3 2426 B16R1.1498 CCCNC(=O)c1ccccc1NC(=O)C 1626a_100000181257_100015343762 [0,2,0,0,0,0|1,0,0]=3 2427 B16R1.1498 CCCNC(=O)c1ccccc1NC(=O)C 22a_100000181257_100000070787 [0,2,0,0,0,0|1,0,0]=3 2428 B16R1.1498 CCCNC(=O)c1ccccc1OC(=O)C 240690a_100020643023_100000210466 [0,2,0,0,0,0|2,0,0]=4 2429 B16R1.1498 CCNN=C(C)c1ccccc1NC(=O)C 4a_100000756455_100000153761 [0,2,0,0,0,0|2,0,0]=4 2430 B16R1.12517 CC(=Cc1ccccc1C(=O)OC(C)C)C 271570a_100102525489_100000169877 [0,2,0,0,0,0|2,0,0]=4 2431 B16R1.12517 CC(=O)Nc1ccccc1C(=O)NC(C)C 11a_100000180276_100015343762 [0,2,0,0,0,0|1,0,0]=3 2432 B16R1.12517 CC(=O)Nc1ccccc1C(=O)NC(C)C 1626a_100000180276_100015343762 [0,2,0,0,0,0|1,0,0]=3 2433 B16R1.12517 CC(=O)Nc1ccccc1C(=O)NC(C)C 22a_100000180276_100000070787 [0,2,0,0,0,0|1,0,0]=3 2434 B16R1.12517 CC(=O)Oc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000210466 [0,2,0,0,0,0|2,0,0]=4 2435 B16R1.14963 CCCC(=O)c1ccccc1NS(=O)(=O)C 1458a_100000169588_100000210303 [0,2,0,0,0,0|2,0,0]=4 2436 B16R1.14963 CCNC(=O)c1ccccc1NS(=O)(=O)C 240690a_100015525214_100000169588 [0,2,0,0,0,0|2,0,0]=4 2437 B16R1.14963 CCNC(=O)c1ccccc1NS(=O)(=O)C 527a_100015525214_100000169588 [0,2,0,0,0,0|2,0,0]=4 2438 B16R1.14963 CNNC(=O)c1ccccc1NS(=O)(=O)C 22a_100016993582_100000169588 [0,2,0,0,0,0|2,0,0]=4 2439 B16R1.14963 CONC(=O)c1ccccc1NC(C)(C)C 34a_100011599994_100000210625 [0,2,0,0,0,0|1,0,1]=4 2440 B16R1.14963 CS(=O)(=O)Nc1ccccc1C(=O)CCF 1458a_100000169588_100011217306 [0,2,0,0,0,0|2,0,0]=4 2441 B16R1.14963 CS(=O)(=O)Nc1ccccc1C(=O)CCO 1458a_100000169588_100000211926 [0,2,0,0,0,0|2,0,0]=4 2442 B16R1.15367 C#CCC(=O)c1ccc(cc1NC(=O)C)Br 1458a_100000747254_100000184674 [0,2,0,0,0,0|1,0,1]=4 2443 B16R1.15367 C#CCC(=O)c1ccc(cc1NC(=O)C)Cl 1458a_100000195377_100000184674 [0,2,0,0,0,0|1,0,1]=4 2444 B16R1.15367 C#CCC(=O)c1ccc(cc1NC(=O)C)F 1458a_100000222213_100000184674 [0,2,0,0,0,0|1,0,1]=4 2445 B16R1.15367 C=CCC(=O)c1ccc(cc1NC(=O)C)Br 1458a_100000747254_100000210623 [0,2,0,0,0,0|1,0,1]=4 2446 B16R1.15367 C=CCC(=O)c1ccc(cc1NC(=O)C)Cl 1458a_100000195377_100000210623 [0,2,0,0,0,0|1,0,1]=4 2447 B16R1.15367 C=CCC(=O)c1ccc(cc1NC(=O)C)F 1458a_100000222213_100000210623 [0,2,0,0,0,0|1,0,1]=4 2448 B16R1.15367 CC(=O)Nc1cc(ccc1C(=O)CC#N)Br 1458a_100000747254_100011214920 [0,2,0,0,0,0|1,0,1]=4 2449 B16R1.15367 CC(=O)Nc1cc(ccc1C(=O)CC#N)Cl 1458a_100000195377_100011214920 [0,2,0,0,0,0|1,0,1]=4 2450 B16R1.15367 CC(=O)Nc1cc(ccc1C(=O)CC#N)F 1458a_100000222213_100011214920 [0,2,0,0,0,0|1,0,1]=4 2451 B16R1.15367 CC(=O)Nc1cc(ccc1C(=O)CCF)Br 1458a_100000747254_100011217306 [0,2,0,0,0,0|1,0,0]=3 2452 B16R1.15367 CC(=O)Nc1cc(ccc1C(=O)CCF)Cl 1458a_100000195377_100011217306 [0,2,0,0,0,0|1,0,0]=3 2453 B16R1.15367 CC(=O)Nc1cc(ccc1C(=O)CCF)F 1458a_100000222213_100011217306 [0,2,0,0,0,0|1,0,0]=3 2454 B16R1.15367 CC(=O)Nc1cc(ccc1C(=O)CCO)Br 1458a_100000747254_100000211926 [0,2,0,0,0,0|1,0,0]=3 2455 B16R1.15367 CC(=O)Nc1cc(ccc1C(=O)CCO)Cl 1458a_100000195377_100000211926 [0,2,0,0,0,0|1,0,0]=3 2456 B16R1.15367 CC(=O)Nc1cc(ccc1C(=O)CCO)F 1458a_100000222213_100000211926 [0,2,0,0,0,0|1,0,0]=3 2457 B16R1.15367 CCCC(=O)c1ccc(cc1NC(=O)C)Br 1458a_100000747254_100000210303 [0,2,0,0,0,0|1,0,0]=3 2458 B16R1.15367 CCCC(=O)c1ccc(cc1NC(=O)C)Cl 1458a_100000195377_100000210303 [0,2,0,0,0,0|1,0,0]=3 2459 B16R1.15367 CCCC(=O)c1ccc(cc1NC(=O)C)F 1458a_100000222213_100000210303 [0,2,0,0,0,0|1,0,0]=3 2460 B16R1.15367 CCNC(=O)c1ccc(cc1NC(=O)C)Br 240690a_100015525214_100000747254 [0,2,0,0,0,0|1,0,0]=3 2461 B16R1.15367 CCNC(=O)c1ccc(cc1NC(=O)C)Cl 240690a_100015525214_100000195377 [0,2,0,0,0,0|1,0,0]=3 2462 B16R1.15367 CCNC(=O)c1ccc(cc1NC(=O)C)F 240690a_100015525214_100000222213 [0,2,0,0,0,0|1,0,0]=3 2463 B16R1.15367 CCOC(=O)c1ccc(cc1C=C(C)C)C 271570a_100102525489_200012185120 [0,2,0,0,0,0|2,0,0]=4 2464 B16R1.15367 CCOC(=O)c1ccc(cc1C=C(C)C)Cl 271570a_100102525489_100000047509 [0,2,0,0,0,0|2,0,0]=4 2465 B16R1.15367 CCOC(=O)c1ccc(cc1C=C(C)C)F 271570a_100102525489_100011206307 [0,2,0,0,0,0|2,0,0]=4 2466 B16R1.15367 CCOC(=O)c1ccc(cc1NC(C)C)F 27a_100138425928_100011206307 [0,2,0,0,0,0|1,0,1]=4 2467 B16R1.15367 CNNC(=O)c1ccc(cc1NC(=O)C)Br 22a_100016993582_100000747254 [0,2,0,0,0,0|1,0,0]=3 2468 B16R1.15367 CNNC(=O)c1ccc(cc1NC(=O)C)Cl 22a_100016993582_100000195377 [0,2,0,0,0,0|1,0,0]=3 2469 B16R1.15367 CNNC(=O)c1ccc(cc1NC(=O)C)F 22a_100016993582_100000222213 [0,2,0,0,0,0|1,0,0]=3 2470 B16R1.15455 C#CCC(=O)c1c(cccc1NC(=O)C)Cl 1458a_200011219801_100000184674 [0,2,0,0,0,0|1,0,1]=4 2471 B16R1.15455 C#CCC(=O)c1c(cccc1NC(=O)C)F 1458a_100000756107_100000184674 [0,2,0,0,0,0|1,0,1]=4 2472 B16R1.15455 C=CCC(=O)c1c(cccc1NC(=O)C)Cl 1458a_200011219801_100000210623 [0,2,0,0,0,0|1,0,1]=4 2473 B16R1.15455 C=CCC(=O)c1c(cccc1NC(=O)C)F 1458a_100000756107_100000210623 [0,2,0,0,0,0|1,0,1]=4 2474 B16R1.15455 CC(=O)Nc1cccc(c1C(=O)CC#N)Cl 1458a_200011219801_100011214920 [0,2,0,0,0,0|1,0,1]=4 2475 B16R1.15455 CC(=O)Nc1cccc(c1C(=O)CC#N)F 1458a_100000756107_100011214920 [0,2,0,0,0,0|1,0,1]=4 2476 B16R1.15455 CC(=O)Nc1cccc(c1C(=O)CCF)Cl 1458a_200011219801_100011217306 [0,2,0,0,0,0|1,0,0]=3 2477 B16R1.15455 CC(=O)Nc1cccc(c1C(=O)CCF)F 1458a_100000756107_100011217306 [0,2,0,0,0,0|1,0,0]=3 2478 B16R1.15455 CC(=O)Nc1cccc(c1C(=O)CCO)Cl 1458a_200011219801_100000211926 [0,2,0,0,0,0|1,0,0]=3 2479 B16R1.15455 CC(=O)Nc1cccc(c1C(=O)CCO)F 1458a_100000756107_100000211926 [0,2,0,0,0,0|1,0,0]=3 2480 B16R1.15455 CCCC(=O)c1c(cccc1NC(=O)C)Cl 1458a_200011219801_100000210303 [0,2,0,0,0,0|1,0,0]=3 2481 B16R1.15455 CCCC(=O)c1c(cccc1NC(=O)C)F 1458a_100000756107_100000210303 [0,2,0,0,0,0|1,0,0]=3 2482 B16R1.15455 CCNC(=O)c1c(cccc1NC(=O)C)Cl 240690a_100015525214_200011219801 [0,2,0,0,0,0|1,0,0]=3 2483 B16R1.15455 CCNC(=O)c1c(cccc1NC(=O)C)F 240690a_100015525214_100000756107 [0,2,0,0,0,0|1,0,0]=3 2484 B16R1.15455 CCOC(=O)c1c(cccc1C=C(C)C)F 271570a_100102525489_100012357633 [0,2,0,0,0,0|2,0,0]=4 2485 B16R1.15455 CCOC(=O)c1c(cccc1NC(=O)C)Cl 188690a_100011899081_100015343762 [0,2,0,0,0,0|0,0,0]=2 2486 B16R1.15455 CCOC(=O)c1c(cccc1NC(C)C)F 27a_100138425928_100012357633 [0,2,0,0,0,0|1,0,1]=4 2487 B16R1.69043 CCOC(=O)c1cccc(c1C=C(C)C)C 271570a_100102525489_200012184857 [0,2,0,0,0,0|2,0,0]=4 2488 B16R1.69043 CCOC(=O)c1cccc(c1C=C(C)C)F 271570a_100102525489_100012357632 [0,2,0,0,0,0|2,0,0]=4 2489 B16R1.11400 CC(=O)Nc1ccc(cc1C(=C(C)C)C)Br 271570a_200000049429_100009813020 [0,2,0,0,0,0|2,0,0]=4 2490 B16R1.11400 CC(=O)Nc1ccc(cc1C(=C(C)C)C)C 271570a_200000049429_100000152032 [0,2,0,0,0,0|2,0,0]=4 2491 B16R1.11400 CC(=O)Nc1ccc(cc1C(=C(C)C)C)F 271570a_200000049429_100011215554 [0,2,0,0,0,0|2,0,0]=4 2492 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)C(C)C)Br 1458a_100000195241_100000210206 [0,2,0,0,0,0|1,0,0]=3 2493 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)C(C)C)F 1458a_100011219192_100000210206 [0,2,0,0,0,0|1,0,0]=3 2494 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)N(C)C)Br 11a_100012355269_100015343762 [0,2,0,0,0,0|1,0,0]=3 2495 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)N(C)C)Br 1626a_100012355269_100015343762 [0,2,0,0,0,0|1,0,0]=3 2496 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)N(C)C)Br 240690a_100102631434_100000195241 [0,2,0,0,0,0|1,0,0]=3 2497 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)N(C)C)Cl 11a_100011200723_100015343762 [0,2,0,0,0,0|1,0,0]=3 2498 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)N(C)C)Cl 1626a_100011200723_100015343762 [0,2,0,0,0,0|1,0,0]=3 2499 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)N(C)C)F 11a_100000707272_100015343762 [0,2,0,0,0,0|1,0,0]=3 2500 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)N(C)C)F 1626a_100000707272_100015343762 [0,2,0,0,0,0|1,0,0]=3 2501 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)N(C)C)F 22a_100000707272_100000070787 [0,2,0,0,0,0|1,0,0]=3 2502 B16R1.11400 CC(=O)Nc1ccc(cc1C(=O)N(C)C)F 240690a_100102631434_100011219192 [0,2,0,0,0,0|1,0,0]=3 2503 B16R1.11400 CC(=O)Oc1ccc(cc1C(=O)N(C)C)Br 240690a_100102631434_200009996594 [0,2,0,0,0,0|2,0,0]=4 2504 B16R1.11400 CC(=O)Oc1ccc(cc1C(=O)N(C)C)C 1626a_100102631434_100000047319 [0,2,0,0,0,0|2,0,0]=4 2505 B16R1.11400 CC(=O)Oc1ccc(cc1C(=O)N(C)C)C 240690a_100102631434_100000047319 [0,2,0,0,0,0|2,0,0]=4 2506 B16R1.11400 CC(=O)Oc1ccc(cc1C(=O)N(C)C)Cl 240690a_100102631434_100000058116 [0,2,0,0,0,0|2,0,0]=4 2507 B16R1.16764 CCC(=O)c1cc(ccc1NS(=O)(=O)C)C 1458a_100000738337_100000210202 [0,2,0,0,0,0|2,0,0]=4 2508 B16R1.16764 CCC(=O)c1cc(ccc1NS(=O)(=O)C)Cl 1458a_100000180059_100000210202 [0,2,0,0,0,0|2,0,0]=4 2509 B16R1.16764 CNC(=O)c1cc(ccc1NS(=O)(=O)C)C 240690a_100102657272_100000738337 [0,2,0,0,0,0|2,0,0]=4 2510 B16R1.16764 CNC(=O)c1cc(ccc1NS(=O)(=O)C)C 527a_100102657272_100000738337 [0,2,0,0,0,0|2,0,0]=4 2511 B16R1.16764 CNC(=O)c1cc(ccc1NS(=O)(=O)C)Cl 240690a_100102657272_100000180059 [0,2,0,0,0,0|2,0,0]=4 2512 B16R1.16764 CNC(=O)c1cc(ccc1NS(=O)(=O)C)Cl 527a_100102657272_100000180059 [0,2,0,0,0,0|2,0,0]=4 2513 B16R1.16776 COC(=O)c1cc(ccc1C(=C(C)C)C)Br 271570a_200000049429_100000148213 [0,2,0,0,0,0|2,0,0]=4 2514 B16R1.16776 COC(=O)c1cc(ccc1C(=C(C)C)C)C 271570a_200000049429_100012339458 [0,2,0,0,0,0|2,0,0]=4 2515 B16R1.16776 COC(=O)c1cc(ccc1C(=C(C)C)C)Cl 271570a_200000049429_100011294804 [0,2,0,0,0,0|2,0,0]=4 2516 B16R1.16776 COC(=O)c1cc(ccc1C(=C(C)C)C)F 271570a_200000049429_100000205820 [0,2,0,0,0,0|2,0,0]=4 2517 B16R1.16776 COC(=O)c1cc(ccc1C(=C(C)C)C)N 271570a_200000049429_100000696289 [0,2,0,0,0,0|2,0,0]=4 2518 B16R1.16776 COC(=O)c1cc(ccc1C(=C(C)C)C)O 271570a_200000049429_100010230369 [0,2,0,0,0,0|2,0,0]=4 2519 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(=O)C)Br 1626a_200000216482_100015343762 [0,2,0,0,0,0|0,0,0]=2 2520 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(=O)C)Cl 11a_100000216484_100015343762 [0,2,0,0,0,0|0,0,0]=2 2521 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(=O)C)Cl 1626a_100000216484_100015343762 [0,2,0,0,0,0|0,0,0]=2 2522 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(=O)C)F 11a_100011806480_100015343762 [0,2,0,0,0,0|0,0,0]=2 2523 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(=O)C)F 1626a_100011806480_100015343762 [0,2,0,0,0,0|0,0,0]=2 2524 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(C)C)Br 269982a_200000216482_100000210206 [0,2,0,0,0,0|1,0,1]=4 2525 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(C)C)Br 34a_200000216482_100000210206 [0,2,0,0,0,0|1,0,1]=4 2526 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(C)C)Br 7a_200000216482_100000210206 [0,2,0,0,0,0|1,0,1]=4 2527 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(C)C)Cl 269982a_100000216484_100000210206 [0,2,0,0,0,0|1,0,1]=4 2528 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(C)C)Cl 34a_100000216484_100000210206 [0,2,0,0,0,0|1,0,1]=4 2529 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(C)C)Cl 38a_100000216484_100000210206 [0,2,0,0,0,0|1,0,1]=4 2530 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(C)C)F 269982a_100011806480_100000210206 [0,2,0,0,0,0|1,0,1]=4 2531 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(C)C)F 34a_100011806480_100000210206 [0,2,0,0,0,0|1,0,1]=4 2532 B16R1.16776 COC(=O)c1cc(ccc1N(C)C(C)C)F 38a_100011806480_100000210206 [0,2,0,0,0,0|1,0,1]=4 2533 B16R1.20137 C=Cc1ccc(c(c1)C(=O)OC)NC(=O)C 271570a_100011290941_200009811626 [0,2,0,0,0,0|0,0,0]=2 2534 B16R1.20137 CNC(=O)c1cc(ccc1NC(=O)C)OC 11a_100000749796_100015343762 [0,2,0,0,0,0|1,0,0]=3 2535 B16R1.20137 CNC(=O)c1cc(ccc1NC(=O)C)OC 1626a_100000749796_100015343762 [0,2,0,0,0,0|1,0,0]=3 2536 B16R1.20137 CNC(=O)c1cc(ccc1NC(=O)C)OC 22a_100000749796_100000070787 [0,2,0,0,0,0|1,0,0]=3 2537 B16R1.20137 COC(=O)c1cc(ccc1C=C(C)C)C#N 271570a_100102525489_100009817095 [0,2,0,0,0,0|2,0,0]=4 2538 B16R1.20137 COC(=O)c1cc(ccc1C=C(C)C)C=O 271570a_100102525489_100013328361 [0,2,0,0,0,0|2,0,0]=4 2539 B16R1.20137 COC(=O)c1cc(ccc1C=C(C)C)CN 271570a_100102525489_100016988414 [0,2,0,0,0,0|2,0,0]=4 2540 B16R1.20137 COC(=O)c1cc(ccc1C=C(C)C)OC 271570a_100102525489_100000151459 [0,2,0,0,0,0|2,0,0]=4 2541 B16R1.20137 COC(=O)c1cc(ccc1CC(=O)C)C#N 1458a_100000070787_100010134437 [0,2,0,0,0,0|1,0,0]=3 2542 B16R1.20137 COC(=O)c1cc(ccc1CC(=O)C)OC 1458a_100000070787_100010239715 [0,2,0,0,0,0|1,0,0]=3 2543 B16R1.20137 COC(=O)c1cc(ccc1NC(=O)C)C#N 188690a_100000100876_100015343762 [0,2,0,0,0,0|0,0,0]=2 2544 B16R1.20137 COC(=O)c1cc(ccc1NC(=O)C)OC 188690a_100000745211_100015343762 [0,2,0,0,0,0|0,0,0]=2 2545 B16R1.76814 COC(=O)c1cc(c(cc1C=C(C)C)Br)F 271570a_100102525489_100014686389 [0,2,0,0,0,0|2,0,0]=4 2546 B16R1.76814 COC(=O)c1cc(c(cc1C=C(C)C)C)F 271570a_100102525489_100015763395 [0,2,0,0,0,0|2,0,0]=4 2547 B16R1.76814 COC(=O)c1cc(c(cc1C=C(C)C)C)N 271570a_100102525489_100000730709 [0,2,0,0,0,0|2,0,0]=4 2548 B16R1.76814 COC(=O)c1cc(c(cc1C=C(C)C)Cl)Br 271570a_100102525489_200012920379 [0,2,0,0,0,0|2,0,0]=4 2549 B16R1.76814 COC(=O)c1cc(c(cc1C=C(C)C)F)C 271570a_100102525489_100015451887 [0,2,0,0,0,0|2,0,0]=4 2550 B16R1.76814 COC(=O)c1cc(c(cc1C=C(C)C)F)F 271570a_100102525489_100010195689 [0,2,0,0,0,0|2,0,0]=4 2551 B16R1.76814 COC(=O)c1cc(c(cc1C=C(C)C)N)F 271570a_100102525489_100010764352 [0,2,0,0,0,0|2,0,0]=4 2552 B16R1.76814 COC(=O)c1cc(c(cc1NC(=O)C)C)C 188690a_100000103818_100015343762 [0,2,0,0,0,0|0,0,0]=2 2553 B16R1.76814 COC(=O)c1cc(c(cc1NC(=O)C)C)F 188690a_100000733234_100015343762 [0,2,0,0,0,0|0,0,0]=2 2554 B16R1.76814 COC(=O)c1cc(c(cc1NC(=O)C)C)I 188690a_100010892302_100015343762 [0,2,0,0,0,0|0,0,0]=2 2555 B16R1.78073 C#CC(=O)Cc1ccc(cc1C(=O)OC)Br 1458a_100000211873_100000728005 [0,2,0,0,0,0|1,0,1]=4 2556 B16R1.78073 C#CC(=O)Cc1ccc(cc1C(=O)OC)Cl 1458a_100000211873_100012352085 [0,2,0,0,0,0|1,0,1]=4 2557 B16R1.78073 C#CC(=O)Cc1ccc(cc1C(=O)OC)F 1458a_100000211873_100000751459 [0,2,0,0,0,0|1,0,1]=4 2558 B16R1.78073 C#CC(=O)Cc1ccc(cc1C(=O)OC)I 1458a_100000211873_100011096949 [0,2,0,0,0,0|1,0,1]=4 2559 B16R1.78073 C=CC(=O)Cc1ccc(cc1C(=O)OC)Br 1458a_100000185746_100000728005 [0,2,0,0,0,0|1,0,1]=4 2560 B16R1.78073 C=CC(=O)Cc1ccc(cc1C(=O)OC)Cl 1458a_100000185746_100012352085 [0,2,0,0,0,0|1,0,1]=4 2561 B16R1.78073 C=CC(=O)Cc1ccc(cc1C(=O)OC)F 1458a_100000185746_100000751459 [0,2,0,0,0,0|1,0,1]=4 2562 B16R1.78073 C=CC(=O)Cc1ccc(cc1C(=O)OC)I 1458a_100000185746_100011096949 [0,2,0,0,0,0|1,0,1]=4 2563 B16R1.78073 C=CC(=O)Nc1ccc(cc1C(=O)NC)Br 1626a_100000690504_100000185746 [0,2,0,0,0,0|1,0,1]=4 2564 B16R1.78073 C=CC(=O)Nc1ccc(cc1C(=O)NC)Cl 1626a_100000739363_100000185746 [0,2,0,0,0,0|1,0,1]=4 2565 B16R1.78073 C=CC(=O)Nc1ccc(cc1C(=O)NC)Cl 22a_100000739363_100000185746 [0,2,0,0,0,0|1,0,1]=4 2566 B16R1.78073 CCC(=O)Cc1ccc(cc1C(=O)OC)Br 1458a_100000210414_100000728005 [0,2,0,0,0,0|1,0,0]=3 2567 B16R1.78073 CCC(=O)Cc1ccc(cc1C(=O)OC)Cl 1458a_100000210414_100012352085 [0,2,0,0,0,0|1,0,0]=3 2568 B16R1.78073 CCC(=O)Cc1ccc(cc1C(=O)OC)F 1458a_100000210414_100000751459 [0,2,0,0,0,0|1,0,0]=3 2569 B16R1.78073 CCC(=O)Cc1ccc(cc1C(=O)OC)I 1458a_100000210414_100011096949 [0,2,0,0,0,0|1,0,0]=3 2570 B16R1.78073 CCC(=O)Nc1ccc(cc1C(=O)NC)Br 11a_100000690504_100000210414 [0,2,0,0,0,0|1,0,0]=3 2571 B16R1.78073 CCC(=O)Nc1ccc(cc1C(=O)NC)Br 1626a_100000690504_100000210414 [0,2,0,0,0,0|1,0,0]=3 2572 B16R1.78073 CCC(=O)Nc1ccc(cc1C(=O)NC)Cl 11a_100000739363_100000210414 [0,2,0,0,0,0|1,0,0]=3 2573 B16R1.78073 CCC(=O)Nc1ccc(cc1C(=O)NC)Cl 1626a_100000739363_100000210414 [0,2,0,0,0,0|1,0,0]=3 2574 B16R1.78073 CCC(=O)Nc1ccc(cc1C(=O)NC)Cl 22a_100000739363_100000210414 [0,2,0,0,0,0|1,0,0]=3 2575 B16R1.78073 CNC(=O)c1cc(ccc1NC(=O)CO)Cl 22a_100000739363_100000210174 [0,2,0,0,0,0|1,0,0]=3 2576 B16R1.78073 COC(=O)c1cc(ccc1C=C(C)C#N)Br 6a_100012355575_200000212204 [0,2,0,0,0,0|2,0,0]=4 2577 B16R1.78073 COC(=O)c1cc(ccc1C=C(C)C#N)F 6a_100012002548_200000212204 [0,2,0,0,0,0|2,0,0]=4 2578 B16R1.78073 COC(=O)c1cc(ccc1CC(=O)CO)Br 1458a_100000210174_100000728005 [0,2,0,0,0,0|1,0,0]=3 2579 B16R1.78073 COC(=O)c1cc(ccc1CC(=O)CO)Cl 1458a_100000210174_100012352085 [0,2,0,0,0,0|1,0,0]=3 2580 B16R1.78073 COC(=O)c1cc(ccc1CC(=O)CO)F 1458a_100000210174_100000751459 [0,2,0,0,0,0|1,0,0]=3 2581 B16R1.78073 COC(=O)c1cc(ccc1CC(=O)CO)I 1458a_100000210174_100011096949 [0,2,0,0,0,0|1,0,0]=3 2582 B16R1.174793 CNC(=O)c1cc(cc(c1NC(=O)C)C)Br 11a_100010284104_100015343762 [0,2,0,0,0,0|1,0,0]=3 2583 B16R1.174793 CNC(=O)c1cc(cc(c1NC(=O)C)C)Br 1626a_100010284104_100015343762 [0,2,0,0,0,0|1,0,0]=3 2584 B16R1.174793 CNC(=O)c1cc(cc(c1NC(=O)C)C)Cl 11a_100009875010_100015343762 [0,2,0,0,0,0|1,0,0]=3 2585 B16R1.174793 CNC(=O)c1cc(cc(c1NC(=O)C)C)Cl 1626a_100009875010_100015343762 [0,2,0,0,0,0|1,0,0]=3 2586 B16R1.174793 COC(=O)c1cc(cc(c1C=C(C)C)C)F 271570a_100102525489_100016049047 [0,2,0,0,0,0|2,0,0]=4 2587 B16R1.174793 COC(=O)c1cc(cc(c1C=C(C)C)F)F 271570a_100102525489_100010155431 [0,2,0,0,0,0|2,0,0]=4 2588 B16R1.174793 COC(=O)c1cc(cc(c1C=C(C)C)N)F 271570a_100102525489_100011794234 [0,2,0,0,0,0|2,0,0]=4 2589 B16R1.174793 COC(=O)c1cc(cc(c1NC(=O)C)C)Br 188690a_100011356660_100015343762 [0,2,0,0,0,0|0,0,0]=2 2590 B16R1.174793 COC(=O)c1cc(cc(c1NC(=O)C)C)Cl 188690a_100011356578_100015343762 [0,2,0,0,0,0|0,0,0]=2 2591 B16R1.174793 COC(=O)c1cc(cc(c1NC(=O)C)C)I 188690a_200021580980_100015343762 [0,2,0,0,0,0|0,0,0]=2 2592 B16R1.175089 COC(=O)c1c(ccc(c1C)F)C=C(C)C 271570a_100102525489_100015681208 [0,2,0,0,0,0|2,0,0]=4 2593 B16R1.175089 COC(=O)c1c(ccc(c1C)N)C=C(C)C 271570a_100102525489_100000718917 [0,2,0,0,0,0|2,0,0]=4 2594 B16R1.175089 COC(=O)c1c(ccc(c1C)O)C=C(C)C 271570a_100102525489_100010074912 [0,2,0,0,0,0|2,0,0]=4 2595 B16R1.175089 COC(=O)c1c(ccc(c1F)Br)C=C(C)C 271570a_100102525489_100015883209 [0,2,0,0,0,0|2,0,0]=4 2596 B16R1.175089 COC(=O)c1c(ccc(c1F)C)C=C(C)C 271570a_100102525489_100010782293 [0,2,0,0,0,0|2,0,0]=4 2597 B16R1.1177 C#CC(C)N(C)c1ccccc1C(=O)OC 34a_100000170468_200000035995 [0,2,0,0,0,0|1,0,1]=4 2598 B16R1.1177 C=CC(=O)N(C)c1ccccc1C(=O)OC 1626a_100000170468_100000185746 [0,2,0,0,0,0|0,0,1]=3 2599 B16R1.1177 C=CC(C)N(C)c1ccccc1C(=O)OC 269982a_100000170468_100011215867 [0,2,0,0,0,0|1,0,1]=4 2600 B16R1.1177 CCC(=O)N(C)c1ccccc1C(=O)OC 11a_100000170468_100000210414 [0,2,0,0,0,0|0,0,0]=2 2601 B16R1.1177 CCC(=O)N(C)c1ccccc1C(=O)OC 1626a_100000170468_100000210414 [0,2,0,0,0,0|0,0,0]=2 2602 B16R1.1177 CCC(=O)c1ccccc1N(C)C(=O)OC 1458a_100000744063_100000210202 [0,2,0,0,0,0|1,0,0]=3 2603 B16R1.1177 CCC(C)N(C)c1ccccc1C(=O)OC 269982a_100000170468_100000758301 [0,2,0,0,0,0|1,0,1]=4 2604 B16R1.1177 CCC(C)N(C)c1ccccc1C(=O)OC 34a_100000170468_100011215416 [0,2,0,0,0,0|1,0,1]=4 2605 B16R1.1177 CNC(=O)N(C)c1ccccc1C(=O)OC 512a_106832991638_100000170468 [0,2,0,0,0,0|0,0,0]=2 2606 B16R1.1177 CNC(=O)c1ccccc1N(C)C(=O)OC 1626a_100102657272_100000744063 [0,2,0,0,0,0|1,0,0]=3 2607 B16R1.1177 CNC(=O)c1ccccc1N(C)C(=O)OC 240690a_100102657272_100000744063 [0,2,0,0,0,0|1,0,0]=3 2608 B16R1.1177 COC(=O)N(C)c1ccccc1C(=O)CF 1458a_100000744063_100015361967 [0,2,0,0,0,0|2,0,0]=4 2609 B16R1.1177 COC(=O)c1ccccc1N(C)C(C)C#N 269982a_100000170468_100000703298 [0,2,0,0,0,0|1,0,1]=4 2610 B16R1.1177 COC(=O)c1ccccc1N(C)C(C)CO 34a_100000170468_100012180447 [0,2,0,0,0,0|0,0,2]=4 2611 B16R1.1177 COC(=O)c1ccccc1N(C)C(C)OC 269982a_100000170468_100009879195 [0,2,0,0,0,0|0,0,2]=4 2612 B16R1.1177 COC(=O)c1ccccc1N(C)[C@H](C)CO 269982a_100000170468_100016084084 [0,2,0,0,0,0|0,0,2]=4 2613 B16R1.4138 CC(=O)N(C)c1ccccc1C(=O)C(C)C 1458a_100000242783_100000210206 [0,2,0,0,0,0|1,0,0]=3 2614 B16R1.4138 CC(=O)N(C)c1ccccc1C(=O)N(C)C 1626a_100102631434_100000242783 [0,2,0,0,0,0|1,0,0]=3 2615 B16R1.4138 CC(=O)N(C)c1ccccc1C(=O)N(C)C 240690a_100102631434_100000242783 [0,2,0,0,0,0|1,0,0]=3 2616 B16R1.17237 CCC(=O)c1ccccc1N(C)S(=O)(=O)C 1458a_100000186282_100000210202 [0,2,0,0,0,0|2,0,0]=4 2617 B16R1.17237 CNC(=O)c1ccccc1N(C)S(=O)(=O)C 11a_106832991635_100000186282 [0,2,0,0,0,0|2,0,0]=4 2618 B16R1.17237 CNC(=O)c1ccccc1N(C)S(=O)(=O)C 1626a_100102657272_100000186282 [0,2,0,0,0,0|2,0,0]=4 2619 B16R1.17237 CNC(=O)c1ccccc1N(C)S(=O)(=O)C 240690a_100102657272_100000186282 [0,2,0,0,0,0|2,0,0]=4 2620 B16R1.17237 CNC(=O)c1ccccc1N(C)S(=O)(=O)C 527a_100102657272_100000186282 [0,2,0,0,0,0|2,0,0]=4 2621 B16R1.17237 COC(=O)c1ccccc1N(C)C(C)(C)C 269982a_100000170468_100000210625 [0,2,0,0,0,0|1,0,1]=4 2622 B16R1.17237 COC(=O)c1ccccc1N(C)C(C)(C)C 34a_100000170468_100000210625 [0,2,0,0,0,0|1,0,1]=4 2623 B16R1.17269 COC(=O)c1c(cccc1C(=C(C)C)C)Br 271570a_200000049429_100010247157 [0,2,0,0,0,0|2,0,0]=4 2624 B16R1.17269 COC(=O)c1c(cccc1C(=C(C)C)C)C 271570a_200000049429_100010204206 [0,2,0,0,0,0|2,0,0]=4 2625 B16R1.17269 COC(=O)c1c(cccc1C(=C(C)C)C)Cl 271570a_200000049429_100010150959 [0,2,0,0,0,0|2,0,0]=4 2626 B16R1.17269 COC(=O)c1c(cccc1C(=C(C)C)C)F 271570a_200000049429_100000150693 [0,2,0,0,0,0|2,0,0]=4 2627 B16R1.17269 COC(=O)c1c(cccc1C(=C(C)C)C)N 271570a_200000049429_100010253892 [0,2,0,0,0,0|2,0,0]=4 2628 B16R1.17269 COC(=O)c1c(cccc1N(C)C(=O)C)Cl 11a_200010565112_100015343762 [0,2,0,0,0,0|0,0,0]=2 2629 B16R1.17269 COC(=O)c1c(cccc1N(C)C(=O)C)Cl 1626a_200010565112_100015343762 [0,2,0,0,0,0|0,0,0]=2 2630 B16R1.17269 COC(=O)c1c(cccc1N(C)C(C)C)Cl 269982a_200010565112_100000210206 [0,2,0,0,0,0|1,0,1]=4 2631 B16R1.17269 COC(=O)c1c(cccc1N(C)C(C)C)Cl 34a_200010565112_100000210206 [0,2,0,0,0,0|1,0,1]=4 2632 B16R1.74191 COC(=O)c1cccc(c1C(=C(C)C)C)Br 271570a_200000049429_100010150843 [0,2,0,0,0,0|2,0,0]=4 2633 B16R1.74191 COC(=O)c1cccc(c1C(=C(C)C)C)C 271570a_200000049429_100012002529 [0,2,0,0,0,0|2,0,0]=4 2634 B16R1.74191 COC(=O)c1cccc(c1C(=C(C)C)C)F 271570a_200000049429_100012357630 [0,2,0,0,0,0|2,0,0]=4 2635 B16R1.74191 COC(=O)c1cccc(c1C(=C(C)C)C)N 271570a_200000049429_100000719424 [0,2,0,0,0,0|2,0,0]=4 2636 B16R1.74191 COC(=O)c1cccc(c1C(=C(C)C)C)O 271570a_200000049429_200010230364 [0,2,0,0,0,0|2,0,0]=4 2637 B16R1.74210 COC(=O)c1ccc(cc1C(=C(C)C)C)Br 271570a_200000049429_100000701758 [0,2,0,0,0,0|2,0,0]=4 2638 B16R1.74210 COC(=O)c1ccc(cc1C(=C(C)C)C)C 271570a_200000049429_100012340597 [0,2,0,0,0,0|2,0,0]=4 2639 B16R1.74210 COC(=O)c1ccc(cc1C(=C(C)C)C)Cl 271570a_200000049429_100000047510 [0,2,0,0,0,0|2,0,0]=4 2640 B16R1.74210 COC(=O)c1ccc(cc1C(=C(C)C)C)F 271570a_200000049429_100000204356 [0,2,0,0,0,0|2,0,0]=4 2641 B16R1.74210 COC(=O)c1ccc(cc1C(=C(C)C)C)N 271570a_200000049429_100009998378 [0,2,0,0,0,0|2,0,0]=4 2642 B16R1.74210 COC(=O)c1ccc(cc1C(=C(C)C)C)O 271570a_200000049429_100010150825 [0,2,0,0,0,0|2,0,0]=4 2643 B16R1.74210 COC(=O)c1ccc(cc1N(C)C(=O)C)Br 1626a_200160487225_100015343762 [0,2,0,0,0,0|0,0,0]=2 2644 B16R1.74210 COC(=O)c1ccc(cc1N(C)C(C)C)Br 269982a_200160487225_100000210206 [0,2,0,0,0,0|1,0,1]=4 2645 B16R1.74210 COC(=O)c1ccc(cc1N(C)C(C)C)Br 34a_200160487225_100000210206 [0,2,0,0,0,0|1,0,1]=4 2646 B16R1.11217 CC(=O)Nc1cccc(c1C(=O)C(C)C)Cl 1458a_200011219801_100000210206 [0,2,0,0,0,0|1,0,0]=3 2647 B16R1.11217 CC(=O)Nc1cccc(c1C(=O)C(C)C)F 1458a_100000756107_100000210206 [0,2,0,0,0,0|1,0,0]=3 2648 B16R1.11217 CC(=O)Nc1cccc(c1C(=O)N(C)C)Cl 240690a_100102631434_200011219801 [0,2,0,0,0,0|1,0,0]=3 2649 B16R1.11217 CC(=O)Nc1cccc(c1C(=O)N(C)C)F 240690a_100102631434_100000756107 [0,2,0,0,0,0|1,0,0]=3 2650 B16R1.11433 CC(=O)Nc1cc(ccc1C(=C(C)C)C)C 271570a_200000049429_100000182586 [0,2,0,0,0,0|2,0,0]=4 2651 B16R1.11433 CC(=O)Nc1cc(ccc1C(=C(C)C)C)F 271570a_200000049429_100012558231 [0,2,0,0,0,0|2,0,0]=4 2652 B16R1.11433 CC(=O)Nc1cc(ccc1C(=O)C(C)C)Br 1458a_100000747254_100000210206 [0,2,0,0,0,0|1,0,0]=3 2653 B16R1.11433 CC(=O)Nc1cc(ccc1C(=O)C(C)C)Cl 1458a_100000195377_100000210206 [0,2,0,0,0,0|1,0,0]=3 2654 B16R1.11433 CC(=O)Nc1cc(ccc1C(=O)C(C)C)F 1458a_100000222213_100000210206 [0,2,0,0,0,0|1,0,0]=3 2655 B16R1.11433 CC(=O)Nc1cc(ccc1C(=O)N(C)C)Br 240690a_100102631434_100000747254 [0,2,0,0,0,0|1,0,0]=3 2656 B16R1.11433 CC(=O)Nc1cc(ccc1C(=O)N(C)C)Cl 11a_100000738152_100015343762 [0,2,0,0,0,0|1,0,0]=3 2657 B16R1.11433 CC(=O)Nc1cc(ccc1C(=O)N(C)C)Cl 1626a_100000738152_100015343762 [0,2,0,0,0,0|1,0,0]=3 2658 B16R1.11433 CC(=O)Nc1cc(ccc1C(=O)N(C)C)Cl 240690a_100102631434_100000195377 [0,2,0,0,0,0|1,0,0]=3 2659 B16R1.11433 CC(=O)Nc1cc(ccc1C(=O)N(C)C)F 240690a_100102631434_100000222213 [0,2,0,0,0,0|1,0,0]=3 2660 B16R1.24477 CC(C)C(=O)c1ccccc1NS(=O)(=O)C 1458a_100000169588_100000210206 [0,2,0,0,0,0|2,0,0]=4 2661 B16R1.24477 CN(C)C(=O)c1ccccc1NS(=O)(=O)C 240690a_100102631434_100000169588 [0,2,0,0,0,0|2,0,0]=4 2662 B16R1.24477 CN(C)C(=O)c1ccccc1NS(=O)(=O)C 527a_100102631434_100000169588 [0,2,0,0,0,0|2,0,0]=4 2663 B16R1.1556 C#CCC(=O)Cc1ccccc1C(=O)OC 1458a_100000695166_100000184674 [0,2,0,0,0,0|1,0,0]=3 2664 B16R1.1556 C#CCC(=O)Cc1ccccc1C(=O)OC 1458a_100011220946_100000744672 [0,2,0,0,0,0|1,0,0]=3 2665 B16R1.1556 C#CCC(=O)Cc1cccnc1C(=O)OC 1458a_100011220946_100010177730 [0,2,0,0,0,0|2,0,0]=4 2666 B16R1.1556 C#CCC(=O)Cc1ncccc1C(=O)OC 1458a_100011220946_100000709840 [0,2,0,0,0,0|2,0,0]=4 2667 B16R1.1556 C#CCC(=O)Nc1ccccc1C(=O)NC 1626a_100000185696_100011220946 [0,2,0,0,0,0|1,0,0]=3 2668 B16R1.1556 C=CCC(=O)Cc1ccccc1C(=O)OC 1458a_100000210193_100000744672 [0,2,0,0,0,0|1,0,0]=3 2669 B16R1.1556 C=CCC(=O)Cc1ccccc1C(=O)OC 1458a_100000695166_100000210623 [0,2,0,0,0,0|1,0,0]=3 2670 B16R1.1556 C=CCC(=O)Cc1cccnc1C(=O)OC 1458a_100000210193_100010177730 [0,2,0,0,0,0|2,0,0]=4 2671 B16R1.1556 C=CCC(=O)Cc1ncccc1C(=O)OC 1458a_100000210193_100000709840 [0,2,0,0,0,0|2,0,0]=4 2672 B16R1.1556 C=CCC(=O)Nc1ccccc1C(=O)NC 11a_100000185696_100000210193 [0,2,0,0,0,0|1,0,0]=3 2673 B16R1.1556 C=CCC(=O)Nc1ccccc1C(=O)NC 1626a_100000185696_100000210193 [0,2,0,0,0,0|1,0,0]=3 2674 B16R1.1556 C=CCC(=O)Nc1ccccc1C(=O)NC 22a_100000185696_100000210193 [0,2,0,0,0,0|1,0,0]=3 2675 B16R1.1556 CC#CC(=O)Cc1ccccc1C(=O)OC 1458a_100000763181_100000744672 [0,2,0,0,0,0|1,0,0]=3 2676 B16R1.1556 CC#CC(=O)Cc1cccnc1C(=O)OC 1458a_100000763181_100010177730 [0,2,0,0,0,0|2,0,0]=4 2677 B16R1.1556 CC#CC(=O)Cc1ncccc1C(=O)OC 1458a_100000763181_100000709840 [0,2,0,0,0,0|2,0,0]=4 2678 B16R1.1556 CC#CC(=O)Nc1ccccc1C(=O)NC 22a_100000185696_100000763181 [0,2,0,0,0,0|1,0,0]=3 2679 B16R1.1556 CC=CC(=O)Cc1ccccc1C(=O)OC 1458a_100000210699_100000744672 [0,2,0,0,0,0|1,0,0]=3 2680 B16R1.1556 CC=CC(=O)Cc1cccnc1C(=O)OC 1458a_100000210699_100010177730 [0,2,0,0,0,0|2,0,0]=4 2681 B16R1.1556 CC=CC(=O)Cc1ncccc1C(=O)OC 1458a_100000210699_100000709840 [0,2,0,0,0,0|2,0,0]=4 2682 B16R1.1556 CC=CC(=O)Nc1ccccc1C(=O)NC 11a_100000185696_100000210699 [0,2,0,0,0,0|1,0,0]=3 2683 B16R1.1556 CC=CC(=O)Nc1ccccc1C(=O)NC 1626a_100000185696_100000210699 [0,2,0,0,0,0|1,0,0]=3 2684 B16R1.1556 CC=CC(=O)Nc1ccccc1C(=O)NC 22a_100000185696_100000210699 [0,2,0,0,0,0|1,0,0]=3 2685 B16R1.1556 CCC(=O)c1ccccc1NC(=O)CC#N 1458a_100000010298_100000210202 [0,2,0,0,0,0|1,0,0]=3 2686 B16R1.1556 CCC(=O)c1ccccc1NC(=O)COC 1458a_100000194449_100000210202 [0,2,0,0,0,0|1,0,0]=3 2687 B16R1.1556 CCCC(=O)Cc1ccccc1C(=O)OC 1458a_100000211992_100000744672 [0,2,0,0,0,0|1,0,0]=3 2688 B16R1.1556 CCCC(=O)Cc1ccccc1C(=O)OC 1458a_100000695166_100000210303 [0,2,0,0,0,0|1,0,0]=3 2689 B16R1.1556 CCCC(=O)Cc1cccnc1C(=O)OC 1458a_100000211992_100010177730 [0,2,0,0,0,0|2,0,0]=4 2690 B16R1.1556 CCCC(=O)Cc1ncccc1C(=O)OC 1458a_100000211992_100000709840 [0,2,0,0,0,0|2,0,0]=4 2691 B16R1.1556 CCCC(=O)Nc1ccccc1C(=O)CC 1458a_100011208156_100000210202 [0,2,0,0,0,0|1,0,0]=3 2692 B16R1.1556 CCCC(=O)Nc1ccccc1C(=O)CF 1458a_100011208156_100015361967 [0,2,0,0,0,0|2,0,0]=4 2693 B16R1.1556 CCCC(=O)Nc1ccccc1C(=O)NC 11a_100000185696_100000211992 [0,2,0,0,0,0|1,0,0]=3 2694 B16R1.1556 CCCC(=O)Nc1ccccc1C(=O)NC 1626a_100000185696_100000211992 [0,2,0,0,0,0|1,0,0]=3 2695 B16R1.1556 CCCC(=O)Nc1ccccc1C(=O)NC 22a_100000185696_100000211992 [0,2,0,0,0,0|1,0,0]=3 2696 B16R1.1556 CCCC(=O)Nc1ccccc1C(=O)NC 240690a_100102657272_100011208156 [0,2,0,0,0,0|1,0,0]=3 2697 B16R1.1556 CCNC(=O)Cc1ccccc1C(=O)OC 11a_100015525214_100000695166 [0,2,0,0,0,0|1,0,0]=3 2698 B16R1.1556 CCNC(=O)Cc1ccccc1C(=O)OC 240690a_100015525214_100000695166 [0,2,0,0,0,0|1,0,0]=3 2699 B16R1.1556 CCNC(=O)Nc1ccccc1C(=O)NC 2430a_100000185696_100015525214 [0,2,0,0,0,0|1,0,0]=3 2700 B16R1.1556 CNC(=O)c1ccccc1NC(=O)C=CBr 1626a_100000185696_100016273825 [0,2,0,0,0,0|1,0,1]=4 2701 B16R1.1556 CNC(=O)c1ccccc1NC(=O)C=CCl 11a_100000185696_200016279998 [0,2,0,0,0,0|1,0,1]=4 2702 B16R1.1556 CNC(=O)c1ccccc1NC(=O)C=CCl 1626a_100000185696_200016279998 [0,2,0,0,0,0|1,0,1]=4 2703 B16R1.1556 CNC(=O)c1ccccc1NC(=O)C=CI 1626a_100000185696_100016256311 [0,2,0,0,0,0|1,0,1]=4 2704 B16R1.1556 CNC(=O)c1ccccc1NC(=O)CC#N 1626a_100000185696_100051588842 [0,2,0,0,0,0|1,0,0]=3 2705 B16R1.1556 CNC(=O)c1ccccc1NC(=O)CC#N 22a_100000185696_100051588842 [0,2,0,0,0,0|1,0,0]=3 2706 B16R1.1556 CNC(=O)c1ccccc1NC(=O)CC#N 240690a_100102657272_100000010298 [0,2,0,0,0,0|1,0,0]=3 2707 B16R1.1556 CNC(=O)c1ccccc1NC(=O)CCO 22a_100000185696_100011216618 [0,2,0,0,0,0|1,0,0]=3 2708 B16R1.1556 CNC(=O)c1ccccc1NC(=O)COC 11a_100000185696_100000210968 [0,2,0,0,0,0|1,0,0]=3 2709 B16R1.1556 CNC(=O)c1ccccc1NC(=O)COC 1626a_100000185696_100000210968 [0,2,0,0,0,0|1,0,0]=3 2710 B16R1.1556 CNC(=O)c1ccccc1NC(=O)COC 22a_100000185696_100000210968 [0,2,0,0,0,0|1,0,0]=3 2711 B16R1.1556 CNC(=O)c1ccccc1NC(=O)COC 240690a_100102657272_100000194449 [0,2,0,0,0,0|1,0,0]=3 2712 B16R1.1556 CNC(=O)c1ccccc1NC(=O)CSC 11a_100000185696_100000184570 [0,2,0,0,0,0|1,0,0]=3 2713 B16R1.1556 CNC(=O)c1ccccc1NC(=O)CSC 1626a_100000185696_100000184570 [0,2,0,0,0,0|1,0,0]=3 2714 B16R1.1556 CNC(=O)c1ccccc1NC(=O)CSC 22a_100000185696_100000184570 [0,2,0,0,0,0|1,0,0]=3 2715 B16R1.1556 CNCC(=O)Nc1ccccc1C(=O)OC 2230a_106832991635_100000181727 [0,2,0,0,0,0|0,0,0]=2 2716 B16R1.1556 CNCC(=O)Nc1ccccc1C(=O)OC 34a_100102657272_100000181727 [0,2,0,0,0,0|0,0,0]=2 2717 B16R1.1556 CNCC(=O)Nc1ccccc1C(=O)OC 7a_106832991635_100000181727 [0,2,0,0,0,0|0,0,0]=2 2718 B16R1.1556 CNNC(=O)Cc1ccccc1C(=O)OC 22a_100016993582_100000695166 [0,2,0,0,0,0|1,0,0]=3 2719 B16R1.1556 COC(=O)c1ccccc1CC(=O)C=CBr 1458a_100016273825_100000744672 [0,2,0,0,0,0|1,0,1]=4 2720 B16R1.1556 COC(=O)c1ccccc1CC(=O)C=CCl 1458a_200016279998_100000744672 [0,2,0,0,0,0|1,0,1]=4 2721 B16R1.1556 COC(=O)c1ccccc1CC(=O)C=CI 1458a_100016256311_100000744672 [0,2,0,0,0,0|1,0,1]=4 2722 B16R1.1556 COC(=O)c1ccccc1CC(=O)CC#N 1458a_100000695166_100011214920 [0,2,0,0,0,0|1,0,0]=3 2723 B16R1.1556 COC(=O)c1ccccc1CC(=O)CC#N 1458a_100051588842_100000744672 [0,2,0,0,0,0|1,0,0]=3 2724 B16R1.1556 COC(=O)c1ccccc1CC(=O)CCF 1458a_100000695166_100011217306 [0,2,0,0,0,0|1,0,0]=3 2725 B16R1.1556 COC(=O)c1ccccc1CC(=O)CCO 1458a_100000695166_100000211926 [0,2,0,0,0,0|1,0,0]=3 2726 B16R1.1556 COC(=O)c1ccccc1CC(=O)CCO 1458a_100011216618_100000744672 [0,2,0,0,0,0|1,0,0]=3 2727 B16R1.1556 COC(=O)c1ccccc1CC(=O)CSC 1458a_100000184570_100000744672 [0,2,0,0,0,0|1,0,0]=3 2728 B16R1.1556 COC(=O)c1ccccc1NC(=O)CSC 62a_200000210301_100000181727 [0,2,0,0,0,0|0,0,0]=2 2729 B16R1.1556 COC(=O)c1ccccc1NC(=O)CS[13CH3] 62a_200025704644_100000181727 [0,2,0,0,0,0|0,0,0]=2 2730 B16R1.1556 COC(=O)c1cccnc1CC(=O)CC#N 1458a_100051588842_100000709840 [0,2,0,0,0,0|2,0,0]=4 2731 B16R1.1556 COC(=O)c1cccnc1CC(=O)CCO 1458a_100011216618_100000709840 [0,2,0,0,0,0|2,0,0]=4 2732 B16R1.1556 COC(=O)c1cccnc1CC(=O)CSC 1458a_100000184570_100000709840 [0,2,0,0,0,0|2,0,0]=4 2733 B16R1.1556 COC(=O)c1ncccc1CC(=O)CC#N 1458a_100051588842_100010177730 [0,2,0,0,0,0|2,0,0]=4 2734 B16R1.1556 COC(=O)c1ncccc1CC(=O)CCO 1458a_100011216618_100010177730 [0,2,0,0,0,0|2,0,0]=4 2735 B16R1.1556 COC(=O)c1ncccc1CC(=O)CSC 1458a_100000184570_100010177730 [0,2,0,0,0,0|2,0,0]=4 2736 B16R1.1556 COCC(=O)Cc1ccccc1C(=O)OC 1458a_100000210968_100000744672 [0,2,0,0,0,0|1,0,0]=3 2737 B16R1.1556 COCC(=O)Cc1cccnc1C(=O)OC 1458a_100000210968_100010177730 [0,2,0,0,0,0|2,0,0]=4 2738 B16R1.1556 COCC(=O)Cc1ncccc1C(=O)OC 1458a_100000210968_100000709840 [0,2,0,0,0,0|2,0,0]=4 2739 B16R1.1556 COCC(=O)Nc1ccccc1C(=O)CF 1458a_100000194449_100015361967 [0,2,0,0,0,0|2,0,0]=4 2740 B16R1.1556 COCC(=O)Nc1ccccc1C(=O)OC 34a_100138415774_100000181727 [0,2,0,0,0,0|0,0,0]=2 2741 B16R1.1556 N#CCC(=O)Nc1ccccc1C(=O)CF 1458a_100000010298_100015361967 [0,2,0,0,0,0|2,0,0]=4 2742 B16R1.25336 C#CC(=O)Cc1c(cccc1C(=O)OC)Br 1458a_100000211873_100012352084 [0,2,0,0,0,0|1,0,1]=4 2743 B16R1.25336 C#CC(=O)Cc1c(cccc1C(=O)OC)Cl 1458a_100000211873_100000725332 [0,2,0,0,0,0|1,0,1]=4 2744 B16R1.25336 C#CC(=O)Cc1c(cccc1C(=O)OC)F 1458a_100000211873_100010239718 [0,2,0,0,0,0|1,0,1]=4 2745 B16R1.25336 C#CC(=O)Cc1c(cccc1C(=O)OC)I 1458a_100000211873_100011003723 [0,2,0,0,0,0|1,0,1]=4 2746 B16R1.25336 C=CC(=O)Cc1c(cccc1C(=O)OC)Br 1458a_100000185746_100012352084 [0,2,0,0,0,0|1,0,1]=4 2747 B16R1.25336 C=CC(=O)Cc1c(cccc1C(=O)OC)Cl 1458a_100000185746_100000725332 [0,2,0,0,0,0|1,0,1]=4 2748 B16R1.25336 C=CC(=O)Cc1c(cccc1C(=O)OC)F 1458a_100000185746_100010239718 [0,2,0,0,0,0|1,0,1]=4 2749 B16R1.25336 C=CC(=O)Cc1c(cccc1C(=O)OC)I 1458a_100000185746_100011003723 [0,2,0,0,0,0|1,0,1]=4 2750 B16R1.25336 C=CC(=O)Nc1c(cccc1C(=O)NC)C 1626a_100000223168_100000185746 [0,2,0,0,0,0|1,0,1]=4 2751 B16R1.25336 C=CC(=O)Nc1c(cccc1C(=O)NC)Cl 1626a_200012181065_100000185746 [0,2,0,0,0,0|1,0,1]=4 2752 B16R1.25336 CCC(=O)Cc1c(cccc1C(=O)OC)Br 1458a_100000210414_100012352084 [0,2,0,0,0,0|1,0,0]=3 2753 B16R1.25336 CCC(=O)Cc1c(cccc1C(=O)OC)Cl 1458a_100000210414_100000725332 [0,2,0,0,0,0|1,0,0]=3 2754 B16R1.25336 CCC(=O)Cc1c(cccc1C(=O)OC)F 1458a_100000210414_100010239718 [0,2,0,0,0,0|1,0,0]=3 2755 B16R1.25336 CCC(=O)Cc1c(cccc1C(=O)OC)I 1458a_100000210414_100011003723 [0,2,0,0,0,0|1,0,0]=3 2756 B16R1.25336 CCC(=O)Nc1c(cccc1C(=O)NC)C 11a_100000223168_100000210414 [0,2,0,0,0,0|1,0,0]=3 2757 B16R1.25336 CCC(=O)Nc1c(cccc1C(=O)NC)C 1626a_100000223168_100000210414 [0,2,0,0,0,0|1,0,0]=3 2758 B16R1.25336 CCC(=O)Nc1c(cccc1C(=O)NC)Cl 1626a_200012181065_100000210414 [0,2,0,0,0,0|1,0,0]=3 2759 B16R1.25336 CCC(=O)Nc1c(cccc1C(=O)OC)C 188690a_100000741038_100000210414 [0,2,0,0,0,0|0,0,0]=2 2760 B16R1.25336 CNC(=O)Nc1c(cccc1C(=O)NC)C 2430a_100000223168_100102657272 [0,2,0,0,0,0|1,0,0]=3 2761 B16R1.25336 COC(=O)c1cccc(c1CC(=O)CO)Br 1458a_100000210174_100012352084 [0,2,0,0,0,0|1,0,0]=3 2762 B16R1.25336 COC(=O)c1cccc(c1CC(=O)CO)Cl 1458a_100000210174_100000725332 [0,2,0,0,0,0|1,0,0]=3 2763 B16R1.25336 COC(=O)c1cccc(c1CC(=O)CO)F 1458a_100000210174_100010239718 [0,2,0,0,0,0|1,0,0]=3 2764 B16R1.25336 COC(=O)c1cccc(c1CC(=O)CO)I 1458a_100000210174_100011003723 [0,2,0,0,0,0|1,0,0]=3 2765 B16R1.25336 COC(=O)c1cccc(c1NC(=O)CO)C 188690a_100000741038_100000210174 [0,2,0,0,0,0|0,0,0]=2 2766 B16R1.74497 C#CC(=O)Cc1cc(ccc1C(=O)OC)Br 1458a_100000211873_100000693193 [0,2,0,0,0,0|1,0,1]=4 2767 B16R1.74497 C#CC(=O)Cc1cc(ccc1C(=O)OC)Cl 1458a_100000211873_100010239717 [0,2,0,0,0,0|1,0,1]=4 2768 B16R1.74497 C#CC(=O)Cc1cc(ccc1C(=O)OC)F 1458a_100000211873_100000700702 [0,2,0,0,0,0|1,0,1]=4 2769 B16R1.74497 C=CC(=O)Cc1cc(ccc1C(=O)OC)Br 1458a_100000185746_100000693193 [0,2,0,0,0,0|1,0,1]=4 2770 B16R1.74497 C=CC(=O)Cc1cc(ccc1C(=O)OC)Cl 1458a_100000185746_100010239717 [0,2,0,0,0,0|1,0,1]=4 2771 B16R1.74497 C=CC(=O)Cc1cc(ccc1C(=O)OC)F 1458a_100000185746_100000700702 [0,2,0,0,0,0|1,0,1]=4 2772 B16R1.74497 C=CC(=O)Nc1cc(ccc1C(=O)NC)Cl 1626a_100000742614_100000185746 [0,2,0,0,0,0|1,0,1]=4 2773 B16R1.74497 CCC(=O)Cc1cc(ccc1C(=O)OC)Br 1458a_100000210414_100000693193 [0,2,0,0,0,0|1,0,0]=3 2774 B16R1.74497 CCC(=O)Cc1cc(ccc1C(=O)OC)Cl 1458a_100000210414_100010239717 [0,2,0,0,0,0|1,0,0]=3 2775 B16R1.74497 CCC(=O)Cc1cc(ccc1C(=O)OC)F 1458a_100000210414_100000700702 [0,2,0,0,0,0|1,0,0]=3 2776 B16R1.74497 CCC(=O)Nc1cc(ccc1C(=O)CC)Cl 1458a_100000195379_100000210202 [0,2,0,0,0,0|1,0,0]=3 2777 B16R1.74497 CCC(=O)Nc1cc(ccc1C(=O)CF)Cl 1458a_100000195379_100015361967 [0,2,0,0,0,0|2,0,0]=4 2778 B16R1.74497 CCC(=O)Nc1cc(ccc1C(=O)NC)Cl 11a_100000742614_100000210414 [0,2,0,0,0,0|1,0,0]=3 2779 B16R1.74497 CCC(=O)Nc1cc(ccc1C(=O)NC)Cl 1626a_100000742614_100000210414 [0,2,0,0,0,0|1,0,0]=3 2780 B16R1.74497 CCC(=O)Nc1cc(ccc1C(=O)NC)Cl 240690a_100102657272_100000195379 [0,2,0,0,0,0|1,0,0]=3 2781 B16R1.74497 CNC(=O)Nc1cc(ccc1C(=O)NC)Cl 2430a_100000742614_100102657272 [0,2,0,0,0,0|1,0,0]=3 2782 B16R1.74497 COC(=O)c1ccc(cc1C=C(C)C#N)Br 6a_100000708894_200000212204 [0,2,0,0,0,0|2,0,0]=4 2783 B16R1.74497 COC(=O)c1ccc(cc1C=C(C)C#N)F 6a_100013041771_200000212204 [0,2,0,0,0,0|2,0,0]=4 2784 B16R1.74497 COC(=O)c1ccc(cc1CC(=O)CO)Br 1458a_100000210174_100000693193 [0,2,0,0,0,0|1,0,0]=3 2785 B16R1.74497 COC(=O)c1ccc(cc1CC(=O)CO)Cl 1458a_100000210174_100010239717 [0,2,0,0,0,0|1,0,0]=3 2786 B16R1.74497 COC(=O)c1ccc(cc1CC(=O)CO)F 1458a_100000210174_100000700702 [0,2,0,0,0,0|1,0,0]=3 2787 B16R1.76633 CCC(=O)c1ccccc1NS(=O)(=O)CC 1458a_100000169589_100000210202 [0,2,0,0,0,0|2,0,0]=4 2788 B16R1.76633 CCS(=O)(=O)Nc1ccccc1C(=O)NC 232682a_100000185696_100000211323 [0,2,0,0,0,0|2,0,0]=4 2789 B16R1.76633 CCS(=O)(=O)Nc1ccccc1C(=O)NC 240690a_100102657272_100000169589 [0,2,0,0,0,0|2,0,0]=4 2790 B16R1.76633 CCS(=O)(=O)Nc1ccccc1C(=O)NC 527a_100102657272_100000169589 [0,2,0,0,0,0|2,0,0]=4 2791 B16R1.78061 C#CC(=O)Cc1cccc(c1C(=O)OC)I 1458a_100000211873_200010272806 [0,2,0,0,0,0|1,0,1]=4 2792 B16R1.78061 C=CC(=O)Cc1cccc(c1C(=O)OC)I 1458a_100000185746_200010272806 [0,2,0,0,0,0|1,0,1]=4 2793 B16R1.78061 CCC(=O)Cc1cccc(c1C(=O)OC)I 1458a_100000210414_200010272806 [0,2,0,0,0,0|1,0,0]=3 2794 B16R1.78061 COC(=O)c1c(cccc1CC(=O)CO)I 1458a_100000210174_200010272806 [0,2,0,0,0,0|1,0,0]=3 2795 B16R1.74190 CCC(=O)c1cccc(c1NS(=O)(=O)C)C 1458a_100011194170_100000210202 [0,2,0,0,0,0|2,0,0]=4 2796 B16R1.74190 CNC(=O)c1cccc(c1NS(=O)(=O)C)C 240690a_100102657272_100011194170 [0,2,0,0,0,0|2,0,0]=4 2797 B16R1.74190 CNC(=O)c1cccc(c1NS(=O)(=O)C)C 527a_100102657272_100011194170 [0,2,0,0,0,0|2,0,0]=4 2798 B16R1.20211 COC(=O)c1ccc(cc1C=C(C)C)C#N 271570a_100102525489_100009832033 [0,2,0,0,0,0|2,0,0]=4 2799 B16R1.20211 COC(=O)c1ccc(cc1C=C(C)C)C=O 271570a_100102525489_100010630601 [0,2,0,0,0,0|2,0,0]=4 2800 B16R1.20211 COC(=O)c1ccc(cc1C=C(C)C)OC 271570a_100102525489_100009815674 [0,2,0,0,0,0|2,0,0]=4 2801 B16R1.20211 COC(=O)c1ccc(cc1CC(=O)C)C#N 1458a_100000070787_100010211389 [0,2,0,0,0,0|1,0,0]=3 2802 B16R1.20211 COC(=O)c1ccc(cc1CC(=O)C)OC 1458a_100000070787_100010138730 [0,2,0,0,0,0|1,0,0]=3 2803 B16R1.76417 COC(=O)c1ccc(c(c1C=C(C)C)F)F 271570a_100102525489_100010710315 [0,2,0,0,0,0|2,0,0]=4 2804 B16R1.175229 COC(=O)c1c(cc(cc1C=C(C)C)C)F 271570a_100102525489_100015667323 [0,2,0,0,0,0|2,0,0]=4 2805 B16R1.175229 COC(=O)c1c(cc(cc1C=C(C)C)F)F 271570a_100102525489_100010009842 [0,2,0,0,0,0|2,0,0]=4 2806 B16R1.19702 COC(=O)c1c(cccc1C=C(C)C)C#N 271570a_100102525489_100009843633 [0,2,0,0,0,0|2,0,0]=4 2807 B16R1.19702 COC(=O)c1c(cccc1CC(=O)C)C#N 1458a_100000070787_100010150874 [0,2,0,0,0,0|1,0,0]=3 2808 B16R1.19702 COC(=O)c1c(cccc1OC)C=C(C)C 271570a_100102525489_100010189552 [0,2,0,0,0,0|2,0,0]=4 2809 B16R1.19702 COC(=O)c1c(cccc1OC)NC(=O)C 188690a_100012179800_100015343762 [0,2,0,0,0,0|0,0,0]=2 2810 B16R1.77081 COC(=O)c1c(ccc(c1C=C(C)C)F)F 271570a_100102525489_100011071027 [0,2,0,0,0,0|2,0,0]=4 2811 B16R1.77081 COC(=O)c1c(ccc(c1NC(=O)C)F)F 188690a_100011356604_100015343762 [0,2,0,0,0,0|0,0,0]=2 2812 B16R1.19756 CCC(=O)c1cccc(c1NC(=O)C)OC 1458a_200010423200_100000210202 [0,2,0,0,0,0|1,0,0]=3 2813 B16R1.19756 CCc1cccc(c1C=C(C)C)C(=O)OC 271570a_100102525489_200009992460 [0,2,0,0,0,0|2,0,0]=4 2814 B16R1.19756 CNC(=O)c1cccc(c1NC(=O)C)OC 240690a_100102657272_200010423200 [0,2,0,0,0,0|1,0,0]=3 2815 B16R1.19756 CNC(=O)c1cccc(c1OC(=O)C)OC 240690a_100102657272_200010007709 [0,2,0,0,0,0|2,0,0]=4 2816 B16R1.19756 COC(=O)c1cccc(c1C=C(C)C)OC 271570a_100102525489_100010189551 [0,2,0,0,0,0|2,0,0]=4 2817 B16R1.19756 COC(=O)c1cccc(c1CC(=O)C)C#N 1458a_100000070787_100010187148 [0,2,0,0,0,0|1,0,0]=3 2818 B16R1.19756 COC(=O)c1cccc(c1CC(=O)C)OC 1458a_100000070787_100010138731 [0,2,0,0,0,0|1,0,0]=3 2819 B16R1.19756 COc1cccc(c1NC(=O)C)C(=O)CF 1458a_200010423200_100015361967 [0,2,0,0,0,0|2,0,0]=4 2820 B14R1.379 C=Cc1cc(cc(c1)NC(=O)C)CC 271570a_100011290941_200011092971 [0,0,1,1,0,0|2,0,0]=4 2821 B14R1.76 COc1cccc(c1)C=NNC(=O)C 4a_100000189765_100000170238 [0,0,1,1,0,0|2,0,0]=4 2822 B14R1.76 COc1cccc(n1)C=NNC(=O)C 4a_100000189765_100000694346 [0,0,1,1,0,0|2,0,0]=4 2823 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)C)Br 1458a_100010710364_200000210301 [0,0,1,1,0,0|2,0,0]=4 2824 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)C)Cl 1458a_200000732520_200000210301 [0,0,1,1,0,0|2,0,0]=4 2825 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)C)O 271570a_203496583355_200016005208 [0,0,1,1,0,0|2,0,0]=4 2826 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)[13CH3])Br 1458a_100010710364_200025704644 [0,0,1,1,0,0|2,0,0]=4 2827 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)[13CH3])Cl 1458a_200000732520_200025704644 [0,0,1,1,0,0|2,0,0]=4 2828 B14R2.535 C=C=Cc1cccc2c1NC(=O)C2 271570a_100015277604_100000767046 [1,0,0,1,0,0|1,0,1]=4 2829 B14R2.535 CC=Cc1cccc2c1CC(=O)C2 271570a_100016259895_100010205903 [1,0,0,1,0,0|2,0,0]=4 2830 B14R2.535 CC=Cc1cccc2c1NC(=O)C2 271570a_100016259895_100000767046 [1,0,0,1,0,0|1,0,0]=3 2831 B14R2.535 CCSc1cccc2c1NC(=O)C2 62a_100000210202_100000767046 [1,0,0,1,0,0|2,0,0]=4 2832 B14R2.1146 CNc1cc(=O)[nH]c2c1cccc2 27a_100102657272_100000075698 [1,0,0,1,0,0|1,0,1]=4 2833 B14R2.1146 COc1cc(nc2c1cccc2)C 34a_100000698765_200000210301 [1,0,0,1,0,0|1,0,1]=4 2834 B14R2.1146 CSc1cc(=O)[nH]c2c1cccc2 62a_200000210301_100000075698 [1,0,0,1,0,0|0,1,1]=4 2835 B14R2.1146 Cc1cc(c2ccccc2n1)O[13CH3] 34a_100000698765_200025704644 [1,0,0,1,0,0|1,0,1]=4 2836 B14R2.1146 [13CH3]Sc1cc(=O)[nH]c2c1cccc2 62a_200025704644_100000075698 [1,0,0,1,0,0|0,1,1]=4 2837 B14R2.9440 CC(=O)Nc1cccc2c1CCC2 11a_100000043548_100015343762 [1,0,0,1,0,0|1,0,1]=4 2838 B14R2.9440 CC(=O)Nc1cccc2c1CCC2 1626a_100000043548_100015343762 [1,0,0,1,0,0|1,0,1]=4 2839 B14R2.9440 CC(=O)Nc1cccc2c1CCC2 22a_100000043548_100000070787 [1,0,0,1,0,0|1,0,1]=4 2840 B14R2.9440 CC(=O)Nc1cccc2c1CCC2 527a_100000043548_100103153847 [1,0,0,1,0,0|1,0,1]=4 2841 B14R2.9440 CC(=O)Nc1cccc2c1COC2 11a_100000125316_100015343762 [1,0,0,1,0,0|0,0,1]=3 2842 B14R2.9440 CC(=O)Nc1cccc2c1COC2 1626a_100000125316_100015343762 [1,0,0,1,0,0|0,0,1]=3 2843 B14R2.9440 CC(=O)Nc1cccc2c1COC2 22a_100000125316_100000070787 [1,0,0,1,0,0|0,0,1]=3 2844 B14R2.9440 CC(=O)Nc1cccc2c1COC2 527a_100000125316_100103153847 [1,0,0,1,0,0|0,0,1]=3 2845 B14R2.9440 CC(=O)Nc1cccc2c1OCC2 11a_100000102157_100015343762 [1,0,0,1,0,0|2,0,0]=4 2846 B14R2.9440 CC(=O)Nc1cccc2c1OCC2 1626a_100000102157_100015343762 [1,0,0,1,0,0|2,0,0]=4 2847 B14R2.9440 CC(=O)Nc1cccc2c1OCC2 22a_100000102157_100000070787 [1,0,0,1,0,0|2,0,0]=4 2848 B14R2.9440 CC(=O)Nc1cccc2c1OCC2 527a_100000102157_100103153847 [1,0,0,1,0,0|2,0,0]=4 2849 B14R2.9440 CC(=O)Nc1cccc2c1cc[nH]2 11a_100011218720_100015343762 [1,0,0,1,0,0|2,0,0]=4 2850 B14R2.9440 CC(=O)Nc1cccc2c1cc[nH]2 1626a_100011218720_100015343762 [1,0,0,1,0,0|2,0,0]=4 2851 B14R2.9440 CC(=O)Nc1cccc2c1cc[nH]2 22a_100011218720_100000070787 [1,0,0,1,0,0|2,0,0]=4 2852 B14R2.9440 CC(=O)Nc1cccc2c1cc[nH]2 527a_100011218720_100103153847 [1,0,0,1,0,0|2,0,0]=4 2853 B14R2.9440 CC(=O)Nc1cccc2c1ccs2 11a_100020628958_100015343762 [1,0,0,1,0,0|2,0,0]=4 2854 B14R2.9440 CC(=O)Nc1cccc2c1ccs2 1626a_100020628958_100015343762 [1,0,0,1,0,0|2,0,0]=4 2855 B14R2.9440 CC(=O)Nc1cccc2c1ccs2 22a_100020628958_100000070787 [1,0,0,1,0,0|2,0,0]=4 2856 B14R2.9440 CC(=O)Nc1cccc2c1cn[nH]2 527a_100000046203_100103153847 [1,0,0,1,0,0|2,0,0]=4 2857 B14R2.9440 CC(=O)Nc1cccc2c1non2 11a_100000028140_100015343762 [1,0,0,1,0,0|2,0,0]=4 2858 B14R2.9440 CC(=O)Nc1cccc2c1non2 1626a_100000028140_100015343762 [1,0,0,1,0,0|2,0,0]=4 2859 B14R2.9577 CC(=O)Nc1ccccc1C2CC2 11a_100011236190_100015343762 [1,0,0,1,0,0|1,0,1]=4 2860 B14R2.9577 CC(=O)Nc1ccccc1C2CC2 1626a_100011236190_100015343762 [1,0,0,1,0,0|1,0,1]=4 2861 B14R2.9577 CC(=O)Nc1ccccc1C2CC2 22a_100011236190_100000070787 [1,0,0,1,0,0|1,0,1]=4 2862 B14R2.9577 CC(=O)Nc1ccccc1C2CC2 271570a_100011220607_100000153524 [1,0,0,1,0,0|1,0,1]=4 2863 B14R2.536 CC=Cc1cccc2c1C(=O)CC2 271570a_100016259895_100009816781 [1,0,0,1,0,0|2,0,0]=4 2864 B14R2.536 CC=Cc1cccc2c1C(=O)NC2 271570a_100016259895_100000724024 [1,0,0,1,0,0|2,0,0]=4 2865 B14R2.536 CC=Cc1cccc2c1C(=O)OC2 271570a_100016259895_100010132333 [1,0,0,1,0,0|1,0,0]=3 2866 B14R2.536 CCSc1cccc2c1C(=O)OC2 62a_100010132333_100000210202 [1,0,0,1,0,0|1,0,1]=4 2867 B14R2.10655 COC(=O)c1ccccc1C2CC2 271570a_100011220607_100000148710 [1,0,0,1,0,0|1,0,1]=4 2868 B14R2.10782 CCC(=O)c1cccc2c1[nH]cc2 1458a_100000027293_100000210202 [1,0,0,1,0,0|1,0,1]=4 2869 B14R2.10782 CNC(=O)c1cccc2c1[nH]cc2 11a_106832991635_100000027293 [1,0,0,1,0,0|1,0,1]=4 2870 B14R2.10782 CNC(=O)c1cccc2c1[nH]cc2 240690a_100102657272_100000027293 [1,0,0,1,0,0|1,0,1]=4 2871 B14R2.10782 CNC(=O)c1cccc2c1[nH]cc2 527a_100102657272_100000027293 [1,0,0,1,0,0|1,0,1]=4 2872 B14R2.17474 CC1(C(=O)Nc2c1cccc2)O[13CH3] 34a_100000695988_200025704644 [1,0,0,1,0,0|1,0,1]=4 2873 B14R2.17474 COC1(C(=O)Nc2c1cccc2)C 34a_100000695988_200000210301 [1,0,0,1,0,0|1,0,1]=4 2874 B14R2.712 C=C(C)c1cccc2c1CC(=O)C2 271570a_100000694244_100010205903 [1,0,0,1,0,0|2,0,0]=4 2875 B14R2.712 C=C(C)c1cccc2c1NC(=O)C2 271570a_100000694244_100000767046 [1,0,0,1,0,0|1,0,0]=3 2876 B14R2.712 CC(=O)c1cccc2c1oc(n2)C 1458a_100011934341_200000210301 [1,0,0,1,0,0|2,0,0]=4 2877 B14R2.712 Cc1nc2cccc(c2o1)C(=O)[13CH3] 1458a_100011934341_200025704644 [1,0,0,1,0,0|2,0,0]=4 2878 B14R2.25733 CC(=O)C1CC(=O)c2c1cccc2 1458a_100000070787_100010208147 [1,0,0,1,0,0|1,0,0]=3 2879 B14R2.25733 CC(=O)n1cc(c2c1cccc2)O 271570a_203496583355_100010365038 [1,0,0,1,0,0|1,0,0]=3 2880 B14R2.24350 C=C(C)c1cccc2c1C(=O)CC2 271570a_100000694244_100009816781 [0,0,0,1,1,0|2,0,0]=4 2881 B14R2.24350 C=C(C)c1cccc2c1C(=O)NC2 271570a_100000694244_100000724024 [0,0,0,1,1,0|2,0,0]=4 2882 B14R2.24350 C=C(C)c1cccc2c1C(=O)OC2 271570a_100000694244_100010132333 [0,0,0,1,1,0|1,0,0]=3 2883 B14R2.24350 CC(=O)c1cccc2c1C(=O)NC2 1458a_100000103835_200000210301 [0,0,0,1,1,0|1,0,0]=3 2884 B14R2.24350 [13CH3]C(=O)c1cccc2c1C(=O)NC2 1458a_100000103835_200025704644 [0,0,0,1,1,0|1,0,0]=3 2885 B16R2.24414 CC(=O)Cn1ccc(=O)c2c1cccc2 1458a_100000745096_200000210301 [0,0,0,1,0,1|1,0,1]=4 2886 B16R2.24414 [13CH3]C(=O)Cn1ccc(=O)c2c1cccc2 1458a_100000745096_200025704644 [0,0,0,1,0,1|1,0,1]=4 2887 B16R2.34081 COC(=O)c1ccccc1CNC2CC2 34a_100000212008_100000744672 [0,0,0,1,0,1|1,0,1]=4 2888 B16R2.97896 C=C(C)CSc1cccc2c1C(=O)OC2 62a_100010132333_100000211660 [0,0,0,1,0,1|2,0,0]=4 2889 B16R2.97896 NC(=O)CSc1cccc2c1C(=O)OC2 62a_100010132333_100000747473 [0,0,0,1,0,1|2,0,0]=4 2890 B16R2.97896 O=C([O-])CSc1cccc2c1C(=O)OC2 62a_100010132333_100020667443 [0,0,0,1,0,1|2,0,0]=4 2891 B16R2.1618 COc1cc(c2ccccc2c1)C(=O)C 1458a_100010090016_200000210301 [0,0,0,1,0,1|2,0,0]=4 2892 B16R2.1618 COc1cc(c2ccccc2c1)C(=O)[13CH3] 1458a_100010090016_200025704644 [0,0,0,1,0,1|2,0,0]=4 2893 B16R2.12129 CC(=O)Nc1cccc2c1NC(=O)CO2 11a_100000070307_100015343762 [0,0,0,1,0,1|2,0,0]=4 2894 B16R2.12129 CC(=O)Nc1cccc2c1NC(=O)CO2 1626a_100000070307_100015343762 [0,0,0,1,0,1|2,0,0]=4 2895 B16R2.12129 CC(=O)Nc1cccc2c1NC(=O)CO2 22a_100000070307_100000070787 [0,0,0,1,0,1|2,0,0]=4 2896 B16R2.33576 CCC(=O)Nc1cccc2c1[nH]c(=O)[nH]2 11a_100000723059_100000210414 [0,0,0,1,0,1|2,0,0]=4 2897 B16R2.33576 CCC(=O)Nc1cccc2c1[nH]c(=O)[nH]2 22a_100000723059_100000210414 [0,0,0,1,0,1|2,0,0]=4 2898 B16R2.33576 CCC(=O)Nc1cccc2c1[nH]c(=O)[nH]2 527a_100000723059_100000210414 [0,0,0,1,0,1|2,0,0]=4 2899 B16R2.33576 COC(C)Sc1cccc2c1NC(=O)C2 62a_100009879195_100000767046 [0,0,0,1,0,1|1,0,1]=4 2900 B16R2.518 CC(=O)Cc1ccccc1C2=CCOC2 271570a_100009872500_100011350739 [0,1,0,1,0,0|2,0,0]=4 2901 B16R2.518 CC(=O)Cc1ccccc1C2=COCC2 271570a_100000118173_100011350739 [0,1,0,1,0,0|2,0,0]=4 2902 B16R2.518 CC(=O)Nc1ccccc1C2=CCCC2 271570a_100000089523_100000153524 [0,1,0,1,0,0|2,0,0]=4 2903 B16R2.518 CC(=O)Nc1ccccc1C2=CCOC2 271570a_100009872500_100000153524 [0,1,0,1,0,0|1,0,0]=3 2904 B16R2.518 CC(=O)Nc1ccccc1C2=COCC2 271570a_100000118173_100000153524 [0,1,0,1,0,0|1,0,0]=3 2905 B16R2.518 CC(=O)Nc1ccccc1C2OCCO2 11a_100009840632_100015343762 [0,1,0,1,0,0|0,0,2]=4 2906 B16R2.518 CC(=O)Nc1ccccc1C2OCCO2 1626a_100009840632_100015343762 [0,1,0,1,0,0|0,0,2]=4 2907 B16R2.518 CC(=O)Nc1ccccc1c2ccco2 11a_200020605208_100015343762 [0,1,0,1,0,0|1,0,1]=4 2908 B16R2.518 CC(=O)Nc1ccccc1c2ccco2 1626a_200020605208_100015343762 [0,1,0,1,0,0|1,0,1]=4 2909 B16R2.518 CC(=O)Nc1ccccc1c2ccco2 22a_200020605208_100000070787 [0,1,0,1,0,0|1,0,1]=4 2910 B16R2.518 CC(=O)Nc1ccccc1c2ccco2 271570a_100000043321_100009814098 [0,1,0,1,0,0|1,0,1]=4 2911 B16R2.518 CC(=O)Nc1ccccc1c2ccco2 271570a_100000750936_100000153524 [0,1,0,1,0,0|1,0,1]=4 2912 B16R2.518 CC(=O)Nc1ccccc1c2ccoc2 271570a_100000043321_100011215275 [0,1,0,1,0,0|1,0,1]=4 2913 B16R2.518 CC(=O)Nc1ccccc1c2ccoc2 271570a_100011218838_100000153524 [0,1,0,1,0,0|1,0,1]=4 2914 B16R2.518 CC(=O)Nc1ccccc1c2cnco2 11a_100000068810_100015343762 [0,1,0,1,0,0|1,0,1]=4 2915 B16R2.518 CC(=O)Nc1ccccc1c2cnco2 1626a_100000068810_100015343762 [0,1,0,1,0,0|1,0,1]=4 2916 B16R2.518 CC(=O)Nc1ccccc1c2cnco2 22a_100000068810_100000070787 [0,1,0,1,0,0|1,0,1]=4 2917 B16R2.518 CC(=O)Nc1ccccc1c2cnco2 271570a_100000043321_100020591547 [0,1,0,1,0,0|1,0,1]=4 2918 B16R2.518 CC(=O)Nc1ccccc1c2cnoc2 271570a_100000043321_100009815712 [0,1,0,1,0,0|2,0,0]=4 2919 B16R2.518 CC(=O)Nc1ccccc1c2ncco2 271570a_100000043321_100011787736 [0,1,0,1,0,0|1,0,1]=4 2920 B16R2.518 CC(=O)Nc1ccncc1C2=CCOC2 271570a_100009872500_100016132053 [0,1,0,1,0,0|2,0,0]=4 2921 B16R2.518 CC(=O)Nc1ccncc1C2=COCC2 271570a_100000118173_100016132053 [0,1,0,1,0,0|2,0,0]=4 2922 B16R2.518 CC(=O)Oc1ccccc1C2=CCOC2 271570a_100009872500_100000051690 [0,1,0,1,0,0|2,0,0]=4 2923 B16R2.518 CC(=O)Oc1ccccc1C2=COCC2 271570a_100000118173_100000051690 [0,1,0,1,0,0|2,0,0]=4 2924 B16R2.518 NC(=O)Nc1ccccc1C2=CCOC2 271570a_100009872500_100000742221 [0,1,0,1,0,0|2,0,0]=4 2925 B16R2.518 NC(=O)Nc1ccccc1C2=COCC2 271570a_100000118173_100000742221 [0,1,0,1,0,0|2,0,0]=4 2926 B16R2.39178 COc1ccc(c2c1cccc2)C(=O)C 1458a_100000198496_200000210301 [0,1,0,1,0,0|2,0,0]=4 2927 B16R2.39178 COc1ccc(c2c1cccc2)C(=O)[13CH3] 1458a_100000198496_200025704644 [0,1,0,1,0,0|2,0,0]=4 2928 B16R2.16076 CC(=O)Nc1cccc2c1C(=O)NC2=O 11a_100000183242_100015343762 [0,1,0,1,0,0|1,0,1]=4 2929 B16R2.16076 CC(=O)Nc1cccc2c1C(=O)NC2=O 1626a_100000183242_100015343762 [0,1,0,1,0,0|1,0,1]=4 2930 B16R2.16076 CC(=O)Nc1cccc2c1c(nn2C)Br 11a_100010235561_100015343762 [0,1,0,1,0,0|2,0,0]=4 2931 B16R2.16076 CC(=O)Nc1cccc2c1c(nn2C)Br 1626a_100010235561_100015343762 [0,1,0,1,0,0|2,0,0]=4 2932 B16R2.16076 CC(=O)Nc1cccc2c1c(nn2C)Br 22a_100010235561_100000070787 [0,1,0,1,0,0|2,0,0]=4 2933 B16R2.16076 CC(=O)Nc1cccc2c1c(nn2C)Br 527a_100010235561_100103153847 [0,1,0,1,0,0|2,0,0]=4 2934 B16R2.18974 CC=Cc1cn(c2c1cccc2)C(=O)C 271570a_100016259895_100010365038 [0,1,0,1,0,0|2,0,0]=4 2935 B16R2.29743 CCNC(=O)c1cccc2c1NC(=O)C2 240690a_100015525214_100000082743 [0,1,0,1,0,0|1,0,0]=3 2936 B16R2.29743 CNNC(=O)c1cccc2c1NC(=O)C2 22a_100016993582_100000082743 [0,1,0,1,0,0|1,0,0]=3 2937 B16R2.29775 CONC(=O)c1ccccc1NC2CC2 34a_100011599994_100000211595 [0,1,0,1,0,0|1,0,1]=4 2938 B16R2.35045 C=C(c1ccccc1NC(=O)C)C2CC2 271570a_100010895485_100000153524 [0,1,0,1,0,0|2,0,0]=4 2939 B16R2.173205 COC(=O)c1cc(cc2c1CC(=O)N2)O 271570a_203496583355_100010967734 [0,1,0,1,0,0|2,0,0]=4 2940 B16R2.173205 COC(=O)c1cc(cc2c1NC(=O)C2)O 271570a_203496583355_200010195938 [0,1,0,1,0,0|0,0,0]=2 2941 B16R2.241316 CC(=O)n1cc(c2c1ccc(c2)Br)O[13CH3] 34a_100009812741_200025704644 [0,1,0,1,0,0|1,0,0]=3 2942 B16R2.241316 COc1cn(c2c1cc(cc2)Br)C(=O)C 34a_100009812741_200000210301 [0,1,0,1,0,0|1,0,0]=3 2943 B16R2.34080 COC(=O)c1ccccc1N(C)C2CC2 269982a_100000170468_100000211595 [0,1,0,1,0,0|1,0,1]=4 2944 B16R2.34080 COC(=O)c1ccccc1N(C)C2CC2 34a_100000170468_100000211595 [0,1,0,1,0,0|1,0,1]=4 2945 B16R2.97895 CC(=C(C)c1cccc2c1C(=O)OC2)C 271570a_200000049429_100010132333 [0,1,0,1,0,0|2,0,0]=4 2946 B16R2.231 CC(=C(C)c1cccc2c1NC(=O)C2)C 271570a_200000049429_100000767046 [0,1,0,1,0,0|2,0,0]=4 2947 B16R2.231 CN(C)C(=O)c1cccc2c1NC(=O)C2 240690a_100102631434_100000082743 [0,1,0,1,0,0|1,0,0]=3 2948 B16R2.400351 C=C(C)c1cn(c2c1cccc2)C(=O)C 271570a_100000694244_100010365038 [0,1,0,1,0,0|2,0,0]=4 2949 B16R2.1948 CNc1nc2c(cccc2s1)C(=O)OC 27a_100102657272_100010739869 [0,1,0,1,0,0|0,1,1]=4 2950 B16R2.33577 C=CC(=O)Nc1cccc2c1C(=O)NC2 1626a_100000026006_100000185746 [0,1,0,1,0,0|1,0,1]=4 2951 B16R2.33577 CCC(=O)Nc1cccc2c1C(=O)NC2 11a_100000026006_100000210414 [0,1,0,1,0,0|1,0,0]=3 2952 B16R2.33577 CCC(=O)Nc1cccc2c1C(=O)NC2 1626a_100000026006_100000210414 [0,1,0,1,0,0|1,0,0]=3 2953 B16R2.33577 CNC(=O)Nc1cccc2c1C(=O)NC2 512a_100000026006_100102657272 [0,1,0,1,0,0|1,0,0]=3 2954 B16R2.172725 CCC(=O)c1cccc2c1[nH]c(c2C)C 1458a_200000030981_100000210202 [0,1,0,1,0,0|2,0,0]=4 2955 B16R2.172725 CNC(=O)c1cccc2c1[nH]c(c2C)C 11a_106832991635_200000030981 [0,1,0,1,0,0|2,0,0]=4 2956 B16R2.172725 CNC(=O)c1cccc2c1[nH]c(c2C)C 240690a_100102657272_200000030981 [0,1,0,1,0,0|2,0,0]=4 2957 B16R2.172725 CNC(=O)c1cccc2c1[nH]c(c2C)C 527a_100102657272_200000030981 [0,1,0,1,0,0|2,0,0]=4 2958 B16R2.172757 CCC(=O)c1cccc2c1NC(=O)CO2 1458a_100009852551_100000210202 [0,1,0,1,0,0|1,0,0]=3 2959 B16R2.172757 CNC(=O)c1cccc2c1NC(=O)CO2 11a_106832991635_100009852551 [0,1,0,1,0,0|1,0,0]=3 2960 B16R2.172757 CNC(=O)c1cccc2c1NC(=O)CO2 1626a_100102657272_100009852551 [0,1,0,1,0,0|1,0,0]=3 2961 B16R2.172757 CNC(=O)c1cccc2c1NC(=O)CO2 240690a_100102657272_100009852551 [0,1,0,1,0,0|1,0,0]=3 2962 B16R2.172757 CNC(=O)c1cccc2c1NC(=O)CO2 527a_100102657272_100009852551 [0,1,0,1,0,0|1,0,0]=3 2963 B16R2.172757 O=C1COc2cccc(c2N1)C(=O)CF 1458a_100009852551_100015361967 [0,1,0,1,0,0|2,0,0]=4 2964 B16R2.97971 CS(=O)(=O)Nc1cccc2c1C(=O)NC2 40a_100000026006_100000738038 [0,1,0,1,0,0|2,0,0]=4 2965 B12R1.291 CC=Cc1cc[nH]c1C(=O)OC 271570a_100016259895_100102525103 [1,0,0,0,1,0|2,0,0]=4 2966 B12R1.291 CC=Cc1ccoc1C(=O)OC 271570a_100016259895_100012676306 [1,0,0,0,1,0|2,0,0]=4 2967 B12R1.291 CC=Cc1ccsc1C(=O)OC 271570a_100016259895_100000730364 [1,0,0,0,1,0|2,0,0]=4 2968 B12R1.291 CC=Cc1cscc1C(=O)OC 271570a_100016259895_100012351140 [1,0,0,0,1,0|2,0,0]=4 2969 B12R1.291 CC=Cc1occc1C(=O)OC 271570a_100016259895_100011935261 [1,0,0,0,1,0|2,0,0]=4 2970 B12R1.291 CC=Cc1sccc1C(=O)OC 271570a_100016259895_100009822520 [1,0,0,0,1,0|2,0,0]=4 2971 B12R1.261 C=C(C)c1ccccc1C(=O)C 271570a_100000694244_100000751169 [1,0,0,0,1,0|1,0,0]=3 2972 B12R1.261 C=C(C)c1ccccc1C(=O)N 271570a_100000694244_100000162227 [1,0,0,0,1,0|2,0,0]=4 2973 B12R1.261 C=C(C)c1ccccc1S(=O)C 271570a_100000694244_100000734199 [1,0,0,0,1,0|2,0,0]=4 2974 B12R1.261 C=C(C)c1cccnc1C(=O)C 271570a_100000694244_100012348690 [1,0,0,0,1,0|2,0,0]=4 2975 B12R1.261 C=C(C)c1ccncc1C(=O)C 271570a_100000694244_100160469449 [1,0,0,0,1,0|2,0,0]=4 2976 B12R1.261 C=C(C)c1cnccc1C(=O)C 271570a_100000694244_100009993184 [1,0,0,0,1,0|2,0,0]=4 2977 B12R1.261 C=C(C)c1ncccc1C(=O)C 271570a_100000694244_100000753718 [1,0,0,0,1,0|2,0,0]=4 2978 B12R1.261 CC(=O)c1ccccc1C(C)C 1458a_100011941426_200000210301 [1,0,0,0,1,0|1,0,1]=4 2979 B12R1.261 CC(=O)c1ccccc1I(=O)=O 1458a_100000061294_200000210301 [1,0,0,0,1,0|1,0,1]=4 2980 B12R1.261 CC(=O)c1ccccc1N(C)C 1458a_100011218752_200000210301 [1,0,0,0,1,0|2,0,0]=4 2981 B12R1.261 CC(=O)c1ccccc1S(=O)C 1458a_100000204632_200000210301 [1,0,0,0,1,0|1,0,0]=3 2982 B12R1.261 CC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_200000210301 [1,0,0,0,1,0|1,0,1]=4 2983 B12R1.261 CC(C)c1ccccc1C(=O)[13CH3] 1458a_100011941426_200025704644 [1,0,0,0,1,0|1,0,1]=4 2984 B12R1.261 CN(C)c1ccccc1C(=O)[13CH3] 1458a_100011218752_200025704644 [1,0,0,0,1,0|2,0,0]=4 2985 B12R1.261 CS(=O)c1ccccc1C(=O)[13CH3] 1458a_100000204632_200025704644 [1,0,0,0,1,0|1,0,0]=3 2986 B12R1.261 [13CH3]C(=O)c1ccccc1I(=O)=O 1458a_100000061294_200025704644 [1,0,0,0,1,0|1,0,1]=4 2987 B12R1.261 [13CH3]C(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_200025704644 [1,0,0,0,1,0|1,0,1]=4 2988 B12R1.368 C=C(C)c1cc[nH]c1C(=O)OC 271570a_100000694244_100102525103 [0,0,0,0,2,0|2,0,0]=4 2989 B12R1.368 C=C(C)c1ccoc1C(=O)OC 271570a_100000694244_100012676306 [0,0,0,0,2,0|2,0,0]=4 2990 B12R1.368 C=C(C)c1ccsc1C(=O)OC 271570a_100000694244_100000730364 [0,0,0,0,2,0|2,0,0]=4 2991 B12R1.368 C=C(C)c1cscc1C(=O)OC 271570a_100000694244_100012351140 [0,0,0,0,2,0|2,0,0]=4 2992 B12R1.368 C=C(C)c1occc1C(=O)OC 271570a_100000694244_100011935261 [0,0,0,0,2,0|2,0,0]=4 2993 B12R1.368 C=C(C)c1sccc1C(=O)OC 271570a_100000694244_100009822520 [0,0,0,0,2,0|2,0,0]=4 2994 B14R1.482 C=C=Cc1ccccc1CNC(=O)C 271570a_100015277604_100011237613 [1,0,0,0,0,1|1,0,1]=4 2995 B14R1.482 CC=Cc1ccccc1CNC(=O)C 271570a_100016259895_100011237613 [1,0,0,0,0,1|1,0,0]=3 2996 B14R1.482 CCOc1ccccc1CNC(=O)C 11a_100000188671_100015343762 [1,0,0,0,0,1|2,0,0]=4 2997 B14R1.482 CCOc1ccccc1CNC(=O)C 1626a_100000188671_100015343762 [1,0,0,0,0,1|2,0,0]=4 2998 B14R1.482 CCOc1ccccc1CNC(=O)C 240690a_100000188671_100015343762 [1,0,0,0,0,1|2,0,0]=4 2999 B14R1.482 CCOc1ccccc1CNC(=O)C 34a_200011628774_100000210202 [1,0,0,0,0,1|2,0,0]=4 3000 B14R1.482 CCOc1ccccc1CNC(=O)C 527a_100000188671_100103153847 [1,0,0,0,0,1|2,0,0]=4 3001 B14R1.482 CCOc1ccccc1CNC(=O)C 7a_200011628774_100000210202 [1,0,0,0,0,1|2,0,0]=4 3002 B14R1.482 CCOc1ccccc1NNC(=O)C 22a_200020603589_100000070787 [1,0,0,0,0,1|2,0,0]=4 3003 B14R1.482 CCSc1ccccc1CNC(=O)C 62a_100000210202_100011237613 [1,0,0,0,0,1|2,0,0]=4 3004 B14R1.482 CCSc1ccccc1CNC(=O)C 62a_100011237613_100000210202 [1,0,0,0,0,1|2,0,0]=4 3005 B14R1.4522 C=C(C)CNc1ccccc1C(=C)C 34a_100000037685_100000748629 [1,0,0,0,0,1|2,0,0]=4 3006 B14R1.4522 C=C(C)CNc1ccccc1C(=O)N 34a_100000185089_100000748629 [1,0,0,0,0,1|2,0,0]=4 3007 B14R1.4522 C=C(C)CNc1ccncc1C(=O)C 27a_100000765925_100160469449 [1,0,0,0,0,1|2,0,0]=4 3008 B14R1.4522 C=C(C)CNc1ncccc1C(=O)C 27a_100000765925_100009816689 [1,0,0,0,0,1|2,0,0]=4 3009 B14R1.4522 C=C(C)COc1ccccc1C(=O)C 1458a_100000217157_200000210301 [1,0,0,0,0,1|2,0,0]=4 3010 B14R1.4522 C=C(C)COc1ccccc1C(=O)[13CH3] 1458a_100000217157_200025704644 [1,0,0,0,0,1|2,0,0]=4 3011 B14R1.4522 C=C(C)CSc1ccccc1C(=O)C 62a_100000751169_100000211660 [1,0,0,0,0,1|2,0,0]=4 3012 B14R1.4522 C=C(C)CSc1ccccc1C(=O)O 62a_100000748629_100000734275 [1,0,0,0,0,1|2,0,0]=4 3013 B14R1.4522 C=C(C)CSc1ccccc1C(=O)O 62a_202125556159_100000211660 [1,0,0,0,0,1|2,0,0]=4 3014 B14R1.4522 C=C(C)c1ccccc1CNC(=O)C 271570a_100000694244_100011237613 [1,0,0,0,0,1|1,0,0]=3 3015 B14R1.4522 C=C(C)c1ccccc1NCC(=O)N 34a_100000037685_100000187820 [1,0,0,0,0,1|2,0,0]=4 3016 B14R1.4522 C=C(C)c1ccccc1NCC(=O)[O-] 34a_100000037685_100020667443 [1,0,0,0,0,1|2,0,0]=4 3017 B14R1.4522 CC(=O)COc1ccccc1C(=O)N 1458a_100000182327_200000210301 [1,0,0,0,0,1|2,0,0]=4 3018 B14R1.4522 CC(=O)NCc1ccccc1N(C)C 11a_100000748089_100015343762 [1,0,0,0,0,1|2,0,0]=4 3019 B14R1.4522 CC(=O)NCc1ccccc1N(C)C 1626a_100000748089_100015343762 [1,0,0,0,0,1|2,0,0]=4 3020 B14R1.4522 CC(=O)NCc1ccccc1N(C)C 240690a_100000748089_100015343762 [1,0,0,0,0,1|2,0,0]=4 3021 B14R1.4522 CC(=O)NCc1ccccc1[N+](=O)[O-] 11a_100000740939_100015343762 [1,0,0,0,0,1|1,0,1]=4 3022 B14R1.4522 CC(=O)NCc1ccccc1[N+](=O)[O-] 240690a_100000740939_100015343762 [1,0,0,0,0,1|1,0,1]=4 3023 B14R1.4522 CC(=O)NCc1ccccc1[N+](=O)[O-] 527a_100000740939_100103153847 [1,0,0,0,0,1|1,0,1]=4 3024 B14R1.4522 CC(=O)NNc1ccccc1C(C)C 22a_100020603696_100000070787 [1,0,0,0,0,1|1,0,1]=4 3025 B14R1.4522 CC(=O)NNc1ccccc1[N+](=O)[O-] 22a_100000737275_100000070787 [1,0,0,0,0,1|1,0,1]=4 3026 B14R1.4522 CC(=O)c1ccccc1SCC(=O)N 1458a_100000180052_200000210301 [1,0,0,0,0,1|2,0,0]=4 3027 B14R1.4522 CC(=O)c1ccccc1SCC(=O)N 62a_100000751169_100000747473 [1,0,0,0,0,1|2,0,0]=4 3028 B14R1.4522 CC(=O)c1ccccc1SCC(=O)[O-] 62a_100000751169_100020667443 [1,0,0,0,0,1|2,0,0]=4 3029 B14R1.4522 CC(C)NCc1ccccc1C(=O)O 269956a_100015183376_100000210206 [1,0,0,0,0,1|1,0,1]=4 3030 B14R1.4522 NC(=O)CNc1ccccc1C(=O)N 34a_100000185089_100000187820 [1,0,0,0,0,1|2,0,0]=4 3031 B14R1.4522 NC(=O)CSc1ccccc1C(=O)O 62a_100000747473_100000734275 [1,0,0,0,0,1|2,0,0]=4 3032 B14R1.4522 NC(=O)CSc1ccccc1C(=O)O 62a_202125556159_100000747473 [1,0,0,0,0,1|2,0,0]=4 3033 B14R1.4522 NC(=O)c1ccccc1NCC(=O)[O-] 34a_100000185089_100020667443 [1,0,0,0,0,1|2,0,0]=4 3034 B14R1.4522 O=C([O-])CSc1ccccc1C(=O)O 62a_100020667443_100000734275 [1,0,0,0,0,1|2,0,0]=4 3035 B14R1.4522 O=C([O-])CSc1ccccc1C(=O)O 62a_202125556159_100020667443 [1,0,0,0,0,1|2,0,0]=4 3036 B14R1.4522 [13CH3]C(=O)COc1ccccc1C(=O)N 1458a_100000182327_200025704644 [1,0,0,0,0,1|2,0,0]=4 3037 B14R1.4522 [13CH3]C(=O)c1ccccc1SCC(=O)N 1458a_100000180052_200025704644 [1,0,0,0,0,1|2,0,0]=4 3038 B14R1.733 CC(=O)Nc1cccc(c1)C(=O)CF 1458a_100000188798_100015361967 [0,0,0,0,1,1|2,0,0]=4 3039 B14R1.733 CCC(=O)c1cccc(c1)NC(=O)C 1458a_100000188798_100000210202 [0,0,0,0,1,1|1,0,0]=3 3040 B14R1.733 CCC(=O)c1cccc(c1)NC(=O)N 1458a_100000199042_100000210202 [0,0,0,0,1,1|2,0,0]=4 3041 B14R1.733 CNC(=O)c1cccc(c1)CC(=O)C 1458a_100000070787_100000755619 [0,0,0,0,1,1|2,0,0]=4 3042 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 11a_100000185133_100015343762 [0,0,0,0,1,1|1,0,0]=3 3043 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 11a_106832991635_100000188798 [0,0,0,0,1,1|1,0,0]=3 3044 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 1626a_100000185133_100015343762 [0,0,0,0,1,1|1,0,0]=3 3045 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 1626a_100102657272_100000188798 [0,0,0,0,1,1|1,0,0]=3 3046 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 22a_100000185133_100000070787 [0,0,0,0,1,1|1,0,0]=3 3047 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 240690a_100102657272_100000188798 [0,0,0,0,1,1|1,0,0]=3 3048 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 527a_100000185133_100103153847 [0,0,0,0,1,1|1,0,0]=3 3049 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 527a_100102657272_100000188798 [0,0,0,0,1,1|1,0,0]=3 3050 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)N 11a_106832991635_100000199042 [0,0,0,0,1,1|2,0,0]=4 3051 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)N 240690a_100102657272_100000199042 [0,0,0,0,1,1|2,0,0]=4 3052 B14R1.733 CNC(=O)c1cccc(c1)OC(=O)C 1626a_100102657272_100000744496 [0,0,0,0,1,1|2,0,0]=4 3053 B14R1.733 CNC(=O)c1cccc(c1)OC(=O)C 240690a_100102657272_100000744496 [0,0,0,0,1,1|2,0,0]=4 3054 B14R1.733 COC(=O)c1cccc(c1)C=C(C)C 271570a_100102525489_100000148679 [0,0,0,0,1,1|2,0,0]=4 3055 B14R1.733 COC(=O)c1cccc(c1)CC(=O)C 1458a_100000070787_100000184886 [0,0,0,0,1,1|1,0,0]=3 3056 B14R1.733 COC(=O)c1cccc(c1)CC(=O)C 1458a_100000111006_200000210301 [0,0,0,0,1,1|1,0,0]=3 3057 B14R1.733 COC(=O)c1cccc(c1)CC(=O)[13CH3] 1458a_100000111006_200025704644 [0,0,0,0,1,1|1,0,0]=3 3058 B14R1.733 COC(=O)c1cccc(c1)NC(=O)C 188690a_100020604953_100015343762 [0,0,0,0,1,1|0,0,0]=2 3059 B14R1.733 COC(=O)c1cccc(n1)C=C(C)C 271570a_100102525489_100000708286 [0,0,0,0,1,1|2,0,0]=4 3060 B14R1.733 COC(=O)c1cccc(n1)CC(=O)C 1458a_100000070787_100000097194 [0,0,0,0,1,1|1,0,0]=3 3061 B14R1.733 COC(=O)c1cccc(n1)NC(C)C 27a_100138425928_100000708286 [0,0,0,0,1,1|1,0,1]=4 3062 B14R1.733 COC(=O)c1ccnc(c1)CC(=O)C 1458a_100000070787_100020667620 [0,0,0,0,1,1|2,0,0]=4 3063 B14R1.733 COC(=O)c1cncc(c1)CC(=O)C 1458a_100000070787_100020633827 [0,0,0,0,1,1|2,0,0]=4 3064 B16R1.1178 C=C(C)CCNc1ccccc1C(=O)NC 34a_100000185696_100000730704 [0,0,0,0,0,2|2,0,0]=4 3065 B16R1.1178 C=C(C)CCOc1ccccc1C(=O)OC 7a_100000150335_100000730704 [0,0,0,0,0,2|2,0,0]=4 3066 B16R1.1178 C=C(C)CCSc1ccccc1C(=O)OC 62a_100000148710_100000730704 [0,0,0,0,0,2|2,0,0]=4 3067 B16R1.1178 C=C(C)CCSc1ccccc1C(=O)OC 62a_100000730704_100000148710 [0,0,0,0,0,2|2,0,0]=4 3068 B16R1.1178 C=C(C)COCc1ccccc1C(=O)OC 34a_100000210245_100000744672 [0,0,0,0,0,2|2,0,0]=4 3069 B16R1.1178 C=C(C)CSCc1ccccc1C(=O)OC 62a_100000744672_100000211660 [0,0,0,0,0,2|2,0,0]=4 3070 B16R1.1178 C=C(C)CSCc1ccccc1C(=O)OC 62a_100000748629_100000744672 [0,0,0,0,0,2|2,0,0]=4 3071 B16R1.1178 CC(=O)CCSc1ccccc1C(=O)O[Na] 62a_100000053229_114855342371 [0,0,0,0,0,2|2,0,0]=4 3072 B16R1.1178 CC(=O)OCSc1ccccc1C(=O)O[Na] 62a_100000076356_114855342371 [0,0,0,0,0,2|2,0,0]=4 3073 B16R1.1178 CCC(=O)c1ccccc1OCCC(=O)C 7a_100000184720_100000053229 [0,0,0,0,0,2|2,0,0]=4 3074 B16R1.1178 CNC(=O)c1ccccc1NCC=C(C)C 27a_100000718196_100000155073 [0,0,0,0,0,2|2,0,0]=4 3075 B16R1.1178 CNC(=O)c1ccccc1NCC=C(C)C 34a_100000185696_100000761012 [0,0,0,0,0,2|2,0,0]=4 3076 B16R1.1178 CNC(=O)c1ccccc1NCCC(=O)N 27a_100000740010_100000155073 [0,0,0,0,0,2|2,0,0]=4 3077 B16R1.1178 CNC(=O)c1ccccc1NCCC(=O)N 34a_100000185696_100000731001 [0,0,0,0,0,2|2,0,0]=4 3078 B16R1.1178 CNC(=O)c1ccccc1NCOC(=O)C 34a_100000185696_100009813279 [0,0,0,0,0,2|1,0,0]=3 3079 B16R1.1178 CNC(=O)c1ccccc1OCCC(=O)C 7a_100000185920_100000053229 [0,0,0,0,0,2|2,0,0]=4 3080 B16R1.1178 CNC(=O)c1ccccc1OCOC(=O)C 34a_100000185920_100009813279 [0,0,0,0,0,2|2,0,0]=4 3081 B16R1.1178 CNC(=O)c1ccccc1SCCC(=O)C 62a_100000053229_100000155073 [0,0,0,0,0,2|2,0,0]=4 3082 B16R1.1178 CNC(=O)c1ccccc1SCCC(=O)C 62a_100000155073_100000053229 [0,0,0,0,0,2|2,0,0]=4 3083 B16R1.1178 CNC(=O)c1ccccc1SCOC(=O)C 62a_100000076356_100000155073 [0,0,0,0,0,2|2,0,0]=4 3084 B16R1.1178 CNC(=O)c1ccccc1SCOC(=O)C 62a_100000155073_100000076356 [0,0,0,0,0,2|2,0,0]=4 3085 B16R1.1178 COC(=O)c1ccccc1C=NNC(=O)C 4a_100000189765_100000006219 [0,0,0,0,0,2|0,0,0]=2 3086 B16R1.1178 COC(=O)c1ccccc1C=NNC(C)C 4a_100000741168_100000006219 [0,0,0,0,0,2|1,0,1]=4 3087 B16R1.1178 COC(=O)c1ccccc1CCNC(=O)C 188690a_100102712930_100015343762 [0,0,0,0,0,2|0,0,0]=2 3088 B16R1.1178 COC(=O)c1ccccc1CCNC(C)C 2230a_100138425928_200010284099 [0,0,0,0,0,2|1,0,1]=4 3089 B16R1.1178 COC(=O)c1ccccc1CCNC(C)C 34a_100138425928_200010284099 [0,0,0,0,0,2|1,0,1]=4 3090 B16R1.1178 COC(=O)c1ccccc1CNCC(=O)N 2230a_100000711301_100000744672 [0,0,0,0,0,2|1,0,0]=3 3091 B16R1.1178 COC(=O)c1ccccc1CNCC(=O)O 269956a_100016091260_100000744672 [0,0,0,0,0,2|1,0,0]=3 3092 B16R1.1178 COC(=O)c1ccccc1CNCC(C)C 2230a_100000210953_100000744672 [0,0,0,0,0,2|1,0,1]=4 3093 B16R1.1178 COC(=O)c1ccccc1CNCC(C)C 34a_100000210953_100000744672 [0,0,0,0,0,2|1,0,1]=4 3094 B16R1.1178 COC(=O)c1ccccc1CNCC(C)O 2230a_100000210904_100000744672 [0,0,0,0,0,2|0,0,2]=4 3095 B16R1.1178 COC(=O)c1ccccc1CNCC(C)O 34a_100000210904_100000744672 [0,0,0,0,0,2|0,0,2]=4 3096 B16R1.1178 COC(=O)c1ccccc1COCC(=O)C 34a_100000211253_100000744672 [0,0,0,0,0,2|1,0,0]=3 3097 B16R1.1178 COC(=O)c1ccccc1CSCC(=O)N 62a_100000744672_100000747473 [0,0,0,0,0,2|2,0,0]=4 3098 B16R1.1178 COC(=O)c1ccccc1CSCC(=O)N 62a_100000747473_100000744672 [0,0,0,0,0,2|2,0,0]=4 3099 B16R1.1178 COC(=O)c1ccccc1CSCC(=O)[O-] 62a_100000744672_100020667443 [0,0,0,0,0,2|2,0,0]=4 3100 B16R1.1178 COC(=O)c1ccccc1CSCC(=O)[O-] 62a_100020667443_100000744672 [0,0,0,0,0,2|2,0,0]=4 3101 B16R1.1178 COC(=O)c1ccccc1OCC=C(C)C 7a_100000150335_100000761012 [0,0,0,0,0,2|2,0,0]=4 3102 B16R1.1178 COC(=O)c1ccccc1OCCC(=O)C 7a_100000150335_100000053229 [0,0,0,0,0,2|1,0,0]=3 3103 B16R1.1178 COC(=O)c1ccccc1OCCC(=O)N 7a_100000150335_100000744528 [0,0,0,0,0,2|2,0,0]=4 3104 B16R1.1178 COC(=O)c1ccccc1SCC=C(C)C 62a_100000148710_100000761012 [0,0,0,0,0,2|2,0,0]=4 3105 B16R1.1178 COC(=O)c1ccccc1SCC=C(C)C 62a_100000761012_100000148710 [0,0,0,0,0,2|2,0,0]=4 3106 B16R1.1178 COC(=O)c1ccccc1SCCC(=O)C 62a_100000053229_100000148710 [0,0,0,0,0,2|1,0,0]=3 3107 B16R1.1178 COC(=O)c1ccccc1SCCC(=O)C 62a_100000148710_100000053229 [0,0,0,0,0,2|1,0,0]=3 3108 B16R1.1178 COC(=O)c1ccccc1SCCC(=O)N 62a_100000148710_100000744528 [0,0,0,0,0,2|2,0,0]=4 3109 B16R1.1178 COC(=O)c1ccccc1SCCC(=O)N 62a_100000744528_100000148710 [0,0,0,0,0,2|2,0,0]=4 3110 B16R1.1178 COC(=O)c1ccccc1SCOC(=O)C 62a_100000076356_100000148710 [0,0,0,0,0,2|1,0,0]=3 3111 B16R1.1178 COC(=O)c1ccccc1SCOC(=O)C 62a_100000148710_100000076356 [0,0,0,0,0,2|1,0,0]=3 3112 B16R1.1178 COC(=O)c1cccnc1C=NNC(=O)C 4a_100000189765_200012002159 [0,0,0,0,0,2|1,0,0]=3 3113 B16R1.1178 COC(=O)c1cccnc1CNCC(=O)N 2230a_100000711301_100000709840 [0,0,0,0,0,2|2,0,0]=4 3114 B16R1.1178 COC(=O)c1cccnc1CNCC(=O)O 269956a_100016091260_100000709840 [0,0,0,0,0,2|2,0,0]=4 3115 B16R1.1178 COC(=O)c1cccnc1COCC(=O)C 34a_100000211253_100012347567 [0,0,0,0,0,2|2,0,0]=4 3116 B16R1.1178 COC(=O)c1cccnc1NCC=C(C)C 27a_100000718196_100000150852 [0,0,0,0,0,2|2,0,0]=4 3117 B16R1.1178 COC(=O)c1cccnc1NCCC(=O)N 27a_100000740010_100000150852 [0,0,0,0,0,2|2,0,0]=4 3118 B16R1.1178 COC(=O)c1cccnc1SCCC(=O)C 62a_100000053229_100000150852 [0,0,0,0,0,2|2,0,0]=4 3119 B16R1.1178 COC(=O)c1cccnc1SCCC(=O)C 62a_100011587185_100000053229 [0,0,0,0,0,2|2,0,0]=4 3120 B16R1.1178 COC(=O)c1cccnc1SCOC(=O)C 62a_100000076356_100000150852 [0,0,0,0,0,2|2,0,0]=4 3121 B16R1.1178 COC(=O)c1cccnc1SCOC(=O)C 62a_100011587185_100000076356 [0,0,0,0,0,2|2,0,0]=4 3122 B16R1.1178 COC(=O)c1ccncc1SCCC(=O)C 62a_100000053229_100010008606 [0,0,0,0,0,2|2,0,0]=4 3123 B16R1.1178 COC(=O)c1ccncc1SCCC(=O)C 62a_100010008606_100000053229 [0,0,0,0,0,2|2,0,0]=4 3124 B16R1.1178 COC(=O)c1ccncc1SCOC(=O)C 62a_100000076356_100010008606 [0,0,0,0,0,2|2,0,0]=4 3125 B16R1.1178 COC(=O)c1ccncc1SCOC(=O)C 62a_100010008606_100000076356 [0,0,0,0,0,2|2,0,0]=4 3126 B16R1.1178 COC(=O)c1cnccc1SCCC(=O)C 62a_100000053229_100020629055 [0,0,0,0,0,2|2,0,0]=4 3127 B16R1.1178 COC(=O)c1cnccc1SCCC(=O)C 62a_100020629055_100000053229 [0,0,0,0,0,2|2,0,0]=4 3128 B16R1.1178 COC(=O)c1cnccc1SCOC(=O)C 62a_100000076356_100020629055 [0,0,0,0,0,2|2,0,0]=4 3129 B16R1.1178 COC(=O)c1cnccc1SCOC(=O)C 62a_100020629055_100000076356 [0,0,0,0,0,2|2,0,0]=4 3130 B16R1.1178 COC(=O)c1ncccc1CNCC(=O)N 2230a_100000711301_100010177730 [0,0,0,0,0,2|2,0,0]=4 3131 B16R1.1178 COC(=O)c1ncccc1COCC(=O)C 34a_100000211253_100010177730 [0,0,0,0,0,2|2,0,0]=4 3132 B16R1.1178 COC(=O)c1ncccc1OCCC(=O)C 7a_100000744052_100000053229 [0,0,0,0,0,2|2,0,0]=4 3133 B16R1.1178 COC(=O)c1ncccc1OCOC(=O)C 34a_100000744052_100009813279 [0,0,0,0,0,2|2,0,0]=4 3134 B16R1.1178 COC(=O)c1ncccc1SCCC(=O)C 62a_100000053229_100011935214 [0,0,0,0,0,2|2,0,0]=4 3135 B16R1.1178 COC(=O)c1ncccc1SCCC(=O)C 62a_100011935214_100000053229 [0,0,0,0,0,2|2,0,0]=4 3136 B16R1.1178 COC(=O)c1ncccc1SCOC(=O)C 62a_100000076356_100011935214 [0,0,0,0,0,2|2,0,0]=4 3137 B16R1.1178 COC(=O)c1ncccc1SCOC(=O)C 62a_100011935214_100000076356 [0,0,0,0,0,2|2,0,0]=4 3138 B16R1.4413 C=C(C)CNc1ccccc1CC(=O)NC 2230a_100000738506_100000748629 [0,0,0,0,0,2|2,0,0]=4 3139 B16R1.4413 C=C(C)CNc1ccccc1CC(=O)NC 34a_100000738506_100000748629 [0,0,0,0,0,2|2,0,0]=4 3140 B16R1.4413 C=C(C)COc1ccccc1CC(=O)OC 7a_100000758901_100000748629 [0,0,0,0,0,2|2,0,0]=4 3141 B16R1.4413 C=C(C)CSc1ccccc1CC(=O)OC 62a_100000699816_100000211660 [0,0,0,0,0,2|2,0,0]=4 3142 B16R1.4413 C=C(C)CSc1ccccc1CC(=O)OC 62a_100000748629_100000699816 [0,0,0,0,0,2|2,0,0]=4 3143 B16R1.4413 C=C(C)CSc1ccccc1NC(=O)OC 62a_100000748629_100000216184 [0,0,0,0,0,2|2,0,0]=4 3144 B16R1.4413 CNC(=O)Cc1ccccc1NCC(=O)N 2230a_100000738506_100000747473 [0,0,0,0,0,2|2,0,0]=4 3145 B16R1.4413 CNC(=O)Cc1ccccc1NCC(=O)N 34a_100000738506_100000187820 [0,0,0,0,0,2|2,0,0]=4 3146 B16R1.4413 CNC(=O)Cc1ccccc1NCC(=O)[O-] 34a_100000738506_100020667443 [0,0,0,0,0,2|2,0,0]=4 3147 B16R1.4413 COC(=O)Cc1ccccc1CNC(C)C 2230a_100138425928_100000094086 [0,0,0,0,0,2|1,0,1]=4 3148 B16R1.4413 COC(=O)Cc1ccccc1CNC(C)C 34a_100138425928_100000094086 [0,0,0,0,0,2|1,0,1]=4 3149 B16R1.4413 COC(=O)Cc1ccccc1OCC(=O)N 7a_100000758901_100000187820 [0,0,0,0,0,2|2,0,0]=4 3150 B16R1.4413 COC(=O)Cc1ccccc1SCC(=O)N 62a_100000699816_100000747473 [0,0,0,0,0,2|2,0,0]=4 3151 B16R1.4413 COC(=O)Cc1ccccc1SCC(=O)N 62a_100000747473_100000699816 [0,0,0,0,0,2|2,0,0]=4 3152 B16R1.4413 COC(=O)Cc1ccccc1SCC(=O)[O-] 62a_100000699816_100020667443 [0,0,0,0,0,2|2,0,0]=4 3153 B16R1.4413 COC(=O)Cc1ccccc1SCC(=O)[O-] 62a_100020667443_100000699816 [0,0,0,0,0,2|2,0,0]=4 3154 B16R1.4413 COC(=O)Nc1ccccc1SCC(=O)N 62a_100000747473_100000216184 [0,0,0,0,0,2|2,0,0]=4 3155 B16R1.4413 COC(=O)Nc1ccccc1SCC(=O)[O-] 62a_100020667443_100000216184 [0,0,0,0,0,2|2,0,0]=4 3156 B16R1.4413 COC(C)Sc1ccccc1CNC(=O)C 62a_100009879195_100011237613 [0,0,0,0,0,2|1,0,1]=4 3157 B16R1.4413 COC(C)Sc1ccccc1CNC(=O)C 62a_100011237613_100009879195 [0,0,0,0,0,2|1,0,1]=4 3158 B16R1.1330 CC(=O)Nc1ccccc1C=CC(=O)CF 1458a_200016992062_100015361967 [0,0,0,0,0,2|2,0,0]=4 3159 B16R1.1330 CC(=O)Nc1ccccc1OCC(=O)CF 1458a_100011204883_100015361967 [0,0,0,0,0,2|2,0,0]=4 3160 B16R1.1330 CC(=O)Nc1ccccc1SCC(=O)CF 1458a_100000027783_100015361967 [0,0,0,0,0,2|2,0,0]=4 3161 B16R1.1330 CCC(=O)C=Cc1ccccc1NC(=O)C 1458a_200016992062_100000210202 [0,0,0,0,0,2|1,0,0]=3 3162 B16R1.1330 CCC(=O)COc1ccccc1NC(=O)C 1458a_100011204883_100000210202 [0,0,0,0,0,2|1,0,0]=3 3163 B16R1.1330 CCC(=O)COc1ccccc1NC(=O)C 7a_100000185124_100000747405 [0,0,0,0,0,2|1,0,0]=3 3164 B16R1.1330 CCC(=O)COc1cccnc1NC(=O)C 7a_200000022013_100000747405 [0,0,0,0,0,2|2,0,0]=4 3165 B16R1.1330 CCC(=O)CSc1ccccc1CC(=O)C 62a_100000747405_100011350739 [0,0,0,0,0,2|2,0,0]=4 3166 B16R1.1330 CCC(=O)CSc1ccccc1CC(=O)C 62a_100011350739_100000747405 [0,0,0,0,0,2|2,0,0]=4 3167 B16R1.1330 CCC(=O)CSc1ccccc1NC(=O)C 1458a_100000027783_100000210202 [0,0,0,0,0,2|1,0,0]=3 3168 B16R1.1330 CCC(=O)CSc1ccccc1NC(=O)C 62a_100000747405_100000153524 [0,0,0,0,0,2|1,0,0]=3 3169 B16R1.1330 CCC(=O)CSc1ccccc1NC(=O)N 62a_100000747405_100000742221 [0,0,0,0,0,2|2,0,0]=4 3170 B16R1.1330 CCC(=O)CSc1ccccc1OC(=O)C 62a_100000051690_100000747405 [0,0,0,0,0,2|2,0,0]=4 3171 B16R1.1330 CCC(=O)CSc1ccccc1OC(=O)C 62a_100000747405_100000051690 [0,0,0,0,0,2|2,0,0]=4 3172 B16R1.1330 CCC(=O)CSc1cnccc1NC(=O)C 62a_100000747405_100016132053 [0,0,0,0,0,2|2,0,0]=4 3173 B16R1.1330 CNC(=O)C=Cc1ccccc1NC(=O)C 240690a_100102657272_200016992062 [0,0,0,0,0,2|1,0,0]=3 3174 B16R1.1330 CNC(=O)CCc1ccccc1NC(=O)C 11a_100011289560_100015343762 [0,0,0,0,0,2|1,0,0]=3 3175 B16R1.1330 CNC(=O)CCc1ccccc1NC(=O)C 1626a_100011289560_100015343762 [0,0,0,0,0,2|1,0,0]=3 3176 B16R1.1330 CNC(=O)CCc1ccccc1NC(=O)C 22a_100011289560_100000070787 [0,0,0,0,0,2|1,0,0]=3 3177 B16R1.1330 CNC(=O)CCc1ccccc1NC(=O)C 527a_100011289560_100103153847 [0,0,0,0,0,2|1,0,0]=3 3178 B16R1.1330 CNC(=O)CNc1ccccc1NC(=O)C 34a_100011193560_100000183359 [0,0,0,0,0,2|1,0,0]=3 3179 B16R1.1330 CNC(=O)COc1ccccc1NC(=O)C 240690a_100102657272_100011204883 [0,0,0,0,0,2|1,0,0]=3 3180 B16R1.1330 CNC(=O)COc1ccccc1NC(=O)C 34a_100000185124_100000183359 [0,0,0,0,0,2|1,0,0]=3 3181 B16R1.1330 CNC(=O)COc1ccccc1NC(=O)C 527a_100102657272_100011204883 [0,0,0,0,0,2|1,0,0]=3 3182 B16R1.1330 CNC(=O)COc1ccccc1NC(=O)C 7a_100000185124_100000183359 [0,0,0,0,0,2|1,0,0]=3 3183 B16R1.1330 CNC(=O)COc1cccnc1NC(=O)C 34a_200000022013_100000183359 [0,0,0,0,0,2|2,0,0]=4 3184 B16R1.1330 CNC(=O)COc1cccnc1NC(=O)C 7a_200000022013_100000183359 [0,0,0,0,0,2|2,0,0]=4 3185 B16R1.1330 CNC(=O)CSc1ccccc1CC(=O)C 62a_100000183359_100011350739 [0,0,0,0,0,2|2,0,0]=4 3186 B16R1.1330 CNC(=O)CSc1ccccc1CC(=O)C 62a_100011350739_100000183359 [0,0,0,0,0,2|2,0,0]=4 3187 B16R1.1330 CNC(=O)CSc1ccccc1NC(=O)C 240690a_100102657272_100000027783 [0,0,0,0,0,2|1,0,0]=3 3188 B16R1.1330 CNC(=O)CSc1ccccc1NC(=O)C 62a_100000183359_100000153524 [0,0,0,0,0,2|1,0,0]=3 3189 B16R1.1330 CNC(=O)CSc1ccccc1NC(=O)N 62a_100000183359_100000742221 [0,0,0,0,0,2|2,0,0]=4 3190 B16R1.1330 CNC(=O)CSc1ccccc1OC(=O)C 62a_100000051690_100000183359 [0,0,0,0,0,2|2,0,0]=4 3191 B16R1.1330 CNC(=O)CSc1ccccc1OC(=O)C 62a_100000183359_100000051690 [0,0,0,0,0,2|2,0,0]=4 3192 B16R1.1330 CNC(=O)CSc1cnccc1NC(=O)C 62a_100000183359_100016132053 [0,0,0,0,0,2|2,0,0]=4 3193 B16R1.1330 COC(=O)/C=C/c1ccccc1C=C(C)C 271570a_100102525489_100000151022 [0,0,0,0,0,2|2,0,0]=4 3194 B16R1.1330 COC(=O)/C=C/c1ccccc1NC(=O)C 188690a_100016264752_100015343762 [0,0,0,0,0,2|0,0,0]=2 3195 B16R1.1330 COC(=O)CCc1ccccc1C=C(C)C 271570a_100102525489_100009815308 [0,0,0,0,0,2|2,0,0]=4 3196 B16R1.1330 COC(=O)CNc1ccccc1NC(=O)C 34a_100011193560_100000747449 [0,0,0,0,0,2|0,0,0]=2 3197 B16R1.1330 COC(=O)COc1ccccc1C=C(C)C 271570a_100102525489_200000173920 [0,0,0,0,0,2|2,0,0]=4 3198 B16R1.1330 COC(=O)COc1ccccc1NC(=O)C 34a_100000185124_100000747449 [0,0,0,0,0,2|0,0,0]=2 3199 B16R1.1330 COC(=O)COc1ccccc1NC(=O)C 7a_100000185124_100000747449 [0,0,0,0,0,2|0,0,0]=2 3200 B16R1.1330 COC(=O)COc1ccccc1NC(=S)N 7a_200000011649_100000747449 [0,0,0,0,0,2|1,1,0]=4 3201 B16R1.1330 COC(=O)COc1cccnc1NC(=O)C 34a_200000022013_100000747449 [0,0,0,0,0,2|1,0,0]=3 3202 B16R1.1330 COC(=O)COc1cccnc1NC(=O)C 7a_200000022013_100000747449 [0,0,0,0,0,2|1,0,0]=3 3203 B16R1.1330 COC(=O)CSc1ccccc1CC(=O)C 62a_100000747449_100011350739 [0,0,0,0,0,2|1,0,0]=3 3204 B16R1.1330 COC(=O)CSc1ccccc1CC(=O)C 62a_100011350739_100000747449 [0,0,0,0,0,2|1,0,0]=3 3205 B16R1.1330 COC(=O)CSc1ccccc1CC(=O)N 62a_100000747449_200009814924 [0,0,0,0,0,2|2,0,0]=4 3206 B16R1.1330 COC(=O)CSc1ccccc1CC(=O)N 62a_200009814924_100000747449 [0,0,0,0,0,2|2,0,0]=4 3207 B16R1.1330 COC(=O)CSc1ccccc1NC(=O)C 62a_100000747449_100000153524 [0,0,0,0,0,2|0,0,0]=2 3208 B16R1.1330 COC(=O)CSc1ccccc1NC(=O)N 62a_100000747449_100000742221 [0,0,0,0,0,2|1,0,0]=3 3209 B16R1.1330 COC(=O)CSc1ccccc1NC(C)C 62a_100000219599_100000747449 [0,0,0,0,0,2|1,0,1]=4 3210 B16R1.1330 COC(=O)CSc1ccccc1NC(C)C 62a_100000747449_100000219599 [0,0,0,0,0,2|1,0,1]=4 3211 B16R1.1330 COC(=O)CSc1ccccc1OC(=O)C 62a_100000051690_100000747449 [0,0,0,0,0,2|1,0,0]=3 3212 B16R1.1330 COC(=O)CSc1ccccc1OC(=O)C 62a_100000747449_100000051690 [0,0,0,0,0,2|1,0,0]=3 3213 B16R1.1330 COC(=O)CSc1cnccc1NC(=O)C 62a_100000747449_100016132053 [0,0,0,0,0,2|1,0,0]=3 3214 B16R1.1330 COC(=O)CSc1ncccc1OC(=O)C 62a_100000747449_200009815371 [0,0,0,0,0,2|2,0,0]=4 3215 B16R1.1330 COC(=O)CSc1ncccc1OC(=O)C 62a_200009815371_100000747449 [0,0,0,0,0,2|2,0,0]=4